A0A087YEU2_POEFO Loading...

Neural cell adhesion molecule 1a

AlphaFold DB , UniProt , Accession A0A087YEU2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 853 aa.

						>A0A087YEU2_POEFO|A0A087YEU2
RKQTNVYFSVSSFLHSAAIQVQITPAQGEISVGESKFFLCEVVGDAKDIDWFSPSGEKILLSRPNISVSRSDESTSILTIYHANVDNAGIYKCLAKNADKEAQATVQVKIFQKITFQSAPSPQEFNEGDNADIVCDVVSSPPPTIIWKHKGSKLQSAKDVRYKIMDNGHLLIRGIKKVDEGMYNCEARVMARGEIDFRMIKVIVNVLPTIRARKSEVNATADVGESALLACDADGFPEPTVTWAQDKQKVVTEEDDDKYSLNEDGSELVIKEVRKVDEGDYTCIAKNKAGEKTEEVSLNVFVLPNITYFNNQTASEFDDEVTLTCEASGDPTPTISWRFGNRVFTEGEQASWTRPDKYESLDRNVVVRSHARVSSLTLKDVQFTDAGRYLCTASNSIGEDNQQLFLEVRYSPKIMGLVVAHTWEGNPANISCEVAANPRASVVWFRDGIELPTANSTNIKIFNTPTISILEITPESQNDFGSYNCTATNVIGSESKEFILIQAEVPSSPKIEEVQPFSSTAVVEFEEPNSLGGVPILKYRVEWRLPGKEWKSKEYKAEDGEHMTRITIVGLKPETTYEVKMSAINGKGEGESSRSSTFKTEPVREPTSPILEVILVKSSNSAKVKWTKQDDGGSPIIRYLIRYKAKHMSDWKPETHLPSTSNYAMLSGLDWNTDYEVRVVAENQRGRSEPSITSFRTASEPTTVPDTADGGSGLGTGAIVGILIVVFLLLLVAVDVTCYFLNKCGLLMCIAVNVCGKAGPGAKSKDIEEGKAAFSKDESKEPIVEVRTKEENTPNQEGGGPTEPNETTPLTEPDGKTVKSDNAKAEPEVKNATAEVKTVPNEAPRANGNESKA
					

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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	R	35.9	Very low	37.1	Very low	292 Å²	292	160.9 Å²	160.9	100%	1.102	80%	0.802	S	S	*	*				0	100.7	0	-171.3	-175.4	-165	-172.7	6.2	105.9
2	K	38.1	Very low	37.4	Very low	186 Å²	186	156.6 Å²	156.6	81%	0.809	80%	0.799	S	S	*	*			trans	65.4	152.5	-162.6	-60.6	-179.4	160.3	-163.8	0	113.6
3	Q	36.2	Very low	37.6	Very low	145 Å²	145	158.4 Å²	158.4	68%	0.678	80%	0.798	S	S	*	*			cis	-155.1	155.9	-18.1	-118.8	170.6	-90	0	0	111
4	T	38.4	Very low	38	Very low	106 Å²	106	159.1 Å²	159.1	65%	0.65	80%	0.804	S	S	*	*			trans	14	128.7	154.5	44.8	0	0	0	0	120.5
5	N	35.8	Very low	38.4	Very low	147 Å²	147	160.1 Å²	160.1	79%	0.786	81%	0.805	S	S	*	*				58.4	138.5	78.5	-63.7	-3.7	0	0	0	113.3
6	V	36.9	Very low	39.3	Very low	133 Å²	133	155.6 Å²	155.6	81%	0.806	79%	0.792	S	S	*	*			cis	-142.9	163.9	33.2	179.7	0	0	0	0	112.2
7	Y	40.5	Very low	40.4	Very low	210 Å²	210	150.6 Å²	150.6	82%	0.824	78%	0.781	S	S	*	*			trans	-65.1	161.7	172.7	-73.6	-109.9	0	0	0	115.1
8	F	33.3	Very low	42	Very low	209 Å²	209	146.2 Å²	146.2	92%	0.917	77%	0.77	S	S	*	*				-152.5	152.9	117.2	-111.4	-73.1	0	0	0	111.4
9	S	39.1	Very low	44	Very low	97 Å²	97	139.4 Å²	139.4	68%	0.678	73%	0.734	S	S	*	*			trans	-112.3	141.4	-171.9	56.2	0	0	0	0	113.3
10	V	36.6	Very low	46.1	Very low	145 Å²	145	139 Å²	139	88%	0.879	73%	0.728	S	S	*	*			trans	-131.3	124.5	152.9	-178.1	0	0	0	0	107.9
11	S	37.4	Very low	48.1	Very low	100 Å²	100	133.6 Å²	133.6	70%	0.699	70%	0.7	S	S	*	*			trans	-92.4	120.2	-179.9	53.3	0	0	0	0	111.4
12	S	41.2	Very low	50.8	Low	109 Å²	109	124.6 Å²	124.6	76%	0.762	67%	0.671	S	S	*	*			trans	-112.5	112.8	167.6	43.2	0	0	0	0	110.2	L14	S12-L14 PolarHBondContact O-N 2.82Å
13	F	39.6	Very low	53.4	Low	180 Å²	180	116.3 Å²	116.3	79%	0.789	64%	0.636	S	S	*	*			trans	-76.5	101.5	176.7	-84.5	-97.8	0	0	0	110.8	H15	F13-H15 PolarHBondContact O-N 3.03Å
14	L	42.9	Very low	55.9	Low	168 Å²	168	112.3 Å²	112.3	88%	0.88	62%	0.621	S	S	*	*			trans	-74.4	106	160.9	-80.1	166.4	0	0	0	109.1	S12 S16	S12-L14 PolarHBondContact O-N 2.82Å; L14-S16 PolarHBondContact O-N 3.45Å; L14-S16 VanDerWaalsContact O-N 3.14Å
15	H	44	Very low	58.3	Low	175 Å²	175	109.8 Å²	109.8	81%	0.81	61%	0.606	S	S	*	*			trans	-68	106.3	166.5	-81.7	69.4	0	0	0	108.6	F13 A17	F13-H15 PolarHBondContact O-N 3.03Å; H15-A17 PolarHBondContact O-N 2.91Å
16	S	52.6	Low	60.5	Low	87 Å²	87	106.2 Å²	106.2	61%	0.608	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-66.6	130.5	170.6	57.4	0	0	0	0	109.4	L14 K100	L14-S16 PolarHBondContact O-N 3.45Å; L14-S16 VanDerWaalsContact O-N 3.14Å; S16-K100 PolarHBondContact O-NZ 2.88Å; S16-K100 WeakPolarHBondContact OG-CE 3.46Å; S16-K100 PolarHBondContact OG-NZ 3.47Å
17	A	58.7	Low	62.7	Low	72 Å²	72	106.3 Å²	106.3	60%	0.595	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-54.6	153.8	179.1	0	0	0	0	0	111.9	H15 K100	H15-A17 PolarHBondContact O-N 2.91Å; A17-K100 PolarHBondContact O-NZ 2.78Å
18	A	69.1	Low	64.8	Low	71 Å²	71	96.4 Å²	96.4	59%	0.587	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-71.9	134.1	168.2	0	0	0	0	0	108.9	Q20	A18-Q20 PolarHBondContact O-N 2.77Å
19	I	80.8	Confident	67.3	Low	16 Å²	16	89.9 Å²	89.9	8%	0.082	52%	0.523	C	S	.	.	P	Polyproline II helix	trans	-66.9	130.7	171.7	-53.5	175.7	0	0	0	107.2	V21 V42 V43 A46 A95 N97 K100 A102	I19-V21 HydrophobicContact CG2-CG2 4.48Å; I19-V42 HydrophobicContact CG2-CG1 3.73Å; I19-V43 WeakPolarHBondContact CA-O 3.48Å; I19-A46 HydrophobicContact CD1-CB 4.2Å; I19-A46 HydrophobicContact CG2-CB 4.13Å; I19-A95 HydrophobicContact CG2-CB 4.12Å; I19-N97 HydrophobicContact CD1-CB 3.93Å; I19-K100 HydrophobicContact CD1-CB 3.76Å; I19-K100 HydrophobicContact CG1-CB 4.26Å; I19-A102 HydrophobicContact CB-CB 4.02Å; I19-A102 HydrophobicContact CG2-CB 3.95Å; I19-A102 VanDerWaalsContact O-CB 3.23Å; I19-A102 WeakPolarHBondContact O-CB 3.18Å
20	Q	84.4	Confident	69.7	Low	132 Å²	132	85.4 Å²	85.4	62%	0.617	49%	0.491	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.1	145.9	170.7	-65.8	-171	-20.4	0	0	109.5	A18 V42 V43	A18-Q20 PolarHBondContact O-N 2.77Å; Q20-V42 WeakPolarHBondContact O-CA 3.48Å; Q20-V43 HydrophobicContact CB-CB 4.46Å; Q20-V43 PolarHBondContact N-O 2.7Å; Q20-V43 PolarHBondContact O-N 3.22Å
21	V	89.6	Confident	72.1	Confident	25 Å²	25	78.7 Å²	78.7	15%	0.152	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	132.5	-179.4	-174.8	0	0	0	0	108.1	I19 C40 V42 C93 A95 A102 A104	I19-V21 HydrophobicContact CG2-CG2 4.48Å; V21-C40 WeakPolarHBondContact CG1-SG 3.24Å; V21-V42 HydrophobicContact CG1-CG2 4.41Å; V21-V42 HydrophobicContact CG2-CG1 4.4Å; V21-V42 HydrophobicContact CG2-CG2 4.24Å; V21-C93 HydrophobicContact CG1-CB 4.31Å; V21-A95 HydrophobicContact CG2-CB 3.54Å; V21-A102 HydrophobicContact CG2-CB 3.85Å; V21-A102 WeakPolarHBondContact CG2-O 3.46Å; V21-A104 HydrophobicContact CB-CB 4.19Å; V21-A104 HydrophobicContact CG1-CB 3.8Å
22	Q	91.2	Very high	74.5	Confident	103 Å²	103	77.2 Å²	77.2	48%	0.481	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	152.4	171.3	66.1	-174	22.4	0	0	110.1	C40 E41	Q22-C40 WeakPolarHBondContact O-CA 3.43Å; Q22-E41 HydrophobicContact CG-CB 3.85Å; Q22-E41 PolarHBondContact N-O 3.1Å; Q22-E41 PolarHBondContact NE2-OE2 3.46Å; Q22-E41 PolarHBondContact O-N 2.98Å
23	I	92.6	Very high	76.6	Confident	13 Å²	13	73.8 Å²	73.8	7%	0.067	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	126.7	172.7	-66.5	164.9	0	0	0	109.2	P25 A26 F38 L39 C40 W51 C93 A104 V106	I23-P25 CarbonylContact O-C 3.47Å; I23-P25 VanDerWaalsContact O-C 3.31Å; I23-A26 WeakPolarHBondContact O-CA 3.5Å; I23-A26 PolarHBondContact O-N 3.18Å; I23-A26 VanDerWaalsContact O-N 3.14Å; I23-F38 HydrophobicContact CG2-CB 4.07Å; I23-F38 HydrophobicContact CG2-CD1 4.5Å; I23-L39 CarbonylContact C-O 3.59Å; I23-L39 VanDerWaalsContact CA-O 3.25Å; I23-L39 WeakPolarHBondContact CA-O 3.49Å; I23-C40 HydrophobicContact CG1-CB 4.31Å; I23-W51 HydrophobicContact CD1-CH2 3.66Å; I23-W51 HydrophobicContact CD1-CZ3 3.8Å; I23-W51 HydrophobicContact CG1-CH2 3.85Å; I23-W51 HydrophobicContact CG1-CZ2 4.44Å; I23-W51 HydrophobicContact CG1-CZ3 4.48Å; I23-W51 HydrophobicContact CG2-CH2 3.91Å; I23-C93 HydrophobicContact CD1-CB 3.91Å; I23-C93 HydrophobicContact CG1-CB 4.17Å; I23-A104 HydrophobicContact CD1-CB 3.78Å; I23-A104 WeakPolarHBondContact CD1-O 3.34Å; I23-A104 HydrophobicContact CG1-CB 3.85Å; I23-V106 HydrophobicContact CD1-CB 4.33Å; I23-V106 HydrophobicContact CD1-CG1 4.24Å; I23-V106 HydrophobicContact CG2-CB 3.87Å; I23-V106 HydrophobicContact CG2-CG1 3.99Å; I23-V106 HydrophobicContact CG2-CG2 4.45Å
24	T	90.1	Very high	78.9	Confident	60 Å²	60	69 Å²	69	37%	0.368	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	116.8	-177.4	-58.8	0	0	0	0	109	L39 E41	T24-L39 PolarHBondContact N-O 2.86Å; T24-L39 PolarHBondContact O-N 2.83Å; T24-E41 PolarHBondContact OG1-OE2 3.22Å
25	P	88.8	Confident	81.2	Confident	53 Å²	53	63.9 Å²	63.9	34%	0.344	38%	0.378	S	S	.	.	S	Bend	cis	-76	148.5	-5.3	32.7	-35.8	0	0	0	113	I23 Q27 F38	I23-P25 CarbonylContact O-C 3.47Å; I23-P25 VanDerWaalsContact O-C 3.31Å; P25-Q27 PolarHBondContact O-N 3.1Å; P25-Q27 VanDerWaalsContact O-N 3.1Å; P25-F38 HydrophobicContact CG-CD1 4.08Å; P25-F38 HydrophobicContact CG-CE1 4.07Å
26	A	82.3	Confident	83.4	Confident	72 Å²	72	58.8 Å²	58.8	60%	0.595	35%	0.353	S	S	*	.	S	Bend	trans	-68.7	-6.4	-178.9	0	0	0	0	0	115.2	I23	I23-A26 WeakPolarHBondContact O-CA 3.5Å; I23-A26 PolarHBondContact O-N 3.18Å; I23-A26 VanDerWaalsContact O-N 3.14Å
27	Q	81.6	Confident	85.3	Confident	136 Å²	136	60.1 Å²	60.1	64%	0.636	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.1	141.8	172.8	-64.8	-170.7	8.9	0	0	110.9	P25	P25-Q27 PolarHBondContact O-N 3.1Å; P25-Q27 VanDerWaalsContact O-N 3.1Å
28	G	84.4	Confident	86.9	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.01	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	71.4	-166.5	0	0	0	0	0	115.6	F38 Q107 V108 K109	G28-F38 VanDerWaalsContact CA-CZ 3.46Å; G28-Q107 PolarHBondContact N-O 2.96Å; G28-V108 CarbonylContact O-C 3.57Å; G28-V108 VanDerWaalsContact O-CA 3.24Å; G28-V108 WeakPolarHBondContact O-CA 3.44Å; G28-K109 PolarHBondContact O-N 3.18Å
29	E	87.3	Confident	87.9	Confident	73 Å²	73	55.4 Å²	55.4	34%	0.341	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	130.4	170.6	-49.2	-157.4	154.5	0	0	110.8	K36 K109 F111	E29-K36 WeakPolarHBondContact O-CD 3.49Å; E29-K36 PolarHBondContact O-NZ 2.82Å; E29-K109 WeakPolarHBondContact CA-O 3.39Å; E29-K109 HydrophobicContact CG-CB 4.41Å; E29-K109 HydrophobicContact CG-CD 4.42Å; E29-K109 WeakPolarHBondContact OE1-CD 3.34Å; E29-K109 WeakPolarHBondContact OE1-CE 3.44Å; E29-K109 IonicContact OE1-NZ 3.87Å; E29-K109 PolarHBondContact OE1-NZ 3.44Å; E29-F111 HydrophobicContact CB-CD1 4.25Å; E29-F111 HydrophobicContact CB-CE1 3.89Å
30	I	88.8	Confident	88.4	Confident	3 Å²	3	54.6 Å²	54.6	2%	0.015	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	139	-177.7	-36.4	177.3	0	0	0	109.4	E34 K36 F38 I80 A83 V108 K109 I110 F111	I30-E34 HydrophobicContact CG2-CB 4.06Å; I30-K36 HydrophobicContact CD1-CB 3.88Å; I30-K36 HydrophobicContact CD1-CD 4.45Å; I30-K36 HydrophobicContact CG1-CB 3.99Å; I30-K36 HydrophobicContact CG1-CD 3.83Å; I30-K36 HydrophobicContact CG2-CB 4.07Å; I30-F38 HydrophobicContact CD1-CE2 4.29Å; I30-F38 HydrophobicContact CD1-CZ 4.37Å; I30-I80 HydrophobicContact CD1-CB 4.32Å; I30-I80 HydrophobicContact CD1-CD1 4.03Å; I30-A83 HydrophobicContact CB-CB 4.35Å; I30-A83 HydrophobicContact CD1-CB 4.37Å; I30-A83 HydrophobicContact CG2-CB 3.9Å; I30-V108 HydrophobicContact CD1-CG1 3.8Å; I30-V108 HydrophobicContact CG1-CG1 4.27Å; I30-K109 PolarHBondContact N-O 2.79Å; I30-I110 HydrophobicContact CB-CD1 3.82Å; I30-I110 HydrophobicContact CD1-CD1 3.9Å; I30-I110 HydrophobicContact CG1-CD1 4.05Å; I30-I110 WeakPolarHBondContact O-CA 3.16Å; I30-F111 VanDerWaalsContact C-CE1 3.43Å; I30-F111 VanDerWaalsContact O-CD1 3.25Å; I30-F111 WeakPolarHBondContact O-CD1 3.47Å; I30-F111 WeakPolarHBondContact O-CE1 3.35Å; I30-F111 PolarHBondContact O-N 2.81Å
31	S	87.3	Confident	88.7	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.021	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	150.6	171.1	-36.3	0	0	0	0	111.3	G33 E34 F111 K113	S31-G33 PolarHBondContact O-N 3.39Å; S31-E34 VanDerWaalsContact CB-CD 3.41Å; S31-E34 WeakPolarHBondContact CB-OE2 3.01Å; S31-E34 PolarHBondContact N-OE2 3.19Å; S31-E34 WeakPolarHBondContact O-CB 3.43Å; S31-E34 PolarHBondContact O-N 2.7Å; S31-E34 VanDerWaalsContact O-N 3.09Å; S31-E34 PolarHBondContact OG-OE1 2.87Å; S31-E34 PolarHBondContact OG-OE2 2.89Å; S31-F111 CarbonylContact C-O 3.54Å; S31-F111 VanDerWaalsContact CA-O 3.25Å; S31-F111 WeakPolarHBondContact CA-O 3.27Å; S31-F111 WeakPolarHBondContact OG-CE2 3.33Å; S31-F111 VanDerWaalsContact OG-CZ 3.28Å; S31-F111 WeakPolarHBondContact OG-CZ 3.44Å; S31-K113 WeakPolarHBondContact OG-CD 3.32Å; S31-K113 WeakPolarHBondContact OG-CE 3.21Å; S31-K113 PolarHBondContact OG-NZ 2.86Å
32	V	87.6	Confident	88.7	Confident	69 Å²	69	50.5 Å²	50.5	42%	0.418	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	129.2	169	174.2	0	0	0	0	109.9	E34 A83 I110 F111 Q112	V32-E34 VanDerWaalsContact C-N 3.31Å; V32-E34 PolarHBondContact O-N 3.23Å; V32-A83 CarbonylContact C-O 3.55Å; V32-A83 VanDerWaalsContact CA-O 3.28Å; V32-A83 WeakPolarHBondContact CA-O 3.37Å; V32-I110 HydrophobicContact CG2-CG2 3.69Å; V32-F111 PolarHBondContact N-O 2.9Å; V32-Q112 HydrophobicContact CG2-CB 4.35Å
33	G	84.5	Confident	88.3	Confident	38 Å²	38	50 Å²	50	39%	0.392	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.2	-11.3	-178.9	0	0	0	0	0	115.7	S31 H82 A83	S31-G33 PolarHBondContact O-N 3.39Å; G33-H82 PolarHBondContact O-ND1 2.8Å; G33-A83 PolarHBondContact N-O 3.49Å
34	E	88.6	Confident	87.4	Confident	80 Å²	80	51.2 Å²	51.2	37%	0.374	30%	0.298	S	S	.	.			trans	-83	162.5	172.8	-72.9	179.7	167.4	0	0	112.3	I30 S31 V32 H82 A83 K113	I30-E34 HydrophobicContact CG2-CB 4.06Å; S31-E34 VanDerWaalsContact CB-CD 3.41Å; S31-E34 WeakPolarHBondContact CB-OE2 3.01Å; S31-E34 PolarHBondContact N-OE2 3.19Å; S31-E34 WeakPolarHBondContact O-CB 3.43Å; S31-E34 PolarHBondContact O-N 2.7Å; S31-E34 VanDerWaalsContact O-N 3.09Å; S31-E34 PolarHBondContact OG-OE1 2.87Å; S31-E34 PolarHBondContact OG-OE2 2.89Å; V32-E34 VanDerWaalsContact C-N 3.31Å; V32-E34 PolarHBondContact O-N 3.23Å; E34-H82 WeakPolarHBondContact O-CA 3.35Å; E34-H82 PolarHBondContact O-N 3.29Å; E34-A83 PolarHBondContact O-N 2.97Å; E34-K113 IonicContact OE1-NZ 2.65Å; E34-K113 PolarHBondContact OE1-NZ 2.98Å; E34-K113 IonicContact OE2-NZ 2.68Å
35	S	90.5	Very high	86.6	Confident	60 Å²	60	54.4 Å²	54.4	42%	0.42	31%	0.313	S	S	.	.			trans	-117	138	178.1	-56	0	0	0	0	110	I80 Y81 H82	S35-I80 CarbonylContact C-O 3.52Å; S35-I80 WeakPolarHBondContact CA-O 3.38Å; S35-I80 WeakPolarHBondContact CB-O 3.25Å; S35-Y81 WeakPolarHBondContact OG-CA 3.37Å; S35-H82 PolarHBondContact OG-N 3.05Å; S35-H82 VanDerWaalsContact OG-N 3.11Å
36	K	91.5	Very high	85.9	Confident	68 Å²	68	52.6 Å²	52.6	30%	0.296	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	146.9	-179.6	-160.5	177	-167	178.6	0	111.1	E29 I30 F38 I80	E29-K36 WeakPolarHBondContact O-CD 3.49Å; E29-K36 PolarHBondContact O-NZ 2.82Å; I30-K36 HydrophobicContact CD1-CB 3.88Å; I30-K36 HydrophobicContact CD1-CD 4.45Å; I30-K36 HydrophobicContact CG1-CB 3.99Å; I30-K36 HydrophobicContact CG1-CD 3.83Å; I30-K36 HydrophobicContact CG2-CB 4.07Å; K36-F38 HydrophobicContact CD-CZ 4.18Å; K36-I80 PolarHBondContact N-O 2.62Å; K36-I80 PolarHBondContact O-N 3.06Å
37	F	91.3	Very high	85.5	Confident	114 Å²	114	56.2 Å²	56.2	50%	0.5	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	156.8	177.2	63.5	-90.6	0	0	0	112.6	L39 I77 L78 T79	F37-L39 HydrophobicContact CD2-CD1 4.21Å; F37-L39 HydrophobicContact CD2-CG 4.48Å; F37-L39 HydrophobicContact CE2-CD1 3.91Å; F37-I77 HydrophobicContact CB-CG2 3.79Å; F37-I77 HydrophobicContact CD2-CG2 4.24Å; F37-I77 HydrophobicContact CG-CG2 4.36Å; F37-L78 CarbonylContact C-O 3.54Å; F37-L78 WeakPolarHBondContact CA-O 3Å; F37-T79 HydrophobicContact CB-CG2 4.26Å
38	F	92.5	Very high	85.6	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	120.3	176.7	-58.3	-83.8	0	0	0	108.2	I23 P25 G28 I30 K36 W51 I77 L78 I80 V106 V108	I23-F38 HydrophobicContact CG2-CB 4.07Å; I23-F38 HydrophobicContact CG2-CD1 4.5Å; P25-F38 HydrophobicContact CG-CD1 4.08Å; P25-F38 HydrophobicContact CG-CE1 4.07Å; G28-F38 VanDerWaalsContact CA-CZ 3.46Å; I30-F38 HydrophobicContact CD1-CE2 4.29Å; I30-F38 HydrophobicContact CD1-CZ 4.37Å; K36-F38 HydrophobicContact CD-CZ 4.18Å; F38-W51 HydrophobicContact CB-CH2 3.87Å; F38-W51 HydrophobicContact CB-CZ2 4.22Å; F38-I77 WeakPolarHBondContact O-CA 3.36Å; F38-L78 HydrophobicContact CB-CB 4.49Å; F38-L78 HydrophobicContact CD2-CD2 4.25Å; F38-L78 PolarHBondContact N-O 3.45Å; F38-L78 PolarHBondContact O-N 2.75Å; F38-I80 HydrophobicContact CE2-CD1 4.26Å; F38-V106 HydrophobicContact CD1-CG1 4.25Å; F38-V106 HydrophobicContact CD1-CG2 3.91Å; F38-V106 HydrophobicContact CE1-CG2 3.85Å; F38-V106 HydrophobicContact CG-CG1 4.34Å; F38-V108 HydrophobicContact CE2-CG2 3.87Å; F38-V108 HydrophobicContact CZ-CG2 3.86Å
39	L	91.5	Very high	85.8	Confident	44 Å²	44	54.5 Å²	54.5	23%	0.23	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	131.6	171.3	-60.7	115.1	0	0	0	108.6	I23 T24 F37 E41 T75 I77	I23-L39 CarbonylContact C-O 3.59Å; I23-L39 VanDerWaalsContact CA-O 3.25Å; I23-L39 WeakPolarHBondContact CA-O 3.49Å; T24-L39 PolarHBondContact N-O 2.86Å; T24-L39 PolarHBondContact O-N 2.83Å; F37-L39 HydrophobicContact CD2-CD1 4.21Å; F37-L39 HydrophobicContact CD2-CG 4.48Å; F37-L39 HydrophobicContact CE2-CD1 3.91Å; L39-E41 HydrophobicContact CB-CG 4.41Å; L39-T75 HydrophobicContact CD2-CG2 3.98Å; L39-I77 HydrophobicContact CD2-CD1 4.06Å; L39-I77 HydrophobicContact CD2-CG1 3.98Å; L39-I77 HydrophobicContact CG-CG1 4.22Å
40	C	91.2	Very high	85.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	116.3	161.6	173.6	0	0	0	0	107.9	V21 Q22 I23 W51 T75 S76 C93	V21-C40 WeakPolarHBondContact CG1-SG 3.24Å; Q22-C40 WeakPolarHBondContact O-CA 3.43Å; I23-C40 HydrophobicContact CG1-CB 4.31Å; C40-W51 HydrophobicContact CB-CH2 4.34Å; C40-W51 HydrophobicContact CB-CZ2 3.47Å; C40-W51 VanDerWaalsContact CB-CZ2 3.47Å; C40-T75 CarbonylContact O-C 3.59Å; C40-T75 WeakPolarHBondContact O-CA 3.46Å; C40-S76 WeakPolarHBondContact CB-O 3.31Å; C40-S76 PolarHBondContact N-O 2.85Å; C40-S76 PolarHBondContact O-N 2.89Å; C40-C93 HydrophobicContact CB-CB 3.6Å; C40-C93 WeakPolarHBondContact CB-SG 3.4Å; C40-C93 WeakPolarHBondContact SG-CB 3.03Å; C40-C93 CovalentContact SG-SG 2.02Å; C40-C93 PolarHBondContact SG-SG 2.86Å
41	E	90.8	Very high	86.1	Confident	61 Å²	61	52.5 Å²	52.5	29%	0.285	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	133.8	-179.2	-60.2	164.1	116.4	0	0	108.5	Q22 T24 L39 T75	Q22-E41 HydrophobicContact CG-CB 3.85Å; Q22-E41 PolarHBondContact N-O 3.1Å; Q22-E41 PolarHBondContact NE2-OE2 3.46Å; Q22-E41 PolarHBondContact O-N 2.98Å; T24-E41 PolarHBondContact OG1-OE2 3.22Å; L39-E41 HydrophobicContact CB-CG 4.41Å; E41-T75 HydrophobicContact CG-CG2 4.21Å
42	V	88.1	Confident	86.3	Confident	10 Å²	10	54.2 Å²	54.2	6%	0.061	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	127.6	-174.2	-174.9	0	0	0	0	110.4	I19 Q20 V21 A46 I49 S74 A95	I19-V42 HydrophobicContact CG2-CG1 3.73Å; Q20-V42 WeakPolarHBondContact O-CA 3.48Å; V21-V42 HydrophobicContact CG1-CG2 4.41Å; V21-V42 HydrophobicContact CG2-CG1 4.4Å; V21-V42 HydrophobicContact CG2-CG2 4.24Å; V42-A46 HydrophobicContact CG1-CB 3.72Å; V42-I49 HydrophobicContact CB-CD1 4.14Å; V42-I49 HydrophobicContact CG2-CD1 3.67Å; V42-I49 HydrophobicContact CG2-CG1 4Å; V42-I49 HydrophobicContact CG2-CG2 4.16Å; V42-S74 WeakPolarHBondContact CB-O 3.5Å; V42-S74 PolarHBondContact N-O 2.03Å; V42-S74 WeakPolarHBondContact O-CB 3.3Å; V42-A95 HydrophobicContact CB-CB 4.42Å; V42-A95 HydrophobicContact CG1-CB 3.71Å; V42-A95 HydrophobicContact CG2-CB 3.76Å
43	V	82.7	Confident	86.3	Confident	92 Å²	92	51.2 Å²	51.2	56%	0.558	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.8	119.7	178.3	-177.5	0	0	0	0	109.1	I19 Q20	I19-V43 WeakPolarHBondContact CA-O 3.48Å; Q20-V43 HydrophobicContact CB-CB 4.46Å; Q20-V43 PolarHBondContact N-O 2.7Å; Q20-V43 PolarHBondContact O-N 3.22Å
44	G	74.1	Confident	86.5	Confident	39 Å²	39	52.2 Å²	52.2	40%	0.402	28%	0.28	S	S	.	.	S	Bend	trans	115	170.6	-173.4	0	0	0	0	0	112.3	A46	G44-A46 PolarHBondContact O-N 3.04Å
45	D	73.3	Confident	86.3	Confident	126 Å²	126	52.2 Å²	52.2	67%	0.674	29%	0.289	S	S	*	.			trans	-74.5	104.8	177.9	176.9	23.9	0	0	0	110.4	N97	D45-N97 WeakPolarHBondContact O-CB 3.29Å; D45-N97 PolarHBondContact O-ND2 3.43Å; D45-N97 PolarHBondContact OD1-ND2 2.84Å; D45-N97 PolarHBondContact OD2-ND2 2.74Å
46	A	75.1	Confident	86	Confident	15 Å²	15	52 Å²	52	12%	0.124	30%	0.297	C	S	.	.			trans	-132.8	127.2	177.3	0	0	0	0	0	110	I19 V42 G44 A95 K96	I19-A46 HydrophobicContact CD1-CB 4.2Å; I19-A46 HydrophobicContact CG2-CB 4.13Å; V42-A46 HydrophobicContact CG1-CB 3.72Å; G44-A46 PolarHBondContact O-N 3.04Å; A46-A95 HydrophobicContact CB-CB 4.1Å; A46-K96 CarbonylContact C-O 3.53Å
47	K	73.3	Confident	85.7	Confident	149 Å²	149	53.5 Å²	53.5	65%	0.648	30%	0.304	S	S	*	.	S	Bend	trans	-88.7	-42.6	-172.2	-169.3	175.7	-177	179	0	112.2	R70 K96	K47-R70 PolarHBondContact O-NH2 2.86Å; K47-K96 PolarHBondContact N-O 3.01Å
48	D	83.8	Confident	85.5	Confident	88 Å²	88	52.3 Å²	52.3	47%	0.471	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131.2	-177.9	-60.3	-54.8	0	0	0	109.5	A95 K96	D48-A95 CarbonylContact O-C 3.59Å; D48-A95 WeakPolarHBondContact O-CA 3.47Å; D48-K96 PolarHBondContact N-O 2.91Å; D48-K96 PolarHBondContact O-N 2.9Å
49	I	89	Confident	85.2	Confident	13 Å²	13	52.8 Å²	52.8	7%	0.067	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	110.5	178.3	-56.8	172.9	0	0	0	107	V42 E73 A95	V42-I49 HydrophobicContact CB-CD1 4.14Å; V42-I49 HydrophobicContact CG2-CD1 3.67Å; V42-I49 HydrophobicContact CG2-CG1 4Å; V42-I49 HydrophobicContact CG2-CG2 4.16Å; I49-E73 VanDerWaalsContact CD1-O 3.29Å; I49-E73 WeakPolarHBondContact CD1-O 3.38Å; I49-A95 HydrophobicContact CG1-CB 4.36Å
50	D	89.4	Confident	84.4	Confident	31 Å²	31	56.5 Å²	56.5	17%	0.166	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	130.8	-168.7	-76.9	-21.2	0	0	0	112.1	F52 K58 C93 L94	D50-F52 HydrophobicContact CB-CD2 4.3Å; D50-F52 HydrophobicContact CB-CE2 3.56Å; D50-F52 HydrophobicContact CB-CZ 4.26Å; D50-K58 HydrophobicContact CB-CD 4.46Å; D50-K58 WeakPolarHBondContact OD1-CE 3.49Å; D50-K58 IonicContact OD1-NZ 2.65Å; D50-K58 PolarHBondContact OD1-NZ 2.94Å; D50-K58 VanDerWaalsContact OD2-CE 3.29Å; D50-K58 WeakPolarHBondContact OD2-CE 3.38Å; D50-K58 IonicContact OD2-NZ 3.22Å; D50-K58 PolarHBondContact OD2-NZ 2.8Å; D50-C93 CarbonylContact O-C 3.58Å; D50-C93 WeakPolarHBondContact O-CA 3.26Å; D50-L94 PolarHBondContact N-O 2.83Å; D50-L94 PolarHBondContact O-N 3.17Å
51	W	91.6	Very high	83	Confident	3 Å²	3	63 Å²	63	1%	0.011	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	137.5	169.1	-79.5	97.6	0	0	0	111.7	I23 F38 C40 I59 V68 S76 L78 K92 C93 V106	I23-W51 HydrophobicContact CD1-CH2 3.66Å; I23-W51 HydrophobicContact CD1-CZ3 3.8Å; I23-W51 HydrophobicContact CG1-CH2 3.85Å; I23-W51 HydrophobicContact CG1-CZ2 4.44Å; I23-W51 HydrophobicContact CG1-CZ3 4.48Å; I23-W51 HydrophobicContact CG2-CH2 3.91Å; F38-W51 HydrophobicContact CB-CH2 3.87Å; F38-W51 HydrophobicContact CB-CZ2 4.22Å; C40-W51 HydrophobicContact CB-CH2 4.34Å; C40-W51 HydrophobicContact CB-CZ2 3.47Å; C40-W51 VanDerWaalsContact CB-CZ2 3.47Å; W51-I59 HydrophobicContact CB-CD1 4.4Å; W51-I59 PolarHBondContact O-N 3.26Å; W51-V68 HydrophobicContact CB-CG1 4.41Å; W51-V68 HydrophobicContact CB-CG2 3.9Å; W51-V68 HydrophobicContact CG-CG1 4.35Å; W51-V68 HydrophobicContact CG-CG2 4.26Å; W51-S76 PolarHBondContact NE1-O 2.85Å; W51-L78 HydrophobicContact CD2-CB 3.7Å; W51-L78 HydrophobicContact CD2-CD2 4.2Å; W51-L78 HydrophobicContact CD2-CG 4.41Å; W51-L78 HydrophobicContact CE3-CB 4.06Å; W51-L78 HydrophobicContact CE3-CD2 3.71Å; W51-L78 HydrophobicContact CE3-CG 4.41Å; W51-L78 HydrophobicContact CG-CB 4.15Å; W51-L78 HydrophobicContact CH2-CB 4.04Å; W51-L78 HydrophobicContact CH2-CD2 4.15Å; W51-L78 HydrophobicContact CZ2-CB 3.69Å; W51-L78 HydrophobicContact CZ3-CB 4.23Å; W51-L78 HydrophobicContact CZ3-CD2 3.69Å; W51-K92 CarbonylContact C-O 3.45Å; W51-K92 WeakPolarHBondContact CA-O 3.4Å; W51-C93 HydrophobicContact CD2-CB 4.03Å; W51-C93 HydrophobicContact CE3-CB 4.06Å; W51-C93 HydrophobicContact CH2-CB 4.3Å; W51-C93 HydrophobicContact CZ2-CB 4.25Å; W51-C93 HydrophobicContact CZ3-CB 4.19Å; W51-V106 HydrophobicContact CH2-CG1 4.29Å; W51-V106 HydrophobicContact CZ3-CG1 4.09Å
52	F	91.3	Very high	81.5	Confident	38 Å²	38	65 Å²	65	17%	0.167	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	141.7	176.7	-64.7	-104.5	0	0	0	110.2	D50 G56 E57 K58 Y91 K92 L94	D50-F52 HydrophobicContact CB-CD2 4.3Å; D50-F52 HydrophobicContact CB-CE2 3.56Å; D50-F52 HydrophobicContact CB-CZ 4.26Å; F52-G56 WeakPolarHBondContact CD1-O 3.48Å; F52-E57 CarbonylContact C-O 3.42Å; F52-E57 VanDerWaalsContact CA-O 3.29Å; F52-E57 WeakPolarHBondContact CA-O 3.47Å; F52-K58 HydrophobicContact CD1-CB 4.06Å; F52-K58 HydrophobicContact CE1-CB 3.79Å; F52-K58 HydrophobicContact CZ-CB 4.22Å; F52-Y91 WeakPolarHBondContact O-CA 3.44Å; F52-K92 HydrophobicContact CB-CB 4.29Å; F52-K92 PolarHBondContact N-O 2.84Å; F52-K92 PolarHBondContact O-N 2.94Å; F52-L94 HydrophobicContact CD2-CB 4.21Å; F52-L94 HydrophobicContact CD2-CD2 4.47Å; F52-L94 HydrophobicContact CE2-CB 3.85Å; F52-L94 HydrophobicContact CE2-CD2 3.62Å; F52-L94 HydrophobicContact CE2-CG 4.34Å; F52-L94 HydrophobicContact CZ-CD2 3.95Å
53	S	88.4	Confident	80.7	Confident	6 Å²	6	69.3 Å²	69.3	4%	0.042	39%	0.391	C	S	.	.			trans	-82.8	168.1	178.3	55.5	0	0	0	0	112.2	S55 G56 E57	S53-S55 PolarHBondContact O-N 2.89Å; S53-S55 VanDerWaalsContact O-N 3.11Å; S53-S55 PolarHBondContact OG-OG 3.38Å; S53-G56 WeakPolarHBondContact O-CA 3.32Å; S53-G56 PolarHBondContact O-N 3.35Å; S53-E57 PolarHBondContact N-O 2.82Å; S53-E57 PolarHBondContact OG-O 2.87Å
54	P	88	Confident	80.1	Confident	60 Å²	60	71 Å²	71	39%	0.39	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-21.4	-179.5	-26.5	36.1	0	0	0	115.3	G56 I90 Y91	P54-G56 PolarHBondContact O-N 2.55Å; P54-I90 WeakPolarHBondContact CA-O 3.5Å; P54-Y91 HydrophobicContact CG-CD2 3.97Å; P54-Y91 HydrophobicContact CG-CE1 4.49Å; P54-Y91 HydrophobicContact CG-CE2 3.68Å; P54-Y91 HydrophobicContact CG-CG 4.5Å
55	S	85.3	Confident	80.3	Confident	79 Å²	79	71.7 Å²	71.7	55%	0.552	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-6.8	171.2	50.6	0	0	0	0	114	S53 E57	S53-S55 PolarHBondContact O-N 2.89Å; S53-S55 VanDerWaalsContact O-N 3.11Å; S53-S55 PolarHBondContact OG-OG 3.38Å; S55-E57 WeakPolarHBondContact OG-CG 3.26Å; S55-E57 PolarHBondContact OG-OE2 2.91Å
56	G	82.9	Confident	81	Confident	57 Å²	57	66.1 Å²	66.1	59%	0.588	37%	0.369	S	S	*	.	S	Bend	trans	84.6	4.6	-174.2	0	0	0	0	0	114.6	F52 S53 P54	F52-G56 WeakPolarHBondContact CD1-O 3.48Å; S53-G56 WeakPolarHBondContact O-CA 3.32Å; S53-G56 PolarHBondContact O-N 3.35Å; P54-G56 PolarHBondContact O-N 2.55Å
57	E	86.2	Confident	81.6	Confident	98 Å²	98	66.8 Å²	66.8	46%	0.458	37%	0.373	S	S	.	.			trans	-86	138.9	-179.4	-55.7	168.3	111.7	0	0	112	F52 S53 S55 R63	F52-E57 CarbonylContact C-O 3.42Å; F52-E57 VanDerWaalsContact CA-O 3.29Å; F52-E57 WeakPolarHBondContact CA-O 3.47Å; S53-E57 PolarHBondContact N-O 2.82Å; S53-E57 PolarHBondContact OG-O 2.87Å; S55-E57 WeakPolarHBondContact OG-CG 3.26Å; S55-E57 PolarHBondContact OG-OE2 2.91Å; E57-R63 VanDerWaalsContact CD-NH2 3.34Å; E57-R63 IonicContact OE1-NH2 3.62Å; E57-R63 IonicContact OE2-CZ 3.65Å; E57-R63 IonicContact OE2-NH1 2.74Å; E57-R63 IonicContact OE2-NH2 2.69Å; E57-R63 PolarHBondContact OE2-NH2 2.82Å
58	K	87.4	Confident	82.3	Confident	90 Å²	90	60.6 Å²	60.6	39%	0.391	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-66.9	130.2	173.2	-179.9	172.5	172.9	163.5	0	110.9	D50 F52 L60	D50-K58 HydrophobicContact CB-CD 4.46Å; D50-K58 WeakPolarHBondContact OD1-CE 3.49Å; D50-K58 IonicContact OD1-NZ 2.65Å; D50-K58 PolarHBondContact OD1-NZ 2.94Å; D50-K58 VanDerWaalsContact OD2-CE 3.29Å; D50-K58 WeakPolarHBondContact OD2-CE 3.38Å; D50-K58 IonicContact OD2-NZ 3.22Å; D50-K58 PolarHBondContact OD2-NZ 2.8Å; F52-K58 HydrophobicContact CD1-CB 4.06Å; F52-K58 HydrophobicContact CE1-CB 3.79Å; F52-K58 HydrophobicContact CZ-CB 4.22Å; K58-L60 HydrophobicContact CD-CD2 3.92Å; K58-L60 HydrophobicContact CG-CD2 3.96Å; K58-L60 HydrophobicContact CG-CG 4.33Å; K58-L60 PolarHBondContact O-N 3.03Å; K58-L60 VanDerWaalsContact O-N 3.16Å
59	I	85.8	Confident	82.4	Confident	9 Å²	9	59 Å²	59	5%	0.046	34%	0.343	C	S	.	.			trans	-85.6	90.8	-175.1	-54.9	177.4	0	0	0	109.8	W51 L61 I66 V68 L78 Y91	W51-I59 HydrophobicContact CB-CD1 4.4Å; W51-I59 PolarHBondContact O-N 3.26Å; I59-L61 PolarHBondContact O-N 2.8Å; I59-L61 VanDerWaalsContact O-N 3.1Å; I59-I66 HydrophobicContact CD1-CG2 4.4Å; I59-I66 HydrophobicContact CG2-CG2 4.19Å; I59-V68 HydrophobicContact CB-CG2 3.97Å; I59-V68 HydrophobicContact CG2-CG2 3.67Å; I59-L78 HydrophobicContact CD1-CD1 3.85Å; I59-Y91 HydrophobicContact CD1-CD1 3.92Å; I59-Y91 HydrophobicContact CD1-CE1 4.04Å
60	L	74.6	Confident	82.1	Confident	123 Å²	123	64.3 Å²	64.3	64%	0.644	36%	0.362	S	S	*	.			trans	-84.7	73.2	-178.5	-63.1	176	0	0	0	112.6	K58 S62	K58-L60 HydrophobicContact CD-CD2 3.92Å; K58-L60 HydrophobicContact CG-CD2 3.96Å; K58-L60 HydrophobicContact CG-CG 4.33Å; K58-L60 PolarHBondContact O-N 3.03Å; K58-L60 VanDerWaalsContact O-N 3.16Å; L60-S62 PolarHBondContact O-N 2.87Å; L60-S62 PolarHBondContact O-OG 2.85Å
61	L	62.8	Low	81.5	Confident	135 Å²	135	66.6 Å²	66.6	71%	0.707	38%	0.381	S	S	*	.	S	Bend	trans	57.3	-3.6	160	-97.7	159.2	0	0	0	119.6	I59 V68	I59-L61 PolarHBondContact O-N 2.8Å; I59-L61 VanDerWaalsContact O-N 3.1Å; L61-V68 WeakPolarHBondContact CD2-O 3.3Å
62	S	58.3	Low	80.9	Confident	105 Å²	105	69.7 Å²	69.7	73%	0.734	40%	0.397	S	S	*	.			trans	-150.3	59.9	-167.8	52.3	0	0	0	0	114.6	L60	L60-S62 PolarHBondContact O-N 2.87Å; L60-S62 PolarHBondContact O-OG 2.85Å
63	R	71.1	Confident	80.2	Confident	99 Å²	99	76.1 Å²	76.1	37%	0.374	43%	0.428	S	S	.	.	B	Isolated β-bridge	trans	-106.7	140.1	160.9	-69.9	-174.4	177.1	-171.9	-2.9	108.7	E57 N65 I66	E57-R63 VanDerWaalsContact CD-NH2 3.34Å; E57-R63 IonicContact OE1-NH2 3.62Å; E57-R63 IonicContact OE2-CZ 3.65Å; E57-R63 IonicContact OE2-NH1 2.74Å; E57-R63 IonicContact OE2-NH2 2.69Å; E57-R63 PolarHBondContact OE2-NH2 2.82Å; R63-N65 VanDerWaalsContact C-N 3.26Å; R63-N65 PolarHBondContact O-N 2.81Å; R63-N65 VanDerWaalsContact O-N 3.16Å; R63-I66 HydrophobicContact CB-CB 4.25Å; R63-I66 PolarHBondContact N-O 2.94Å; R63-I66 CarbonylContact O-C 3.57Å; R63-I66 PolarHBondContact O-N 2.88Å; R63-I66 VanDerWaalsContact O-N 3.08Å
64	P	69.5	Low	79.9	Confident	128 Å²	128	78.6 Å²	78.6	83%	0.831	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-33.4	-168.9	22	-33.6	0	0	0	113.8
65	N	79.8	Confident	79.9	Confident	53 Å²	53	76.4 Å²	76.4	28%	0.283	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	4.4	179.8	-67.9	47.7	0	0	0	112.9	R63 I80 Y81 H82	R63-N65 VanDerWaalsContact C-N 3.26Å; R63-N65 PolarHBondContact O-N 2.81Å; R63-N65 VanDerWaalsContact O-N 3.16Å; N65-I80 CarbonylContact O-C 3.6Å; N65-I80 WeakPolarHBondContact O-CA 3.37Å; N65-Y81 WeakPolarHBondContact CB-O 3.41Å; N65-Y81 PolarHBondContact ND2-O 2.77Å; N65-Y81 PolarHBondContact O-N 3.2Å; N65-H82 PolarHBondContact ND2-O 2.89Å; N65-H82 VanDerWaalsContact ND2-O 3.12Å
66	I	86.9	Confident	80.1	Confident	9 Å²	9	72.8 Å²	72.8	5%	0.046	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	118.7	-177.3	-52.3	-178.2	0	0	0	111.4	I59 R63 L78 T79 I80 Y91	I59-I66 HydrophobicContact CD1-CG2 4.4Å; I59-I66 HydrophobicContact CG2-CG2 4.19Å; R63-I66 HydrophobicContact CB-CB 4.25Å; R63-I66 PolarHBondContact N-O 2.94Å; R63-I66 CarbonylContact O-C 3.57Å; R63-I66 PolarHBondContact O-N 2.88Å; R63-I66 VanDerWaalsContact O-N 3.08Å; I66-L78 HydrophobicContact CG2-CD1 3.44Å; I66-L78 VanDerWaalsContact CG2-CD1 3.44Å; I66-T79 CarbonylContact C-O 3.58Å; I66-T79 WeakPolarHBondContact CA-O 3.03Å; I66-I80 HydrophobicContact CG1-CG1 4.33Å; I66-I80 HydrophobicContact CG1-CG2 4.46Å; I66-Y91 HydrophobicContact CD1-CE1 4.04Å; I66-Y91 WeakPolarHBondContact CD1-OH 3.39Å
67	S	87.3	Confident	80.5	Confident	30 Å²	30	71.6 Å²	71.6	21%	0.21	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	157.3	170.6	74.6	0	0	0	0	112	T79 Y81	S67-T79 PolarHBondContact N-O 2.89Å; S67-T79 PolarHBondContact O-N 3.22Å; S67-Y81 WeakPolarHBondContact OG-CE2 3.47Å
68	V	88	Confident	80.7	Confident	18 Å²	18	66.9 Å²	66.9	11%	0.109	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	131.3	169.4	174.7	0	0	0	0	107.9	W51 I59 L61 I77 L78	W51-V68 HydrophobicContact CB-CG1 4.41Å; W51-V68 HydrophobicContact CB-CG2 3.9Å; W51-V68 HydrophobicContact CG-CG1 4.35Å; W51-V68 HydrophobicContact CG-CG2 4.26Å; I59-V68 HydrophobicContact CB-CG2 3.97Å; I59-V68 HydrophobicContact CG2-CG2 3.67Å; L61-V68 WeakPolarHBondContact CD2-O 3.3Å; V68-I77 CarbonylContact C-O 3.58Å; V68-I77 VanDerWaalsContact CA-O 3.32Å; V68-I77 WeakPolarHBondContact CA-O 3.4Å; V68-L78 HydrophobicContact CG2-CD1 3.74Å
69	S	86.1	Confident	80.9	Confident	54 Å²	54	63.6 Å²	63.6	38%	0.378	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	164.6	174.7	61.9	0	0	0	0	111.3	S76 I77	S69-S76 CarbonylContact O-C 3.53Å; S69-S76 VanDerWaalsContact O-CA 3.22Å; S69-S76 WeakPolarHBondContact O-CA 3.47Å; S69-S76 WeakPolarHBondContact O-CB 3.43Å; S69-S76 PolarHBondContact O-OG 2.93Å; S69-I77 PolarHBondContact N-O 2.86Å; S69-I77 PolarHBondContact O-N 2.81Å
70	R	82.6	Confident	81.1	Confident	125 Å²	125	63.1 Å²	63.1	47%	0.472	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	139.6	159.5	-94.3	-177.2	164.7	157.4	-6.3	108.5	K47 T75	K47-R70 PolarHBondContact O-NH2 2.86Å; R70-T75 WeakPolarHBondContact CA-O 3.22Å
71	S	77.8	Confident	81.8	Confident	80 Å²	80	62.3 Å²	62.3	56%	0.559	34%	0.337	S	S	*	.	S	Bend	trans	-90.3	-39	168.2	176.3	0	0	0	0	110.1	T75	S71-T75 PolarHBondContact N-O 2.78Å
72	D	79.7	Confident	82.9	Confident	67 Å²	67	61.9 Å²	61.9	36%	0.358	33%	0.331	S	S	.	.	S	Bend	trans	-155.8	-168.6	179.3	53.9	72.2	0	0	0	109.1	S74 T75	D72-S74 VanDerWaalsContact C-N 3.32Å; D72-S74 WeakPolarHBondContact OD1-CA 3.35Å; D72-S74 WeakPolarHBondContact OD1-CB 3.45Å; D72-S74 PolarHBondContact OD1-N 2.9Å; D72-S74 PolarHBondContact OD1-OG 2.91Å; D72-T75 WeakPolarHBondContact OD1-CB 3.48Å; D72-T75 PolarHBondContact OD1-N 2.85Å; D72-T75 PolarHBondContact OD1-OG1 2.62Å; D72-T75 VanDerWaalsContact OD2-CB 3.22Å; D72-T75 WeakPolarHBondContact OD2-CB 3.5Å; D72-T75 PolarHBondContact OD2-OG1 2.86Å
73	E	75.9	Confident	84.4	Confident	174 Å²	174	57 Å²	57	81%	0.813	30%	0.297	S	S	*	.	S	Bend	trans	-69.3	-28.9	-179.7	-60.4	-172.2	148.9	0	0	112.9	I49	I49-E73 VanDerWaalsContact CD1-O 3.29Å; I49-E73 WeakPolarHBondContact CD1-O 3.38Å
74	S	81.8	Confident	85.1	Confident	57 Å²	57	54.9 Å²	54.9	40%	0.399	29%	0.293	S	S	.	.	S	Bend	trans	-95.3	-16.2	-179.5	38.6	0	0	0	0	115	V42 D72	V42-S74 WeakPolarHBondContact CB-O 3.5Å; V42-S74 PolarHBondContact N-O 2.03Å; V42-S74 WeakPolarHBondContact O-CB 3.3Å; D72-S74 VanDerWaalsContact C-N 3.32Å; D72-S74 WeakPolarHBondContact OD1-CA 3.35Å; D72-S74 WeakPolarHBondContact OD1-CB 3.45Å; D72-S74 PolarHBondContact OD1-N 2.9Å; D72-S74 PolarHBondContact OD1-OG 2.91Å
75	T	87.4	Confident	85.8	Confident	15 Å²	15	53.8 Å²	53.8	9%	0.092	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	125.8	-167.9	-47.7	0	0	0	0	113.1	L39 C40 E41 R70 S71 D72	L39-T75 HydrophobicContact CD2-CG2 3.98Å; C40-T75 CarbonylContact O-C 3.59Å; C40-T75 WeakPolarHBondContact O-CA 3.46Å; E41-T75 HydrophobicContact CG-CG2 4.21Å; R70-T75 WeakPolarHBondContact CA-O 3.22Å; S71-T75 PolarHBondContact N-O 2.78Å; D72-T75 WeakPolarHBondContact OD1-CB 3.48Å; D72-T75 PolarHBondContact OD1-N 2.85Å; D72-T75 PolarHBondContact OD1-OG1 2.62Å; D72-T75 VanDerWaalsContact OD2-CB 3.22Å; D72-T75 WeakPolarHBondContact OD2-CB 3.5Å; D72-T75 PolarHBondContact OD2-OG1 2.86Å
76	S	89.6	Confident	86	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.014	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	131.2	173.7	179.7	0	0	0	0	112.7	C40 W51 S69	C40-S76 WeakPolarHBondContact CB-O 3.31Å; C40-S76 PolarHBondContact N-O 2.85Å; C40-S76 PolarHBondContact O-N 2.89Å; W51-S76 PolarHBondContact NE1-O 2.85Å; S69-S76 CarbonylContact O-C 3.53Å; S69-S76 VanDerWaalsContact O-CA 3.22Å; S69-S76 WeakPolarHBondContact O-CA 3.47Å; S69-S76 WeakPolarHBondContact O-CB 3.43Å; S69-S76 PolarHBondContact O-OG 2.93Å
77	I	91.3	Very high	86.1	Confident	32 Å²	32	57.5 Å²	57.5	16%	0.164	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	124.3	-175	-54.3	175.9	0	0	0	109.8	F37 F38 L39 V68 S69	F37-I77 HydrophobicContact CB-CG2 3.79Å; F37-I77 HydrophobicContact CD2-CG2 4.24Å; F37-I77 HydrophobicContact CG-CG2 4.36Å; F38-I77 WeakPolarHBondContact O-CA 3.36Å; L39-I77 HydrophobicContact CD2-CD1 4.06Å; L39-I77 HydrophobicContact CD2-CG1 3.98Å; L39-I77 HydrophobicContact CG-CG1 4.22Å; V68-I77 CarbonylContact C-O 3.58Å; V68-I77 VanDerWaalsContact CA-O 3.32Å; V68-I77 WeakPolarHBondContact CA-O 3.4Å; S69-I77 PolarHBondContact N-O 2.86Å; S69-I77 PolarHBondContact O-N 2.81Å
78	L	90.9	Very high	86.1	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	121.7	165.1	172	72.3	0	0	0	108.4	F37 F38 W51 I59 I66 V68 Y91	F37-L78 CarbonylContact C-O 3.54Å; F37-L78 WeakPolarHBondContact CA-O 3Å; F38-L78 HydrophobicContact CB-CB 4.49Å; F38-L78 HydrophobicContact CD2-CD2 4.25Å; F38-L78 PolarHBondContact N-O 3.45Å; F38-L78 PolarHBondContact O-N 2.75Å; W51-L78 HydrophobicContact CD2-CB 3.7Å; W51-L78 HydrophobicContact CD2-CD2 4.2Å; W51-L78 HydrophobicContact CD2-CG 4.41Å; W51-L78 HydrophobicContact CE3-CB 4.06Å; W51-L78 HydrophobicContact CE3-CD2 3.71Å; W51-L78 HydrophobicContact CE3-CG 4.41Å; W51-L78 HydrophobicContact CG-CB 4.15Å; W51-L78 HydrophobicContact CH2-CB 4.04Å; W51-L78 HydrophobicContact CH2-CD2 4.15Å; W51-L78 HydrophobicContact CZ2-CB 3.69Å; W51-L78 HydrophobicContact CZ3-CB 4.23Å; W51-L78 HydrophobicContact CZ3-CD2 3.69Å; I59-L78 HydrophobicContact CD1-CD1 3.85Å; I66-L78 HydrophobicContact CG2-CD1 3.44Å; I66-L78 VanDerWaalsContact CG2-CD1 3.44Å; V68-L78 HydrophobicContact CG2-CD1 3.74Å; L78-Y91 HydrophobicContact CD2-CD1 3.55Å; L78-Y91 HydrophobicContact CD2-CE1 4.22Å; L78-Y91 HydrophobicContact CD2-CG 3.85Å
79	T	90.8	Very high	86.2	Confident	20 Å²	20	58 Å²	58	12%	0.123	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	126.1	173.1	-50.7	0	0	0	0	110.4	F37 I66 S67 Y81	F37-T79 HydrophobicContact CB-CG2 4.26Å; I66-T79 CarbonylContact C-O 3.58Å; I66-T79 WeakPolarHBondContact CA-O 3.03Å; S67-T79 PolarHBondContact N-O 2.89Å; S67-T79 PolarHBondContact O-N 3.22Å; T79-Y81 HydrophobicContact CG2-CD1 4.08Å; T79-Y81 HydrophobicContact CG2-CD2 4.29Å; T79-Y81 HydrophobicContact CG2-CE1 3.62Å; T79-Y81 HydrophobicContact CG2-CE2 3.87Å; T79-Y81 HydrophobicContact CG2-CG 4.38Å
80	I	91.3	Very high	86.5	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	125	169	-55.9	179.1	0	0	0	107	I30 S35 K36 F38 N65 I66 A83 N87 Y91 V108	I30-I80 HydrophobicContact CD1-CB 4.32Å; I30-I80 HydrophobicContact CD1-CD1 4.03Å; S35-I80 CarbonylContact C-O 3.52Å; S35-I80 WeakPolarHBondContact CA-O 3.38Å; S35-I80 WeakPolarHBondContact CB-O 3.25Å; K36-I80 PolarHBondContact N-O 2.62Å; K36-I80 PolarHBondContact O-N 3.06Å; F38-I80 HydrophobicContact CE2-CD1 4.26Å; N65-I80 CarbonylContact O-C 3.6Å; N65-I80 WeakPolarHBondContact O-CA 3.37Å; I66-I80 HydrophobicContact CG1-CG1 4.33Å; I66-I80 HydrophobicContact CG1-CG2 4.46Å; I80-A83 HydrophobicContact CG2-CB 3.75Å; I80-N87 HydrophobicContact CG2-CB 4.05Å; I80-Y91 HydrophobicContact CD1-CE2 4.18Å; I80-V108 HydrophobicContact CD1-CG1 4.17Å; I80-V108 HydrophobicContact CD1-CG2 4.2Å
81	Y	88.4	Confident	87	Confident	105 Å²	105	53.9 Å²	53.9	41%	0.412	30%	0.295	S	S	.	.			trans	-106.7	137	177.4	-61.3	-78.1	0	0	0	110.7	S35 N65 S67 T79 A83	S35-Y81 WeakPolarHBondContact OG-CA 3.37Å; N65-Y81 WeakPolarHBondContact CB-O 3.41Å; N65-Y81 PolarHBondContact ND2-O 2.77Å; N65-Y81 PolarHBondContact O-N 3.2Å; S67-Y81 WeakPolarHBondContact OG-CE2 3.47Å; T79-Y81 HydrophobicContact CG2-CD1 4.08Å; T79-Y81 HydrophobicContact CG2-CD2 4.29Å; T79-Y81 HydrophobicContact CG2-CE1 3.62Å; T79-Y81 HydrophobicContact CG2-CE2 3.87Å; T79-Y81 HydrophobicContact CG2-CG 4.38Å; Y81-A83 VanDerWaalsContact C-N 3.34Å; Y81-A83 PolarHBondContact O-N 2.54Å
82	H	87.5	Confident	87.7	Confident	127 Å²	127	52.8 Å²	52.8	59%	0.588	28%	0.28	S	S	*	.	S	Bend	trans	45.5	57.8	176.9	-59.3	-56.8	0	0	0	112.5	G33 E34 S35 N65 N84	G33-H82 PolarHBondContact O-ND1 2.8Å; E34-H82 WeakPolarHBondContact O-CA 3.35Å; E34-H82 PolarHBondContact O-N 3.29Å; S35-H82 PolarHBondContact OG-N 3.05Å; S35-H82 VanDerWaalsContact OG-N 3.11Å; N65-H82 PolarHBondContact ND2-O 2.89Å; N65-H82 VanDerWaalsContact ND2-O 3.12Å; H82-N84 PolarHBondContact O-N 2.81Å
83	A	87.9	Confident	88.3	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.008	26%	0.263	C	S	.	.			trans	-58.6	135.1	-165.6	0	0	0	0	0	111.8	I30 V32 G33 E34 I80 Y81 N87 I110	I30-A83 HydrophobicContact CB-CB 4.35Å; I30-A83 HydrophobicContact CD1-CB 4.37Å; I30-A83 HydrophobicContact CG2-CB 3.9Å; V32-A83 CarbonylContact C-O 3.55Å; V32-A83 VanDerWaalsContact CA-O 3.28Å; V32-A83 WeakPolarHBondContact CA-O 3.37Å; G33-A83 PolarHBondContact N-O 3.49Å; E34-A83 PolarHBondContact O-N 2.97Å; I80-A83 HydrophobicContact CG2-CB 3.75Å; Y81-A83 VanDerWaalsContact C-N 3.34Å; Y81-A83 PolarHBondContact O-N 2.54Å; A83-N87 WeakPolarHBondContact CA-OD1 3.26Å; A83-I110 HydrophobicContact CB-CD1 3.81Å
84	N	87.2	Confident	89.1	Confident	55 Å²	55	41.7 Å²	41.7	29%	0.294	23%	0.227	S	C	.	.			trans	-115.7	173.6	175.6	79.5	-5.1	0	0	0	110.5	H82 D86 N87 I110	H82-N84 PolarHBondContact O-N 2.81Å; N84-D86 PolarHBondContact ND2-OD2 2.74Å; N84-D86 PolarHBondContact O-N 2.79Å; N84-D86 WeakPolarHBondContact OD1-CB 3.48Å; N84-D86 PolarHBondContact OD1-N 3.03Å; N84-D86 VanDerWaalsContact OD1-N 3.15Å; N84-N87 PolarHBondContact N-OD1 3.38Å; N84-N87 WeakPolarHBondContact O-CB 3.32Å; N84-N87 PolarHBondContact O-N 2.86Å; N84-N87 PolarHBondContact OD1-N 2.75Å; N84-N87 PolarHBondContact OD1-ND2 3.49Å; N84-N87 VanDerWaalsContact OD1-ND2 3.14Å; N84-N87 PolarHBondContact OD1-OD1 2.84Å; N84-I110 WeakPolarHBondContact O-CG1 3.33Å
85	V	83.3	Confident	89.4	Confident	105 Å²	105	39 Å²	39	64%	0.636	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-58.7	-30.6	-177.1	-66.9	0	0	0	0	113.5	N87 A88	V85-N87 PolarHBondContact O-N 2.74Å; V85-A88 WeakPolarHBondContact O-CB 3.46Å; V85-A88 PolarHBondContact O-N 3.04Å; V85-A88 VanDerWaalsContact O-N 3.17Å
86	D	84.9	Confident	89.3	Confident	126 Å²	126	41.2 Å²	41.2	67%	0.674	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-71	-11.8	178.2	-41	-52.5	0	0	0	112.8	N84 A88	N84-D86 PolarHBondContact ND2-OD2 2.74Å; N84-D86 PolarHBondContact O-N 2.79Å; N84-D86 WeakPolarHBondContact OD1-CB 3.48Å; N84-D86 PolarHBondContact OD1-N 3.03Å; N84-D86 VanDerWaalsContact OD1-N 3.15Å; D86-A88 VanDerWaalsContact C-N 3.32Å
87	N	88.1	Confident	88.8	Confident	14 Å²	14	43.4 Å²	43.4	8%	0.075	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-86.7	-0.8	174.7	-50.7	150.9	0	0	0	112.7	I80 A83 N84 V85 Y91 V108 I110	I80-N87 HydrophobicContact CG2-CB 4.05Å; A83-N87 WeakPolarHBondContact CA-OD1 3.26Å; N84-N87 PolarHBondContact N-OD1 3.38Å; N84-N87 WeakPolarHBondContact O-CB 3.32Å; N84-N87 PolarHBondContact O-N 2.86Å; N84-N87 PolarHBondContact OD1-N 2.75Å; N84-N87 PolarHBondContact OD1-ND2 3.49Å; N84-N87 VanDerWaalsContact OD1-ND2 3.14Å; N84-N87 PolarHBondContact OD1-OD1 2.84Å; V85-N87 PolarHBondContact O-N 2.74Å; N87-Y91 VanDerWaalsContact O-CE2 3.27Å; N87-Y91 WeakPolarHBondContact O-CE2 3.37Å; N87-Y91 PolarHBondContact O-OH 3.4Å; N87-V108 WeakPolarHBondContact O-CG1 3.42Å; N87-I110 HydrophobicContact CB-CD1 4.38Å; N87-I110 HydrophobicContact CB-CG1 4.39Å
88	A	88.6	Confident	87.9	Confident	44 Å²	44	46.2 Å²	46.2	36%	0.364	26%	0.255	S	S	.	.			trans	-74	145.4	172.5	0	0	0	0	0	112	V85 D86 I110	V85-A88 WeakPolarHBondContact O-CB 3.46Å; V85-A88 PolarHBondContact O-N 3.04Å; V85-A88 VanDerWaalsContact O-N 3.17Å; D86-A88 VanDerWaalsContact C-N 3.32Å; A88-I110 HydrophobicContact CB-CB 4.31Å; A88-I110 HydrophobicContact CB-CG1 3.88Å
89	G	90.3	Very high	87.1	Confident	15 Å²	15	53.8 Å²	53.8	16%	0.155	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	138.6	-173.6	175.6	0	0	0	0	0	113.8	Q107 V108	G89-Q107 VanDerWaalsContact C-NE2 3.32Å; G89-Q107 PolarHBondContact O-NE2 3.15Å; G89-V108 PolarHBondContact N-O 2.86Å; G89-V108 PolarHBondContact O-N 2.83Å
90	I	92.4	Very high	86.5	Confident	89 Å²	89	56.2 Å²	56.2	46%	0.456	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	110.7	-179.2	-57.1	175.4	0	0	0	109.3	P54 T105 Q107	P54-I90 WeakPolarHBondContact CA-O 3.5Å; I90-T105 HydrophobicContact CG2-CG2 3.77Å; I90-Q107 VanDerWaalsContact CG1-OE1 3.24Å
91	Y	92.4	Very high	86.2	Confident	3 Å²	3	62 Å²	62	1%	0.012	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	144.5	169.7	-68.4	-104.1	0	0	0	109.2	F52 P54 I59 I66 L78 I80 N87 T105 V106 V108	F52-Y91 WeakPolarHBondContact O-CA 3.44Å; P54-Y91 HydrophobicContact CG-CD2 3.97Å; P54-Y91 HydrophobicContact CG-CE1 4.49Å; P54-Y91 HydrophobicContact CG-CE2 3.68Å; P54-Y91 HydrophobicContact CG-CG 4.5Å; I59-Y91 HydrophobicContact CD1-CD1 3.92Å; I59-Y91 HydrophobicContact CD1-CE1 4.04Å; I66-Y91 HydrophobicContact CD1-CE1 4.04Å; I66-Y91 WeakPolarHBondContact CD1-OH 3.39Å; L78-Y91 HydrophobicContact CD2-CD1 3.55Å; L78-Y91 HydrophobicContact CD2-CE1 4.22Å; L78-Y91 HydrophobicContact CD2-CG 3.85Å; I80-Y91 HydrophobicContact CD1-CE2 4.18Å; N87-Y91 VanDerWaalsContact O-CE2 3.27Å; N87-Y91 WeakPolarHBondContact O-CE2 3.37Å; N87-Y91 PolarHBondContact O-OH 3.4Å; Y91-T105 CarbonylContact O-C 3.55Å; Y91-T105 VanDerWaalsContact O-CA 3.26Å; Y91-T105 WeakPolarHBondContact O-CA 3.49Å; Y91-V106 PolarHBondContact N-O 2.82Å; Y91-V106 PolarHBondContact O-N 3.2Å; Y91-V108 HydrophobicContact CD2-CB 3.96Å; Y91-V108 HydrophobicContact CD2-CG2 3.46Å; Y91-V108 VanDerWaalsContact CD2-CG2 3.46Å; Y91-V108 HydrophobicContact CE2-CB 3.85Å; Y91-V108 HydrophobicContact CE2-CG1 4.46Å; Y91-V108 HydrophobicContact CE2-CG2 3.7Å; Y91-V108 HydrophobicContact CG-CG2 4.43Å
92	K	92.9	Very high	86.2	Confident	57 Å²	57	57.9 Å²	57.9	25%	0.248	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	125.2	-175.9	-171	-177.9	86.2	157.5	0	110.9	W51 F52 Q103 A104 T105	W51-K92 CarbonylContact C-O 3.45Å; W51-K92 WeakPolarHBondContact CA-O 3.4Å; F52-K92 HydrophobicContact CB-CB 4.29Å; F52-K92 PolarHBondContact N-O 2.84Å; F52-K92 PolarHBondContact O-N 2.94Å; K92-Q103 HydrophobicContact CD-CB 4.39Å; K92-Q103 VanDerWaalsContact CD-OE1 3.32Å; K92-Q103 HydrophobicContact CG-CB 4.37Å; K92-A104 CarbonylContact C-O 3.31Å; K92-A104 WeakPolarHBondContact CA-O 3.14Å; K92-A104 WeakPolarHBondContact CG-O 3.47Å; K92-T105 HydrophobicContact CB-CG2 3.97Å; K92-T105 HydrophobicContact CD-CG2 4.34Å; K92-T105 HydrophobicContact CG-CG2 3.77Å
93	C	92.3	Very high	86.4	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	135.4	163.7	-171.7	0	0	0	0	109.4	V21 I23 C40 D50 W51 Q103 A104	V21-C93 HydrophobicContact CG1-CB 4.31Å; I23-C93 HydrophobicContact CD1-CB 3.91Å; I23-C93 HydrophobicContact CG1-CB 4.17Å; C40-C93 HydrophobicContact CB-CB 3.6Å; C40-C93 WeakPolarHBondContact CB-SG 3.4Å; C40-C93 WeakPolarHBondContact SG-CB 3.03Å; C40-C93 CovalentContact SG-SG 2.02Å; C40-C93 PolarHBondContact SG-SG 2.86Å; D50-C93 CarbonylContact O-C 3.58Å; D50-C93 WeakPolarHBondContact O-CA 3.26Å; W51-C93 HydrophobicContact CD2-CB 4.03Å; W51-C93 HydrophobicContact CE3-CB 4.06Å; W51-C93 HydrophobicContact CH2-CB 4.3Å; W51-C93 HydrophobicContact CZ2-CB 4.25Å; W51-C93 HydrophobicContact CZ3-CB 4.19Å; C93-Q103 CarbonylContact O-C 3.47Å; C93-Q103 WeakPolarHBondContact O-CA 3.36Å; C93-Q103 WeakPolarHBondContact O-CB 3.38Å; C93-A104 PolarHBondContact N-O 2.72Å; C93-A104 PolarHBondContact O-N 2.78Å
94	L	91.3	Very high	86.6	Confident	9 Å²	9	58 Å²	58	5%	0.047	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	117.1	-176.7	175.7	64.5	0	0	0	108.7	D50 F52 K96 E101 Q103	D50-L94 PolarHBondContact N-O 2.83Å; D50-L94 PolarHBondContact O-N 3.17Å; F52-L94 HydrophobicContact CD2-CB 4.21Å; F52-L94 HydrophobicContact CD2-CD2 4.47Å; F52-L94 HydrophobicContact CE2-CB 3.85Å; F52-L94 HydrophobicContact CE2-CD2 3.62Å; F52-L94 HydrophobicContact CE2-CG 4.34Å; F52-L94 HydrophobicContact CZ-CD2 3.95Å; L94-K96 HydrophobicContact CG-CG 4.25Å; L94-E101 HydrophobicContact CD1-CB 4.43Å; L94-Q103 HydrophobicContact CB-CB 4.49Å; L94-Q103 HydrophobicContact CD1-CB 3.83Å
95	A	89	Confident	86.9	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	136.4	177.7	0	0	0	0	0	110.3	I19 V21 V42 A46 D48 I49 E101 A102	I19-A95 HydrophobicContact CG2-CB 4.12Å; V21-A95 HydrophobicContact CG2-CB 3.54Å; V42-A95 HydrophobicContact CB-CB 4.42Å; V42-A95 HydrophobicContact CG1-CB 3.71Å; V42-A95 HydrophobicContact CG2-CB 3.76Å; A46-A95 HydrophobicContact CB-CB 4.1Å; D48-A95 CarbonylContact O-C 3.59Å; D48-A95 WeakPolarHBondContact O-CA 3.47Å; I49-A95 HydrophobicContact CG1-CB 4.36Å; A95-E101 WeakPolarHBondContact O-CA 3.47Å; A95-A102 PolarHBondContact N-O 2.81Å; A95-A102 PolarHBondContact O-N 2.8Å
96	K	85.7	Confident	87.4	Confident	62 Å²	62	54.4 Å²	54.4	27%	0.27	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	148.4	-174.5	-55.3	-163.1	-179.8	-151.9	0	113.2	A46 K47 D48 L94 K100 E101	A46-K96 CarbonylContact C-O 3.53Å; K47-K96 PolarHBondContact N-O 3.01Å; D48-K96 PolarHBondContact N-O 2.91Å; D48-K96 PolarHBondContact O-N 2.9Å; L94-K96 HydrophobicContact CG-CG 4.25Å; K96-K100 WeakPolarHBondContact CA-O 3.36Å; K96-E101 HydrophobicContact CB-CG 4.46Å; K96-E101 HydrophobicContact CD-CG 3.97Å; K96-E101 WeakPolarHBondContact CE-OE1 3.35Å; K96-E101 WeakPolarHBondContact CE-OE2 3.43Å; K96-E101 HydrophobicContact CG-CB 4.41Å; K96-E101 HydrophobicContact CG-CG 3.91Å; K96-E101 IonicContact NZ-OE1 2.7Å; K96-E101 PolarHBondContact NZ-OE1 2.88Å; K96-E101 IonicContact NZ-OE2 2.88Å; K96-E101 PolarHBondContact NZ-OE2 2.84Å
97	N	78	Confident	87.8	Confident	48 Å²	48	52.4 Å²	52.4	26%	0.257	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	173.3	160.7	-156.5	-15.3	0	0	0	108.5	I19 D45 D99 K100	I19-N97 HydrophobicContact CD1-CB 3.93Å; D45-N97 WeakPolarHBondContact O-CB 3.29Å; D45-N97 PolarHBondContact O-ND2 3.43Å; D45-N97 PolarHBondContact OD1-ND2 2.84Å; D45-N97 PolarHBondContact OD2-ND2 2.74Å; N97-D99 PolarHBondContact O-N 3.04Å; N97-K100 PolarHBondContact N-O 2.81Å; N97-K100 PolarHBondContact O-N 2.97Å; N97-K100 VanDerWaalsContact O-N 3.12Å; N97-K100 VanDerWaalsContact O-O 3.05Å
98	A	72.6	Confident	87.9	Confident	90 Å²	90	51.8 Å²	51.8	74%	0.744	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.4	-40.8	-165.6	0	0	0	0	0	115.5
99	D	73.8	Confident	87.9	Confident	160 Å²	160	54.4 Å²	54.4	86%	0.856	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.5	8.7	-176.7	-51.7	-71.4	0	0	0	114.1	N97	N97-D99 PolarHBondContact O-N 3.04Å
100	K	78.3	Confident	87.9	Confident	71 Å²	71	54.8 Å²	54.8	31%	0.309	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	140.8	-173.8	-61.5	-171.7	-166.6	-179.7	0	113	S16 A17 I19 K96 N97	S16-K100 PolarHBondContact O-NZ 2.88Å; S16-K100 WeakPolarHBondContact OG-CE 3.46Å; S16-K100 PolarHBondContact OG-NZ 3.47Å; A17-K100 PolarHBondContact O-NZ 2.78Å; I19-K100 HydrophobicContact CD1-CB 3.76Å; I19-K100 HydrophobicContact CG1-CB 4.26Å; K96-K100 WeakPolarHBondContact CA-O 3.36Å; N97-K100 PolarHBondContact N-O 2.81Å; N97-K100 PolarHBondContact O-N 2.97Å; N97-K100 VanDerWaalsContact O-N 3.12Å; N97-K100 VanDerWaalsContact O-O 3.05Å
101	E	85.5	Confident	87.6	Confident	120 Å²	120	51.8 Å²	51.8	56%	0.561	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.9	146.4	172	-52.9	-165.7	-173.4	0	0	111	L94 A95 K96	L94-E101 HydrophobicContact CD1-CB 4.43Å; A95-E101 WeakPolarHBondContact O-CA 3.47Å; K96-E101 HydrophobicContact CB-CG 4.46Å; K96-E101 HydrophobicContact CD-CG 3.97Å; K96-E101 WeakPolarHBondContact CE-OE1 3.35Å; K96-E101 WeakPolarHBondContact CE-OE2 3.43Å; K96-E101 HydrophobicContact CG-CB 4.41Å; K96-E101 HydrophobicContact CG-CG 3.91Å; K96-E101 IonicContact NZ-OE1 2.7Å; K96-E101 PolarHBondContact NZ-OE1 2.88Å; K96-E101 IonicContact NZ-OE2 2.88Å; K96-E101 PolarHBondContact NZ-OE2 2.84Å
102	A	89.1	Confident	87.3	Confident	20 Å²	20	54.9 Å²	54.9	17%	0.165	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	151.3	168.7	0	0	0	0	0	110.1	I19 V21 A95	I19-A102 HydrophobicContact CB-CB 4.02Å; I19-A102 HydrophobicContact CG2-CB 3.95Å; I19-A102 VanDerWaalsContact O-CB 3.23Å; I19-A102 WeakPolarHBondContact O-CB 3.18Å; V21-A102 HydrophobicContact CG2-CB 3.85Å; V21-A102 WeakPolarHBondContact CG2-O 3.46Å; A95-A102 PolarHBondContact N-O 2.81Å; A95-A102 PolarHBondContact O-N 2.8Å
103	Q	91.6	Very high	87.1	Confident	114 Å²	114	56.3 Å²	56.3	53%	0.533	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	150.1	-175	65.3	-177.5	15.3	0	0	112.4	K92 C93 L94	K92-Q103 HydrophobicContact CD-CB 4.39Å; K92-Q103 VanDerWaalsContact CD-OE1 3.32Å; K92-Q103 HydrophobicContact CG-CB 4.37Å; C93-Q103 CarbonylContact O-C 3.47Å; C93-Q103 WeakPolarHBondContact O-CA 3.36Å; C93-Q103 WeakPolarHBondContact O-CB 3.38Å; L94-Q103 HydrophobicContact CB-CB 4.49Å; L94-Q103 HydrophobicContact CD1-CB 3.83Å
104	A	92.4	Very high	87	Confident	17 Å²	17	57.2 Å²	57.2	14%	0.14	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	155.6	169.3	0	0	0	0	0	109.8	V21 I23 K92 C93	V21-A104 HydrophobicContact CB-CB 4.19Å; V21-A104 HydrophobicContact CG1-CB 3.8Å; I23-A104 HydrophobicContact CD1-CB 3.78Å; I23-A104 WeakPolarHBondContact CD1-O 3.34Å; I23-A104 HydrophobicContact CG1-CB 3.85Å; K92-A104 CarbonylContact C-O 3.31Å; K92-A104 WeakPolarHBondContact CA-O 3.14Å; K92-A104 WeakPolarHBondContact CG-O 3.47Å; C93-A104 PolarHBondContact N-O 2.72Å; C93-A104 PolarHBondContact O-N 2.78Å
105	T	93.7	Very high	87	Confident	84 Å²	84	60 Å²	60	52%	0.515	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	141	179.4	48	0	0	0	0	111.2	I90 Y91 K92	I90-T105 HydrophobicContact CG2-CG2 3.77Å; Y91-T105 CarbonylContact O-C 3.55Å; Y91-T105 VanDerWaalsContact O-CA 3.26Å; Y91-T105 WeakPolarHBondContact O-CA 3.49Å; K92-T105 HydrophobicContact CB-CG2 3.97Å; K92-T105 HydrophobicContact CD-CG2 4.34Å; K92-T105 HydrophobicContact CG-CG2 3.77Å
106	V	93.3	Very high	87.1	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	126.1	170	60.7	0	0	0	0	109.8	I23 F38 W51 Y91 V108	I23-V106 HydrophobicContact CD1-CB 4.33Å; I23-V106 HydrophobicContact CD1-CG1 4.24Å; I23-V106 HydrophobicContact CG2-CB 3.87Å; I23-V106 HydrophobicContact CG2-CG1 3.99Å; I23-V106 HydrophobicContact CG2-CG2 4.45Å; F38-V106 HydrophobicContact CD1-CG1 4.25Å; F38-V106 HydrophobicContact CD1-CG2 3.91Å; F38-V106 HydrophobicContact CE1-CG2 3.85Å; F38-V106 HydrophobicContact CG-CG1 4.34Å; W51-V106 HydrophobicContact CH2-CG1 4.29Å; W51-V106 HydrophobicContact CZ3-CG1 4.09Å; Y91-V106 PolarHBondContact N-O 2.82Å; Y91-V106 PolarHBondContact O-N 3.2Å; V106-V108 PolarHBondContact O-N 2.82Å
107	Q	92.2	Very high	87.1	Confident	84 Å²	84	64.7 Å²	64.7	39%	0.393	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	112.2	168.1	177.5	69.2	67.3	0	0	108.3	G28 G89 I90 K109	G28-Q107 PolarHBondContact N-O 2.96Å; G89-Q107 VanDerWaalsContact C-NE2 3.32Å; G89-Q107 PolarHBondContact O-NE2 3.15Å; I90-Q107 VanDerWaalsContact CG1-OE1 3.24Å; Q107-K109 HydrophobicContact CG-CG 4.2Å
108	V	91.4	Very high	87.3	Confident	0 Å²	0	66 Å²	66	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	131	166.1	178.1	0	0	0	0	108.6	G28 I30 F38 I80 N87 G89 Y91 V106 I110	G28-V108 CarbonylContact O-C 3.57Å; G28-V108 VanDerWaalsContact O-CA 3.24Å; G28-V108 WeakPolarHBondContact O-CA 3.44Å; I30-V108 HydrophobicContact CD1-CG1 3.8Å; I30-V108 HydrophobicContact CG1-CG1 4.27Å; F38-V108 HydrophobicContact CE2-CG2 3.87Å; F38-V108 HydrophobicContact CZ-CG2 3.86Å; I80-V108 HydrophobicContact CD1-CG1 4.17Å; I80-V108 HydrophobicContact CD1-CG2 4.2Å; N87-V108 WeakPolarHBondContact O-CG1 3.42Å; G89-V108 PolarHBondContact N-O 2.86Å; G89-V108 PolarHBondContact O-N 2.83Å; Y91-V108 HydrophobicContact CD2-CB 3.96Å; Y91-V108 HydrophobicContact CD2-CG2 3.46Å; Y91-V108 VanDerWaalsContact CD2-CG2 3.46Å; Y91-V108 HydrophobicContact CE2-CB 3.85Å; Y91-V108 HydrophobicContact CE2-CG1 4.46Å; Y91-V108 HydrophobicContact CE2-CG2 3.7Å; Y91-V108 HydrophobicContact CG-CG2 4.43Å; V106-V108 PolarHBondContact O-N 2.82Å; V108-I110 HydrophobicContact CG1-CD1 3.67Å; V108-I110 HydrophobicContact CG1-CG1 4.32Å
109	K	88.8	Confident	87.6	Confident	99 Å²	99	65.6 Å²	65.6	43%	0.43	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	129.6	170.3	-57.6	-175.4	-154.9	154.8	0	108.4	G28 E29 I30 Q107	G28-K109 PolarHBondContact O-N 3.18Å; E29-K109 WeakPolarHBondContact CA-O 3.39Å; E29-K109 HydrophobicContact CG-CB 4.41Å; E29-K109 HydrophobicContact CG-CD 4.42Å; E29-K109 WeakPolarHBondContact OE1-CD 3.34Å; E29-K109 WeakPolarHBondContact OE1-CE 3.44Å; E29-K109 IonicContact OE1-NZ 3.87Å; E29-K109 PolarHBondContact OE1-NZ 3.44Å; I30-K109 PolarHBondContact N-O 2.79Å; Q107-K109 HydrophobicContact CG-CG 4.2Å
110	I	88.5	Confident	87.9	Confident	23 Å²	23	62.3 Å²	62.3	12%	0.118	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	130.3	176.2	-52.9	-58.5	0	0	0	108.4	I30 V32 A83 N84 N87 A88 V108	I30-I110 HydrophobicContact CB-CD1 3.82Å; I30-I110 HydrophobicContact CD1-CD1 3.9Å; I30-I110 HydrophobicContact CG1-CD1 4.05Å; I30-I110 WeakPolarHBondContact O-CA 3.16Å; V32-I110 HydrophobicContact CG2-CG2 3.69Å; A83-I110 HydrophobicContact CB-CD1 3.81Å; N84-I110 WeakPolarHBondContact O-CG1 3.33Å; N87-I110 HydrophobicContact CB-CD1 4.38Å; N87-I110 HydrophobicContact CB-CG1 4.39Å; A88-I110 HydrophobicContact CB-CB 4.31Å; A88-I110 HydrophobicContact CB-CG1 3.88Å; V108-I110 HydrophobicContact CG1-CD1 3.67Å; V108-I110 HydrophobicContact CG1-CG1 4.32Å
111	F	86.9	Confident	88.3	Confident	27 Å²	27	62.4 Å²	62.4	12%	0.118	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	154.1	179.7	64.3	-98.2	0	0	0	111	E29 I30 S31 V32 K113	E29-F111 HydrophobicContact CB-CD1 4.25Å; E29-F111 HydrophobicContact CB-CE1 3.89Å; I30-F111 VanDerWaalsContact C-CE1 3.43Å; I30-F111 VanDerWaalsContact O-CD1 3.25Å; I30-F111 WeakPolarHBondContact O-CD1 3.47Å; I30-F111 WeakPolarHBondContact O-CE1 3.35Å; I30-F111 PolarHBondContact O-N 2.81Å; S31-F111 CarbonylContact C-O 3.54Å; S31-F111 VanDerWaalsContact CA-O 3.25Å; S31-F111 WeakPolarHBondContact CA-O 3.27Å; S31-F111 WeakPolarHBondContact OG-CE2 3.33Å; S31-F111 VanDerWaalsContact OG-CZ 3.28Å; S31-F111 WeakPolarHBondContact OG-CZ 3.44Å; V32-F111 PolarHBondContact N-O 2.9Å; F111-K113 HydrophobicContact CD2-CG 4.43Å; F111-K113 HydrophobicContact CE2-CG 3.9Å
112	Q	86.6	Confident	88.6	Confident	68 Å²	68	60 Å²	60	32%	0.318	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-101.6	122.7	173.7	-174.4	170.9	3.1	0	0	108.3	V32 S139 S140 R192	V32-Q112 HydrophobicContact CG2-CB 4.35Å; Q112-S139 CarbonylContact O-C 3.59Å; Q112-S139 WeakPolarHBondContact O-CA 3.38Å; Q112-S139 WeakPolarHBondContact O-CB 3.47Å; Q112-S140 PolarHBondContact O-N 3.15Å; Q112-R192 PolarHBondContact O-NH2 2.94Å
113	K	87.9	Confident	88.9	Confident	87 Å²	87	60.7 Å²	60.7	38%	0.378	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-62.8	153.6	170.5	-78	177.9	163.5	167.1	0	110.3	S31 E34 F111 T115	S31-K113 WeakPolarHBondContact OG-CD 3.32Å; S31-K113 WeakPolarHBondContact OG-CE 3.21Å; S31-K113 PolarHBondContact OG-NZ 2.86Å; E34-K113 IonicContact OE1-NZ 2.65Å; E34-K113 PolarHBondContact OE1-NZ 2.98Å; E34-K113 IonicContact OE2-NZ 2.68Å; F111-K113 HydrophobicContact CD2-CG 4.43Å; F111-K113 HydrophobicContact CE2-CG 3.9Å; K113-T115 PolarHBondContact O-N 3.33Å; K113-T115 PolarHBondContact O-OG1 3.2Å
114	I	91.4	Very high	89	Confident	18 Å²	18	59.6 Å²	59.6	9%	0.092	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-52.3	117.1	172.7	-54.6	175.7	0	0	0	109	F116 V137 A187 V189 E194 D196	I114-F116 HydrophobicContact CG2-CE2 4.29Å; I114-V137 HydrophobicContact CG2-CG2 3.47Å; I114-V137 VanDerWaalsContact CG2-CG2 3.47Å; I114-A187 HydrophobicContact CD1-CB 4.3Å; I114-A187 WeakPolarHBondContact CD1-O 3.47Å; I114-A187 HydrophobicContact CG2-CB 3.72Å; I114-V189 HydrophobicContact CD1-CG2 4.01Å; I114-V189 HydrophobicContact CG1-CG2 3.75Å; I114-E194 HydrophobicContact CD1-CB 3.82Å; I114-E194 HydrophobicContact CG1-CB 4.23Å; I114-D196 HydrophobicContact CB-CB 4.15Å; I114-D196 HydrophobicContact CD1-CB 4.29Å; I114-D196 HydrophobicContact CG2-CB 3.93Å
115	T	90.2	Very high	89.1	Confident	68 Å²	68	60.5 Å²	60.5	42%	0.417	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	114.4	-176.5	-50.3	0	0	0	0	108.9	K113 V137 V138	K113-T115 PolarHBondContact O-N 3.33Å; K113-T115 PolarHBondContact O-OG1 3.2Å; T115-V137 WeakPolarHBondContact O-CA 3.39Å; T115-V138 PolarHBondContact N-O 3.09Å; T115-V138 PolarHBondContact O-N 3.5Å
116	F	91.4	Very high	89	Confident	27 Å²	27	58.9 Å²	58.9	12%	0.118	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	132.8	173.5	-63.4	-89.1	0	0	0	110.4	I114 D136 V137 A187 D196 R198	I114-F116 HydrophobicContact CG2-CE2 4.29Å; F116-D136 WeakPolarHBondContact CA-O 3.25Å; F116-V137 HydrophobicContact CD1-CB 3.58Å; F116-V137 HydrophobicContact CD1-CG2 3.77Å; F116-V137 HydrophobicContact CD2-CG2 4.36Å; F116-V137 HydrophobicContact CE1-CB 3.75Å; F116-V137 HydrophobicContact CE1-CG1 4.31Å; F116-V137 HydrophobicContact CE1-CG2 3.78Å; F116-V137 HydrophobicContact CE2-CG2 4.38Å; F116-V137 HydrophobicContact CG-CB 4.23Å; F116-V137 HydrophobicContact CG-CG2 4.05Å; F116-V137 HydrophobicContact CZ-CG2 4.09Å; F116-A187 HydrophobicContact CZ-CB 4.37Å; F116-D196 HydrophobicContact CE2-CB 4.26Å; F116-D196 WeakPolarHBondContact CE2-OD2 3.31Å; F116-R198 HydrophobicContact CD1-CB 3.87Å; F116-R198 HydrophobicContact CD2-CB 4.47Å; F116-R198 HydrophobicContact CE1-CB 3.58Å; F116-R198 HydrophobicContact CE2-CB 4.2Å; F116-R198 HydrophobicContact CG-CB 4.33Å; F116-R198 HydrophobicContact CZ-CB 3.77Å
117	Q	84.8	Confident	89.1	Confident	134 Å²	134	63 Å²	63	63%	0.626	34%	0.341	S	S	*	.			trans	-79.1	-33.2	-162.4	-60.2	-168.8	-74.3	0	0	115.4	D136 V138	Q117-D136 HydrophobicContact CB-CB 4.31Å; Q117-D136 HydrophobicContact CG-CB 4.38Å; Q117-D136 PolarHBondContact N-O 2.96Å; Q117-V138 HydrophobicContact CG-CG2 3.86Å
118	S	82.3	Confident	89	Confident	76 Å²	76	61.4 Å²	61.4	53%	0.531	35%	0.348	S	S	.	.	S	Bend	trans	-108.9	173.2	-176	-57.2	0	0	0	0	112	R198	S118-R198 PolarHBondContact O-NH1 2.92Å; S118-R198 PolarHBondContact O-NH2 3.04Å
119	A	80.6	Confident	89	Confident	80 Å²	80	65.3 Å²	65.3	66%	0.661	37%	0.369	S	S	*	.			trans	-68.8	157.5	160.7	0	0	0	0	0	111	S121 R198	A119-S121 PolarHBondContact O-N 2.83Å; A119-R198 PolarHBondContact O-NH1 2.77Å
120	P	78.6	Confident	89.3	Confident	91 Å²	91	65.8 Å²	65.8	59%	0.591	38%	0.376	S	S	*	.			trans	-77	105	172.1	30.5	-32.6	0	0	0	110.8
121	S	87.5	Confident	89.5	Confident	73 Å²	73	64.7 Å²	64.7	51%	0.51	37%	0.37	S	S	.	.			trans	-101.4	157.6	169.1	58.8	0	0	0	0	111.2	A119	A119-S121 PolarHBondContact O-N 2.83Å
122	P	92.5	Very high	89.9	Confident	70 Å²	70	65.9 Å²	65.9	46%	0.455	38%	0.378	S	S	.	.			trans	-59.5	149.2	162.7	-19.6	32.9	0	0	0	111	K201 I203	P122-K201 CarbonylContact C-O 3.58Å; P122-K201 VanDerWaalsContact CA-O 3.24Å; P122-K201 WeakPolarHBondContact CA-O 3.35Å; P122-K201 HydrophobicContact CB-CB 4.26Å; P122-I203 HydrophobicContact CB-CD1 3.85Å; P122-I203 HydrophobicContact CB-CG1 4.45Å
123	Q	93.7	Very high	90.2	Very high	34 Å²	34	62.6 Å²	62.6	16%	0.159	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	127	170.8	-64.9	177.5	23.4	0	0	107.6	F125 I133 V134 I200 K201 V202 I203	Q123-F125 HydrophobicContact CB-CE2 3.82Å; Q123-F125 HydrophobicContact CB-CZ 4.04Å; Q123-I133 VanDerWaalsContact OE1-CA 3.31Å; Q123-V134 PolarHBondContact NE2-O 3.43Å; Q123-I200 HydrophobicContact CG-CG2 4.16Å; Q123-K201 PolarHBondContact N-O 2.81Å; Q123-V202 WeakPolarHBondContact O-CA 3.45Å; Q123-I203 PolarHBondContact O-N 2.59Å
124	E	93.6	Very high	90.5	Very high	91 Å²	91	60.9 Å²	60.9	43%	0.425	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	137.4	-170.4	-46.1	-157.9	130.6	0	0	110.7	I203 K288	E124-I203 WeakPolarHBondContact CA-O 3.31Å; E124-I203 HydrophobicContact CB-CB 4.47Å; E124-I203 HydrophobicContact CG-CB 4.12Å; E124-I203 HydrophobicContact CG-CD1 4.41Å; E124-I203 WeakPolarHBondContact OE1-CD1 3.41Å; E124-K288 IonicContact OE1-NZ 2.64Å; E124-K288 PolarHBondContact OE1-NZ 2.86Å; E124-K288 IonicContact OE2-NZ 3.53Å; E124-K288 PolarHBondContact OE2-NZ 2.58Å
125	F	94.6	Very high	90.4	Very high	36 Å²	36	60.2 Å²	60.2	16%	0.158	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	154.3	-178.7	-51.7	-84.6	0	0	0	109.5	Q123 A131 I133 I175 V202 I203 V204 N205	Q123-F125 HydrophobicContact CB-CE2 3.82Å; Q123-F125 HydrophobicContact CB-CZ 4.04Å; F125-A131 HydrophobicContact CB-CB 4.01Å; F125-A131 HydrophobicContact CD1-CB 3.5Å; F125-A131 HydrophobicContact CD2-CB 3.59Å; F125-A131 HydrophobicContact CE1-CB 3.76Å; F125-A131 HydrophobicContact CE2-CB 3.85Å; F125-A131 HydrophobicContact CG-CB 3.4Å; F125-A131 VanDerWaalsContact CG-CB 3.4Å; F125-A131 HydrophobicContact CZ-CB 3.92Å; F125-I133 HydrophobicContact CE2-CG1 4.16Å; F125-I133 HydrophobicContact CZ-CG1 4.32Å; F125-I175 HydrophobicContact CB-CG2 4.07Å; F125-I175 HydrophobicContact CD2-CD1 4.21Å; F125-V202 HydrophobicContact CD2-CG1 4.09Å; F125-V202 HydrophobicContact CE2-CG1 4.27Å; F125-I203 PolarHBondContact N-O 2.69Å; F125-V204 WeakPolarHBondContact O-CA 3.4Å; F125-N205 PolarHBondContact O-N 2.9Å
126	N	93.3	Very high	90.4	Very high	50 Å²	50	59.9 Å²	59.9	27%	0.267	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	148.1	175	-58.6	-23.3	0	0	0	110.3	G128 D129 I175 N205 A289	N126-G128 PolarHBondContact O-N 2.77Å; N126-D129 WeakPolarHBondContact CB-OD2 3.42Å; N126-D129 PolarHBondContact N-OD2 3.43Å; N126-D129 WeakPolarHBondContact O-CB 3.29Å; N126-D129 PolarHBondContact O-N 2.72Å; N126-D129 VanDerWaalsContact O-N 3.11Å; N126-I175 WeakPolarHBondContact O-CG2 3.16Å; N126-N205 CarbonylContact C-O 3.56Å; N126-N205 WeakPolarHBondContact CA-O 3.46Å; N126-N205 WeakPolarHBondContact OD1-CB 3.2Å; N126-N205 PolarHBondContact OD1-ND2 2.86Å; N126-A289 HydrophobicContact CB-CB 4.46Å
127	E	93.4	Very high	90.4	Very high	86 Å²	86	59.7 Å²	59.7	40%	0.402	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	128	178.5	178.9	153.3	-124.4	0	0	111	I175 K176 K177 V204 N205	E127-I175 WeakPolarHBondContact CA-O 3.38Å; E127-K176 WeakPolarHBondContact OE1-CA 3.48Å; E127-K176 WeakPolarHBondContact OE1-CB 3.39Å; E127-K177 PolarHBondContact OE1-N 2.85Å; E127-V204 HydrophobicContact CB-CG1 3.94Å; E127-N205 PolarHBondContact N-O 3.32Å
128	G	90.3	Very high	90.7	Very high	52 Å²	52	55.5 Å²	55.5	54%	0.536	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	101	-19.3	-173.1	0	0	0	0	0	114.8	N126 I175	N126-G128 PolarHBondContact O-N 2.77Å; G128-I175 PolarHBondContact N-O 2.67Å
129	D	93.1	Very high	91	Very high	81 Å²	81	52.3 Å²	52.3	43%	0.433	31%	0.314	S	S	.	.	S	Bend	trans	-69.5	164.6	179.5	-77.3	-27.9	0	0	0	113.4	N126 G174 I175	N126-D129 WeakPolarHBondContact CB-OD2 3.42Å; N126-D129 PolarHBondContact N-OD2 3.43Å; N126-D129 WeakPolarHBondContact O-CB 3.29Å; N126-D129 PolarHBondContact O-N 2.72Å; N126-D129 VanDerWaalsContact O-N 3.11Å; D129-G174 CarbonylContact O-C 3.53Å; D129-G174 VanDerWaalsContact O-CA 3.29Å; D129-G174 WeakPolarHBondContact O-CA 3.49Å; D129-G174 PolarHBondContact O-N 3.22Å; D129-G174 VanDerWaalsContact O-N 3.1Å; D129-I175 PolarHBondContact O-N 2.92Å
130	N	94.2	Very high	91.2	Very high	109 Å²	109	51.3 Å²	51.3	58%	0.583	30%	0.302	S	S	*	.			trans	-88.8	98.5	164.2	-65.5	-57.7	0	0	0	108.9	D132 L171 I172 R173	N130-D132 PolarHBondContact O-N 3.39Å; N130-L171 HydrophobicContact CB-CD1 4.19Å; N130-I172 CarbonylContact C-O 3.48Å; N130-I172 WeakPolarHBondContact CA-O 3.37Å; N130-R173 VanDerWaalsContact OD1-CA 3.29Å; N130-R173 WeakPolarHBondContact OD1-CA 3.43Å
131	A	93.4	Very high	91.5	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	116	-179.8	0	0	0	0	0	111	F125 L171 I172 I175	F125-A131 HydrophobicContact CB-CB 4.01Å; F125-A131 HydrophobicContact CD1-CB 3.5Å; F125-A131 HydrophobicContact CD2-CB 3.59Å; F125-A131 HydrophobicContact CE1-CB 3.76Å; F125-A131 HydrophobicContact CE2-CB 3.85Å; F125-A131 HydrophobicContact CG-CB 3.4Å; F125-A131 VanDerWaalsContact CG-CB 3.4Å; F125-A131 HydrophobicContact CZ-CB 3.92Å; A131-L171 CarbonylContact O-C 3.47Å; A131-L171 WeakPolarHBondContact O-CA 3.41Å; A131-I172 HydrophobicContact CB-CB 4.38Å; A131-I172 PolarHBondContact N-O 3.2Å; A131-I172 PolarHBondContact O-N 2.83Å; A131-I175 HydrophobicContact CB-CB 4.02Å; A131-I175 HydrophobicContact CB-CD1 3.61Å; A131-I175 HydrophobicContact CB-CG1 4.38Å; A131-I175 HydrophobicContact CB-CG2 4.11Å
132	D	94.2	Very high	91.5	Very high	52 Å²	52	51.2 Å²	51.2	28%	0.278	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	101.3	171.4	-165.2	12.1	0	0	0	109.4	N130 V134 H169 L171	N130-D132 PolarHBondContact O-N 3.39Å; D132-V134 PolarHBondContact O-N 2.95Å; D132-H169 VanDerWaalsContact OD1-CB 3.32Å; D132-H169 WeakPolarHBondContact OD1-CB 3.29Å; D132-L171 HydrophobicContact CB-CD1 4.29Å
133	I	94.1	Very high	91.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	103.7	-174.8	-52.3	166.9	0	0	0	108.8	Q123 F125 W147 L170 I172 Y183 I200 V202	Q123-I133 VanDerWaalsContact OE1-CA 3.31Å; F125-I133 HydrophobicContact CE2-CG1 4.16Å; F125-I133 HydrophobicContact CZ-CG1 4.32Å; I133-W147 HydrophobicContact CB-CH2 4.11Å; I133-W147 HydrophobicContact CG2-CH2 3.56Å; I133-W147 HydrophobicContact CG2-CZ3 3.85Å; I133-W147 WeakPolarHBondContact O-CH2 3.43Å; I133-W147 VanDerWaalsContact O-CZ2 3.31Å; I133-W147 WeakPolarHBondContact O-CZ2 3.24Å; I133-L170 HydrophobicContact CB-CB 4.27Å; I133-L170 WeakPolarHBondContact CB-O 3.09Å; I133-L170 HydrophobicContact CD1-CD2 4.04Å; I133-L170 HydrophobicContact CD1-CG 4.29Å; I133-L170 PolarHBondContact N-O 2.89Å; I133-L170 PolarHBondContact O-N 2.84Å; I133-I172 HydrophobicContact CD1-CD1 3.49Å; I133-I172 VanDerWaalsContact CD1-CD1 3.49Å; I133-I172 HydrophobicContact CD1-CG1 3.88Å; I133-Y183 HydrophobicContact CD1-CD1 4.05Å; I133-Y183 HydrophobicContact CD1-CE1 4Å; I133-Y183 HydrophobicContact CD1-CG 4.4Å; I133-I200 HydrophobicContact CG2-CD1 4.39Å; I133-I200 HydrophobicContact CG2-CG2 4.12Å; I133-V202 HydrophobicContact CD1-CG2 3.67Å; I133-V202 HydrophobicContact CG1-CG2 4.12Å; I133-V202 HydrophobicContact CG2-CG2 4.19Å
134	V	92.6	Very high	91.3	Very high	51 Å²	51	51.6 Å²	51.6	31%	0.309	30%	0.304	S	S	.	.			trans	-67.8	130.7	-175.3	173.1	0	0	0	0	111	Q123 D132 D136 I200	Q123-V134 PolarHBondContact NE2-O 3.43Å; D132-V134 PolarHBondContact O-N 2.95Å; V134-D136 WeakPolarHBondContact CG1-OD2 3.49Å; V134-I200 WeakPolarHBondContact O-CD1 3.33Å
135	C	90.9	Very high	91.3	Very high	3 Å²	3	48.4 Å²	48.4	2%	0.02	29%	0.29	C	S	.	.			trans	-139.3	83.4	170.4	-177.1	0	0	0	0	111.2	V137 W147 H169 C185 I200	C135-V137 PolarHBondContact O-N 3.08Å; C135-W147 HydrophobicContact CB-CH2 3.69Å; C135-W147 HydrophobicContact CB-CZ2 3.38Å; C135-H169 PolarHBondContact N-CD2 2.89Å; C135-H169 VanDerWaalsContact N-CD2 3.27Å; C135-C185 HydrophobicContact CB-CB 3.84Å; C135-C185 WeakPolarHBondContact CB-SG 3.45Å; C135-C185 WeakPolarHBondContact SG-CB 3.15Å; C135-C185 CovalentContact SG-SG 2.03Å; C135-C185 PolarHBondContact SG-SG 2.88Å; C135-I200 HydrophobicContact CB-CD1 4.31Å
136	D	90.3	Very high	91.1	Very high	61 Å²	61	47.7 Å²	47.7	33%	0.326	29%	0.287	S	S	.	.			trans	-82.1	107.4	-177.6	-57.4	-36.7	0	0	0	111.2	F116 Q117 V134 H169	F116-D136 WeakPolarHBondContact CA-O 3.25Å; Q117-D136 HydrophobicContact CB-CB 4.31Å; Q117-D136 HydrophobicContact CG-CB 4.38Å; Q117-D136 PolarHBondContact N-O 2.96Å; V134-D136 WeakPolarHBondContact CG1-OD2 3.49Å; D136-H169 IonicContact OD1-CD2 3.43Å; D136-H169 IonicContact OD1-CE1 3.13Å; D136-H169 PolarHBondContact OD1-CE1 2.88Å; D136-H169 IonicContact OD1-NE2 3.79Å; D136-H169 PolarHBondContact OD1-NE2 3.14Å
137	V	91.6	Very high	91.1	Very high	23 Å²	23	45.3 Å²	45.3	14%	0.139	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	134.6	-176.1	61.5	0	0	0	0	111	I114 T115 F116 C135 P143 I145 A187	I114-V137 HydrophobicContact CG2-CG2 3.47Å; I114-V137 VanDerWaalsContact CG2-CG2 3.47Å; T115-V137 WeakPolarHBondContact O-CA 3.39Å; F116-V137 HydrophobicContact CD1-CB 3.58Å; F116-V137 HydrophobicContact CD1-CG2 3.77Å; F116-V137 HydrophobicContact CD2-CG2 4.36Å; F116-V137 HydrophobicContact CE1-CB 3.75Å; F116-V137 HydrophobicContact CE1-CG1 4.31Å; F116-V137 HydrophobicContact CE1-CG2 3.78Å; F116-V137 HydrophobicContact CE2-CG2 4.38Å; F116-V137 HydrophobicContact CG-CB 4.23Å; F116-V137 HydrophobicContact CG-CG2 4.05Å; F116-V137 HydrophobicContact CZ-CG2 4.09Å; C135-V137 PolarHBondContact O-N 3.08Å; V137-P143 HydrophobicContact CG1-CG 4.19Å; V137-I145 HydrophobicContact CG1-CD1 3.46Å; V137-I145 VanDerWaalsContact CG1-CD1 3.46Å; V137-A187 HydrophobicContact CG1-CB 4.3Å; V137-A187 HydrophobicContact CG2-CB 4.04Å
138	V	89.1	Confident	91	Very high	46 Å²	46	43.6 Å²	43.6	28%	0.279	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	136.7	-175.5	-169.3	0	0	0	0	110	T115 Q117	T115-V138 PolarHBondContact N-O 3.09Å; T115-V138 PolarHBondContact O-N 3.5Å; Q117-V138 HydrophobicContact CG-CG2 3.86Å
139	S	89.3	Confident	91	Very high	10 Å²	10	41.8 Å²	41.8	7%	0.07	24%	0.243	C	C	.	.			trans	-152.2	164.7	166.7	67.8	0	0	0	0	110.5	Q112 P141 P143 V189	Q112-S139 CarbonylContact O-C 3.59Å; Q112-S139 WeakPolarHBondContact O-CA 3.38Å; Q112-S139 WeakPolarHBondContact O-CB 3.47Å; S139-P141 CarbonylContact C-O 3.52Å; S139-P141 VanDerWaalsContact C-O 3.29Å; S139-P141 CarbonylContact O-C 3.4Å; S139-P141 PolarHBondContact OG-O 3.18Å; S139-P143 WeakPolarHBondContact OG-CD 3.38Å; S139-V189 VanDerWaalsContact OG-CG2 3.29Å; S139-V189 WeakPolarHBondContact OG-CG2 3.46Å
140	S	85.8	Confident	90.6	Very high	58 Å²	58	44.6 Å²	44.6	41%	0.406	25%	0.251	S	S	.	.	S	Bend	trans	-123.8	125	167.7	-174.4	0	0	0	0	110.1	Q112 R192	Q112-S140 PolarHBondContact O-N 3.15Å; S140-R192 PolarHBondContact O-NE 2.7Å; S140-R192 PolarHBondContact O-NH2 2.87Å
141	P	85.2	Confident	89.9	Confident	56 Å²	56	42.9 Å²	42.9	36%	0.364	26%	0.26	S	S	.	.	S	Bend	cis	-61.1	167.3	-11.8	29.4	-35.2	0	0	0	112	S139 V189 A191	S139-P141 CarbonylContact C-O 3.52Å; S139-P141 VanDerWaalsContact C-O 3.29Å; S139-P141 CarbonylContact O-C 3.4Å; S139-P141 PolarHBondContact OG-O 3.18Å; P141-V189 HydrophobicContact CG-CG1 3.9Å; P141-A191 HydrophobicContact CG-CB 4.38Å
142	P	86.6	Confident	89.5	Confident	107 Å²	107	46.7 Å²	46.7	70%	0.695	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-55.4	146	-178.6	-27.8	36.2	0	0	0	113.4
143	P	91.4	Very high	89.2	Confident	28 Å²	28	49.3 Å²	49.3	18%	0.182	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-83.3	147.6	-175.5	32.7	-30.6	0	0	0	111.5	V137 S139 I145 A187 V189	V137-P143 HydrophobicContact CG1-CG 4.19Å; S139-P143 WeakPolarHBondContact OG-CD 3.38Å; P143-I145 HydrophobicContact CB-CD1 4.18Å; P143-I145 HydrophobicContact CG-CD1 3.93Å; P143-A187 HydrophobicContact CB-CB 4.02Å; P143-V189 HydrophobicContact CB-CG2 4.32Å
144	T	91.1	Very high	88.8	Confident	83 Å²	83	50.3 Å²	50.3	51%	0.509	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	123.5	163.1	-56.3	0	0	0	0	108.9	R188	T144-R188 PolarHBondContact N-O 3.33Å; T144-R188 PolarHBondContact O-N 3.27Å
145	I	91.9	Very high	87.9	Confident	25 Å²	25	52.1 Å²	52.1	13%	0.128	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	137.3	-179.6	-51	-54	0	0	0	111.3	V137 P143 A187	V137-I145 HydrophobicContact CG1-CD1 3.46Å; V137-I145 VanDerWaalsContact CG1-CD1 3.46Å; P143-I145 HydrophobicContact CB-CD1 4.18Å; P143-I145 HydrophobicContact CG-CD1 3.93Å; I145-A187 HydrophobicContact CD1-CB 3.9Å
146	I	91.7	Very high	86.6	Confident	20 Å²	20	54.7 Å²	54.7	10%	0.103	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	112.5	176.4	-65.7	-177	0	0	0	108.7	K148 K153 E186	I146-K148 HydrophobicContact CG2-CG 4.27Å; I146-K153 HydrophobicContact CG2-CD 3.64Å; I146-K153 HydrophobicContact CG2-CG 3.95Å; I146-E186 HydrophobicContact CB-CB 4.23Å; I146-E186 PolarHBondContact N-O 3.42Å; I146-E186 WeakPolarHBondContact O-CB 3.41Å; I146-E186 PolarHBondContact O-N 2.71Å
147	W	93.2	Very high	85.2	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	139	172.5	-71.9	92.9	0	0	0	111.9	I133 C135 L154 G168 L170 Y183 N184 C185 I200	I133-W147 HydrophobicContact CB-CH2 4.11Å; I133-W147 HydrophobicContact CG2-CH2 3.56Å; I133-W147 HydrophobicContact CG2-CZ3 3.85Å; I133-W147 WeakPolarHBondContact O-CH2 3.43Å; I133-W147 VanDerWaalsContact O-CZ2 3.31Å; I133-W147 WeakPolarHBondContact O-CZ2 3.24Å; C135-W147 HydrophobicContact CB-CH2 3.69Å; C135-W147 HydrophobicContact CB-CZ2 3.38Å; W147-L154 HydrophobicContact CB-CB 4.43Å; W147-L154 HydrophobicContact CB-CD1 4.24Å; W147-L154 PolarHBondContact O-N 3.39Å; W147-G168 PolarHBondContact NE1-O 2.6Å; W147-L170 HydrophobicContact CB-CD2 4.04Å; W147-L170 HydrophobicContact CD2-CB 3.65Å; W147-L170 HydrophobicContact CD2-CD2 3.84Å; W147-L170 HydrophobicContact CD2-CG 4.37Å; W147-L170 VanDerWaalsContact CE2-CB 3.46Å; W147-L170 HydrophobicContact CE3-CB 4.23Å; W147-L170 HydrophobicContact CE3-CD2 3.89Å; W147-L170 HydrophobicContact CG-CB 3.9Å; W147-L170 HydrophobicContact CG-CD2 3.93Å; W147-L170 HydrophobicContact CG-CG 4.39Å; W147-L170 HydrophobicContact CH2-CB 4.35Å; W147-L170 HydrophobicContact CZ2-CB 3.83Å; W147-Y183 HydrophobicContact CE3-CD1 4.34Å; W147-N184 CarbonylContact C-O 3.54Å; W147-N184 WeakPolarHBondContact CA-O 3.49Å; W147-C185 HydrophobicContact CD2-CB 4.27Å; W147-C185 HydrophobicContact CE3-CB 4.02Å; W147-C185 HydrophobicContact CH2-CB 3.86Å; W147-C185 HydrophobicContact CZ2-CB 4.08Å; W147-C185 HydrophobicContact CZ3-CB 3.81Å; W147-I200 HydrophobicContact CH2-CD1 3.64Å; W147-I200 HydrophobicContact CZ3-CD1 3.93Å
148	K	91.6	Very high	83.9	Confident	50 Å²	50	64 Å²	64	22%	0.217	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	142.7	171.1	-42.3	175.4	-171.1	164.8	0	110.4	I146 S152 K153 N184 E186	I146-K148 HydrophobicContact CG2-CG 4.27Å; K148-S152 CarbonylContact C-O 3.55Å; K148-S152 WeakPolarHBondContact CA-O 3.4Å; K148-S152 WeakPolarHBondContact CB-O 3.35Å; K148-K153 HydrophobicContact CG-CB 4.44Å; K148-N184 HydrophobicContact CB-CB 4.23Å; K148-N184 PolarHBondContact N-O 3.44Å; K148-N184 PolarHBondContact O-N 3.47Å; K148-E186 WeakPolarHBondContact CE-OE1 3.38Å; K148-E186 WeakPolarHBondContact CE-OE2 3.32Å; K148-E186 VanDerWaalsContact NZ-CD 3.29Å; K148-E186 IonicContact NZ-OE1 3.92Å; K148-E186 IonicContact NZ-OE2 3.73Å; K148-E186 PolarHBondContact NZ-OE2 2.98Å
149	H	89.8	Confident	83.1	Confident	14 Å²	14	64.1 Å²	64.1	7%	0.065	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	140.4	171.9	-177.9	-159.3	0	0	0	108.7	G151 S152 L154 D179 Y183	H149-G151 PolarHBondContact O-N 2.75Å; H149-G151 VanDerWaalsContact O-N 3.16Å; H149-S152 PolarHBondContact N-O 3.24Å; H149-S152 PolarHBondContact O-N 2.7Å; H149-L154 HydrophobicContact CB-CD1 4.15Å; H149-L154 HydrophobicContact CB-CD2 4.17Å; H149-L154 HydrophobicContact CB-CG 4.31Å; H149-D179 PolarHBondContact CE1-O 2.85Å; H149-Y183 HydrophobicContact CB-CD1 4.06Å; H149-Y183 HydrophobicContact CB-CE1 3.84Å; H149-Y183 HydrophobicContact CB-CE2 4.5Å; H149-Y183 HydrophobicContact CB-CG 4.49Å; H149-Y183 AromaticContact CD2-CE2 3.76Å; H149-Y183 AromaticContact CE1-CE2 3.57Å; H149-Y183 AromaticContact CE1-CZ 3.63Å; H149-Y183 PolarHBondContact CE1-OH 2.69Å; H149-Y183 AromaticContact CG-CE1 3.93Å; H149-Y183 AromaticContact CG-CE2 3.78Å; H149-Y183 AromaticContact CG-CZ 3.61Å; H149-Y183 AromaticContact ND1-CE1 3.95Å; H149-Y183 AromaticContact ND1-CE2 3.67Å; H149-Y183 AromaticContact ND1-CZ 3.3Å; H149-Y183 VanDerWaalsContact ND1-CZ 3.3Å; H149-Y183 PolarHBondContact ND1-OH 3.36Å; H149-Y183 VanDerWaalsContact ND1-OH 3.08Å; H149-Y183 AromaticContact NE2-CE2 3.71Å
150	K	84.4	Confident	82.6	Confident	140 Å²	140	69.4 Å²	69.4	61%	0.609	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	44.2	-178	-70.4	154.1	-175.7	164.3	0	111.5	S152 V178 E180	K150-S152 PolarHBondContact O-N 2.75Å; K150-S152 VanDerWaalsContact O-N 3.12Å; K150-V178 PolarHBondContact NZ-O 3.01Å; K150-E180 PolarHBondContact NZ-O 2.88Å
151	G	79.5	Confident	82.7	Confident	73 Å²	73	69.4 Å²	69.4	75%	0.753	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	-20.7	-177.3	0	0	0	0	0	116.3	H149	H149-G151 PolarHBondContact O-N 2.75Å; H149-G151 VanDerWaalsContact O-N 3.16Å
152	S	85.6	Confident	82.9	Confident	81 Å²	81	68.1 Å²	68.1	57%	0.566	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	136.6	-172.2	-66	0	0	0	0	112.7	K148 H149 K150 L154	K148-S152 CarbonylContact C-O 3.55Å; K148-S152 WeakPolarHBondContact CA-O 3.4Å; K148-S152 WeakPolarHBondContact CB-O 3.35Å; H149-S152 PolarHBondContact N-O 3.24Å; H149-S152 PolarHBondContact O-N 2.7Å; K150-S152 PolarHBondContact O-N 2.75Å; K150-S152 VanDerWaalsContact O-N 3.12Å; S152-L154 PolarHBondContact O-N 2.8Å
153	K	86.8	Confident	83	Confident	106 Å²	106	67.4 Å²	67.4	46%	0.461	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	124.7	172.6	175	168.9	-179.7	167.1	0	110.4	I146 K148 Q155	I146-K153 HydrophobicContact CG2-CD 3.64Å; I146-K153 HydrophobicContact CG2-CG 3.95Å; K148-K153 HydrophobicContact CG-CB 4.44Å; K153-Q155 HydrophobicContact CG-CG 4.49Å
154	L	85.5	Confident	82.9	Confident	22 Å²	22	68.6 Å²	68.6	12%	0.115	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-71.6	140.2	174	-63.4	178.5	0	0	0	110.2	W147 H149 S152 Y162 L170 Y183	W147-L154 HydrophobicContact CB-CB 4.43Å; W147-L154 HydrophobicContact CB-CD1 4.24Å; W147-L154 PolarHBondContact O-N 3.39Å; H149-L154 HydrophobicContact CB-CD1 4.15Å; H149-L154 HydrophobicContact CB-CD2 4.17Å; H149-L154 HydrophobicContact CB-CG 4.31Å; S152-L154 PolarHBondContact O-N 2.8Å; L154-Y162 HydrophobicContact CD2-CD2 4.07Å; L154-Y162 HydrophobicContact CD2-CE2 3.94Å; L154-L170 HydrophobicContact CD1-CD1 4.47Å; L154-L170 HydrophobicContact CD1-CD2 3.53Å; L154-Y183 HydrophobicContact CD1-CD1 4.21Å; L154-Y183 HydrophobicContact CD1-CE1 3.87Å
155	Q	73.9	Confident	82.8	Confident	88 Å²	88	67.1 Å²	67.1	41%	0.411	37%	0.367	S	S	.	.			trans	-138.4	111.2	-176.8	-65.6	-176.5	-47.4	0	0	108.8	K153 A157 K158	K153-Q155 HydrophobicContact CG-CG 4.49Å; Q155-A157 PolarHBondContact O-N 2.9Å; Q155-K158 HydrophobicContact CB-CD 4.41Å; Q155-K158 HydrophobicContact CB-CG 4.45Å; Q155-K158 PolarHBondContact O-N 3.37Å
156	S	63.7	Low	82.6	Confident	58 Å²	58	73.8 Å²	73.8	41%	0.406	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-8.7	-179.8	-57.8	0	0	0	0	115.1	Y162	S156-Y162 WeakPolarHBondContact CA-O 3.36Å; S156-Y162 WeakPolarHBondContact CB-O 3.32Å; S156-Y162 PolarHBondContact OG-O 2.83Å
157	A	61.3	Low	82.3	Confident	106 Å²	106	77 Å²	77	88%	0.876	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-1.2	172.1	0	0	0	0	0	114	Q155	Q155-A157 PolarHBondContact O-N 2.9Å
158	K	63.9	Low	82	Confident	173 Å²	173	77.3 Å²	77.3	75%	0.752	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116	-31.3	-179	-75.3	-176.7	175.2	163.4	0	114.7	Q155	Q155-K158 HydrophobicContact CB-CD 4.41Å; Q155-K158 HydrophobicContact CB-CG 4.45Å; Q155-K158 PolarHBondContact O-N 3.37Å
159	D	72.9	Confident	82	Confident	49 Å²	49	75.8 Å²	75.8	26%	0.262	42%	0.418	S	S	.	.			trans	-131.9	122	168.3	-179.4	-8.6	0	0	0	107.6	R161 Y162	D159-R161 PolarHBondContact O-N 3.39Å; D159-R161 WeakPolarHBondContact OD1-CB 3.37Å; D159-R161 WeakPolarHBondContact OD1-CG 3.35Å; D159-R161 PolarHBondContact OD1-N 3.31Å; D159-R161 IonicContact OD1-NE 2.79Å; D159-R161 IonicContact OD2-CZ 2.81Å; D159-R161 IonicContact OD2-NE 2.68Å; D159-R161 PolarHBondContact OD2-NE 3.1Å; D159-R161 IonicContact OD2-NH2 3.21Å; D159-R161 PolarHBondContact OD2-NH2 2.99Å; D159-Y162 HydrophobicContact CB-CD2 3.66Å; D159-Y162 HydrophobicContact CB-CE2 3.83Å; D159-Y162 PolarHBondContact O-N 3.04Å; D159-Y162 WeakPolarHBondContact OD2-CE2 3.49Å
160	V	78.4	Confident	82.2	Confident	121 Å²	121	75.1 Å²	75.1	73%	0.733	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-13.5	-175.9	-174.2	0	0	0	0	111.9
161	R	88.3	Confident	82.6	Confident	58 Å²	58	69.9 Å²	69.9	22%	0.219	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-27.5	174.7	-59.7	-172.8	-50	131.2	5.7	113.4	D159 R173 G174 D179	D159-R161 PolarHBondContact O-N 3.39Å; D159-R161 WeakPolarHBondContact OD1-CB 3.37Å; D159-R161 WeakPolarHBondContact OD1-CG 3.35Å; D159-R161 PolarHBondContact OD1-N 3.31Å; D159-R161 IonicContact OD1-NE 2.79Å; D159-R161 IonicContact OD2-CZ 2.81Å; D159-R161 IonicContact OD2-NE 2.68Å; D159-R161 PolarHBondContact OD2-NE 3.1Å; D159-R161 IonicContact OD2-NH2 3.21Å; D159-R161 PolarHBondContact OD2-NH2 2.99Å; R161-R173 HydrophobicContact CB-CB 4.4Å; R161-R173 WeakPolarHBondContact CD-O 3.28Å; R161-R173 PolarHBondContact O-N 3.49Å; R161-G174 PolarHBondContact NH1-O 3.37Å; R161-G174 VanDerWaalsContact NH1-O 3.14Å; R161-D179 IonicContact CZ-OD1 2.67Å; R161-D179 IonicContact CZ-OD2 3.37Å; R161-D179 IonicContact NH1-OD1 3.01Å; R161-D179 IonicContact NH1-OD2 3.38Å; R161-D179 PolarHBondContact NH1-OD2 2.8Å; R161-D179 IonicContact NH2-OD1 2.76Å; R161-D179 PolarHBondContact NH2-OD1 2.74Å; R161-D179 IonicContact NH2-OD2 3.36Å; R161-D179 PolarHBondContact NH2-OD2 2.83Å
162	Y	88.8	Confident	83.3	Confident	29 Å²	29	66.4 Å²	66.4	11%	0.114	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	111.8	-176.6	-56.5	-43.1	0	0	0	111.7	L154 S156 D159 L171 I172 D179	L154-Y162 HydrophobicContact CD2-CD2 4.07Å; L154-Y162 HydrophobicContact CD2-CE2 3.94Å; S156-Y162 WeakPolarHBondContact CA-O 3.36Å; S156-Y162 WeakPolarHBondContact CB-O 3.32Å; S156-Y162 PolarHBondContact OG-O 2.83Å; D159-Y162 HydrophobicContact CB-CD2 3.66Å; D159-Y162 HydrophobicContact CB-CE2 3.83Å; D159-Y162 PolarHBondContact O-N 3.04Å; D159-Y162 WeakPolarHBondContact OD2-CE2 3.49Å; Y162-L171 WeakPolarHBondContact CA-O 3.4Å; Y162-I172 HydrophobicContact CD1-CB 4.32Å; Y162-I172 HydrophobicContact CD1-CD1 4.28Å; Y162-I172 HydrophobicContact CD1-CG1 3.89Å; Y162-I172 HydrophobicContact CD1-CG2 4.01Å; Y162-I172 HydrophobicContact CE1-CB 4.47Å; Y162-I172 HydrophobicContact CE1-CD1 3.99Å; Y162-I172 HydrophobicContact CE1-CG1 4.07Å; Y162-I172 HydrophobicContact CE1-CG2 3.8Å; Y162-D179 PolarHBondContact OH-OD1 3.06Å
163	K	89	Confident	83.6	Confident	92 Å²	92	68.6 Å²	68.6	40%	0.4	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	120	169.8	-175.1	-170.4	173.8	-160.9	0	110	M165 L171	K163-M165 HydrophobicContact CD-CG 4.4Å; K163-L171 HydrophobicContact CB-CB 4.35Å; K163-L171 PolarHBondContact N-O 2.85Å; K163-L171 WeakPolarHBondContact O-CB 3.43Å; K163-L171 PolarHBondContact O-N 2.86Å
164	I	89.8	Confident	83.8	Confident	53 Å²	53	64.6 Å²	64.6	27%	0.272	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	126.5	161.7	-54.8	176.5	0	0	0	107.3	H169 L170	I164-H169 WeakPolarHBondContact CA-O 3.48Å; I164-L170 HydrophobicContact CG1-CD1 4.36Å
165	M	89.2	Confident	84.2	Confident	51 Å²	51	63.6 Å²	63.6	25%	0.251	34%	0.337	S	S	.	.			trans	-90	163.6	-178.6	-78.6	176.2	34.6	0	0	111.9	K163 N167 G168 H169 L171	K163-M165 HydrophobicContact CD-CG 4.4Å; M165-N167 WeakPolarHBondContact CB-OD1 3.33Å; M165-N167 PolarHBondContact O-N 2.94Å; M165-G168 WeakPolarHBondContact O-CA 3.17Å; M165-G168 PolarHBondContact O-N 2.83Å; M165-H169 PolarHBondContact N-O 2.83Å; M165-L171 HydrophobicContact CG-CB 4.37Å; M165-L171 HydrophobicContact SD-CB 3.88Å; M165-L171 HydrophobicContact SD-CD2 4.23Å; M165-L171 HydrophobicContact SD-CG 4.48Å
166	D	86.9	Confident	85	Confident	165 Å²	165	64.9 Å²	64.9	88%	0.882	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-17.3	-172.2	-50.7	-69.9	0	0	0	113	G168	D166-G168 VanDerWaalsContact C-N 3.33Å
167	N	85.1	Confident	86.3	Confident	88 Å²	88	64.9 Å²	64.9	47%	0.471	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-3.1	168.7	65.6	-11	0	0	0	113.8	M165 H169	M165-N167 WeakPolarHBondContact CB-OD1 3.33Å; M165-N167 PolarHBondContact O-N 2.94Å; N167-H169 PolarHBondContact ND2-CE1 2.94Å; N167-H169 PolarHBondContact ND2-ND1 2.83Å; N167-H169 WeakPolarHBondContact OD1-CB 3.43Å; N167-H169 PolarHBondContact OD1-N 2.88Å
168	G	87	Confident	87.7	Confident	7 Å²	7	65 Å²	65	7%	0.072	32%	0.323	C	S	.	.	S	Bend	trans	90.2	-7.7	-177.4	0	0	0	0	0	115.7	W147 M165 D166	W147-G168 PolarHBondContact NE1-O 2.6Å; M165-G168 WeakPolarHBondContact O-CA 3.17Å; M165-G168 PolarHBondContact O-N 2.83Å; D166-G168 VanDerWaalsContact C-N 3.33Å
169	H	92.3	Very high	89	Confident	18 Å²	18	57 Å²	57	8%	0.083	29%	0.289	C	S	.	.			trans	-70.6	161.7	179.1	-61.8	-176.5	0	0	0	111.7	D132 C135 D136 I164 M165 N167	D132-H169 VanDerWaalsContact OD1-CB 3.32Å; D132-H169 WeakPolarHBondContact OD1-CB 3.29Å; C135-H169 PolarHBondContact N-CD2 2.89Å; C135-H169 VanDerWaalsContact N-CD2 3.27Å; D136-H169 IonicContact OD1-CD2 3.43Å; D136-H169 IonicContact OD1-CE1 3.13Å; D136-H169 PolarHBondContact OD1-CE1 2.88Å; D136-H169 IonicContact OD1-NE2 3.79Å; D136-H169 PolarHBondContact OD1-NE2 3.14Å; I164-H169 WeakPolarHBondContact CA-O 3.48Å; M165-H169 PolarHBondContact N-O 2.83Å; N167-H169 PolarHBondContact ND2-CE1 2.94Å; N167-H169 PolarHBondContact ND2-ND1 2.83Å; N167-H169 WeakPolarHBondContact OD1-CB 3.43Å; N167-H169 PolarHBondContact OD1-N 2.88Å
170	L	93	Very high	90	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	105.6	179.6	171	64.5	0	0	0	111.2	I133 W147 L154 I164 I172 Y183	I133-L170 HydrophobicContact CB-CB 4.27Å; I133-L170 WeakPolarHBondContact CB-O 3.09Å; I133-L170 HydrophobicContact CD1-CD2 4.04Å; I133-L170 HydrophobicContact CD1-CG 4.29Å; I133-L170 PolarHBondContact N-O 2.89Å; I133-L170 PolarHBondContact O-N 2.84Å; W147-L170 HydrophobicContact CB-CD2 4.04Å; W147-L170 HydrophobicContact CD2-CB 3.65Å; W147-L170 HydrophobicContact CD2-CD2 3.84Å; W147-L170 HydrophobicContact CD2-CG 4.37Å; W147-L170 VanDerWaalsContact CE2-CB 3.46Å; W147-L170 HydrophobicContact CE3-CB 4.23Å; W147-L170 HydrophobicContact CE3-CD2 3.89Å; W147-L170 HydrophobicContact CG-CB 3.9Å; W147-L170 HydrophobicContact CG-CD2 3.93Å; W147-L170 HydrophobicContact CG-CG 4.39Å; W147-L170 HydrophobicContact CH2-CB 4.35Å; W147-L170 HydrophobicContact CZ2-CB 3.83Å; L154-L170 HydrophobicContact CD1-CD1 4.47Å; L154-L170 HydrophobicContact CD1-CD2 3.53Å; I164-L170 HydrophobicContact CG1-CD1 4.36Å; L170-I172 HydrophobicContact CG-CG1 4.27Å; L170-Y183 HydrophobicContact CD2-CD1 3.66Å; L170-Y183 HydrophobicContact CD2-CE1 3.69Å
171	L	93.1	Very high	90.7	Very high	29 Å²	29	52.5 Å²	52.5	15%	0.152	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	121.5	171.1	-174.2	68.2	0	0	0	110.6	N130 A131 D132 Y162 K163 M165 R173	N130-L171 HydrophobicContact CB-CD1 4.19Å; A131-L171 CarbonylContact O-C 3.47Å; A131-L171 WeakPolarHBondContact O-CA 3.41Å; D132-L171 HydrophobicContact CB-CD1 4.29Å; Y162-L171 WeakPolarHBondContact CA-O 3.4Å; K163-L171 HydrophobicContact CB-CB 4.35Å; K163-L171 PolarHBondContact N-O 2.85Å; K163-L171 WeakPolarHBondContact O-CB 3.43Å; K163-L171 PolarHBondContact O-N 2.86Å; M165-L171 HydrophobicContact CG-CB 4.37Å; M165-L171 HydrophobicContact SD-CB 3.88Å; M165-L171 HydrophobicContact SD-CD2 4.23Å; M165-L171 HydrophobicContact SD-CG 4.48Å; L171-R173 HydrophobicContact CD2-CG 4.39Å; L171-R173 HydrophobicContact CG-CG 4.46Å
172	I	94.2	Very high	91	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	113.8	166.7	-50.1	-171.6	0	0	0	108.5	N130 A131 I133 Y162 L170 I175 Y183	N130-I172 CarbonylContact C-O 3.48Å; N130-I172 WeakPolarHBondContact CA-O 3.37Å; A131-I172 HydrophobicContact CB-CB 4.38Å; A131-I172 PolarHBondContact N-O 3.2Å; A131-I172 PolarHBondContact O-N 2.83Å; I133-I172 HydrophobicContact CD1-CD1 3.49Å; I133-I172 VanDerWaalsContact CD1-CD1 3.49Å; I133-I172 HydrophobicContact CD1-CG1 3.88Å; Y162-I172 HydrophobicContact CD1-CB 4.32Å; Y162-I172 HydrophobicContact CD1-CD1 4.28Å; Y162-I172 HydrophobicContact CD1-CG1 3.89Å; Y162-I172 HydrophobicContact CD1-CG2 4.01Å; Y162-I172 HydrophobicContact CE1-CB 4.47Å; Y162-I172 HydrophobicContact CE1-CD1 3.99Å; Y162-I172 HydrophobicContact CE1-CG1 4.07Å; Y162-I172 HydrophobicContact CE1-CG2 3.8Å; L170-I172 HydrophobicContact CG-CG1 4.27Å; I172-I175 HydrophobicContact CD1-CD1 4.37Å; I172-I175 HydrophobicContact CG2-CB 4.17Å; I172-I175 HydrophobicContact CG2-CG1 4.24Å; I172-Y183 HydrophobicContact CD1-CE1 3.85Å; I172-Y183 VanDerWaalsContact CD1-OH 3.25Å; I172-Y183 WeakPolarHBondContact CD1-OH 3.15Å
173	R	92.4	Very high	91.2	Very high	127 Å²	127	52.6 Å²	52.6	48%	0.479	27%	0.269	S	S	.	.	S	Bend	trans	-81.9	126	177.1	-67.1	172.5	165.1	171.8	-9.4	111.8	N130 R161 L171	N130-R173 VanDerWaalsContact OD1-CA 3.29Å; N130-R173 WeakPolarHBondContact OD1-CA 3.43Å; R161-R173 HydrophobicContact CB-CB 4.4Å; R161-R173 WeakPolarHBondContact CD-O 3.28Å; R161-R173 PolarHBondContact O-N 3.49Å; L171-R173 HydrophobicContact CD2-CG 4.39Å; L171-R173 HydrophobicContact CG-CG 4.46Å
174	G	91.4	Very high	91.4	Very high	23 Å²	23	49.4 Å²	49.4	24%	0.237	26%	0.256	C	S	.	.	S	Bend	trans	57.2	64.3	-176.9	0	0	0	0	0	110.2	D129 R161	D129-G174 CarbonylContact O-C 3.53Å; D129-G174 VanDerWaalsContact O-CA 3.29Å; D129-G174 WeakPolarHBondContact O-CA 3.49Å; D129-G174 PolarHBondContact O-N 3.22Å; D129-G174 VanDerWaalsContact O-N 3.1Å; R161-G174 PolarHBondContact NH1-O 3.37Å; R161-G174 VanDerWaalsContact NH1-O 3.14Å
175	I	92.9	Very high	91.6	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.243	C	C	.	.			trans	-61.2	138.4	178.8	-166.8	168.1	0	0	0	109.8	F125 N126 E127 G128 D129 A131 I172 D179 V202 V204	F125-I175 HydrophobicContact CB-CG2 4.07Å; F125-I175 HydrophobicContact CD2-CD1 4.21Å; N126-I175 WeakPolarHBondContact O-CG2 3.16Å; E127-I175 WeakPolarHBondContact CA-O 3.38Å; G128-I175 PolarHBondContact N-O 2.67Å; D129-I175 PolarHBondContact O-N 2.92Å; A131-I175 HydrophobicContact CB-CB 4.02Å; A131-I175 HydrophobicContact CB-CD1 3.61Å; A131-I175 HydrophobicContact CB-CG1 4.38Å; A131-I175 HydrophobicContact CB-CG2 4.11Å; I172-I175 HydrophobicContact CD1-CD1 4.37Å; I172-I175 HydrophobicContact CG2-CB 4.17Å; I172-I175 HydrophobicContact CG2-CG1 4.24Å; I175-D179 HydrophobicContact CG1-CB 3.9Å; I175-V202 HydrophobicContact CD1-CG1 3.79Å; I175-V204 HydrophobicContact CD1-CG2 3.7Å; I175-V204 HydrophobicContact CG1-CG2 3.84Å
176	K	92.3	Very high	91.8	Very high	115 Å²	115	45.2 Å²	45.2	50%	0.5	24%	0.235	S	C	.	.			trans	-122.5	160.3	-178.8	-62.5	-167.4	177.6	-166.4	0	111.5	E127 V178 D179	E127-K176 WeakPolarHBondContact OE1-CA 3.48Å; E127-K176 WeakPolarHBondContact OE1-CB 3.39Å; K176-V178 HydrophobicContact CB-CG2 3.86Å; K176-V178 PolarHBondContact O-N 2.91Å; K176-D179 PolarHBondContact N-OD2 2.89Å; K176-D179 WeakPolarHBondContact O-CA 3.27Å; K176-D179 VanDerWaalsContact O-CB 3.28Å; K176-D179 WeakPolarHBondContact O-CB 3.5Å; K176-D179 PolarHBondContact O-N 2.83Å
177	K	91	Very high	92.1	Very high	59 Å²	59	37.3 Å²	37.3	26%	0.257	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-56.7	-27.4	177.9	-167.6	55	164.5	176.2	0	113.1	E127 D179 E180 V204 V206	E127-K177 PolarHBondContact OE1-N 2.85Å; K177-D179 VanDerWaalsContact C-N 3.3Å; K177-D179 PolarHBondContact O-N 2.83Å; K177-E180 HydrophobicContact CD-CB 4.49Å; K177-E180 WeakPolarHBondContact CE-OE1 3.39Å; K177-E180 IonicContact NZ-OE1 2.65Å; K177-E180 PolarHBondContact NZ-OE1 3.15Å; K177-E180 IonicContact NZ-OE2 2.77Å; K177-E180 PolarHBondContact NZ-OE2 3.15Å; K177-E180 WeakPolarHBondContact O-CB 3.34Å; K177-E180 PolarHBondContact O-N 2.9Å; K177-V204 HydrophobicContact CD-CB 4.09Å; K177-V204 WeakPolarHBondContact CD-O 3.3Å; K177-V204 PolarHBondContact NZ-O 2.98Å; K177-V206 HydrophobicContact CB-CG2 4.27Å; K177-V206 HydrophobicContact CD-CG2 4.12Å; K177-V206 HydrophobicContact CG-CG2 4.27Å
178	V	90.3	Very high	92.5	Very high	107 Å²	107	36.4 Å²	36.4	65%	0.648	18%	0.183	S	C	*	.	G	3₁₀ helix	trans	-70.1	-20.2	173.1	-62.9	0	0	0	0	114.8	K150 K176 E180	K150-V178 PolarHBondContact NZ-O 3.01Å; K176-V178 HydrophobicContact CB-CG2 3.86Å; K176-V178 PolarHBondContact O-N 2.91Å; V178-E180 VanDerWaalsContact C-N 3.31Å
179	D	91.4	Very high	92.7	Very high	6 Å²	6	36.2 Å²	36.2	3%	0.032	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-82.6	-9.9	173.8	-55.1	-45.4	0	0	0	111.9	H149 R161 Y162 I175 K176 K177 Y183	H149-D179 PolarHBondContact CE1-O 2.85Å; R161-D179 IonicContact CZ-OD1 2.67Å; R161-D179 IonicContact CZ-OD2 3.37Å; R161-D179 IonicContact NH1-OD1 3.01Å; R161-D179 IonicContact NH1-OD2 3.38Å; R161-D179 PolarHBondContact NH1-OD2 2.8Å; R161-D179 IonicContact NH2-OD1 2.76Å; R161-D179 PolarHBondContact NH2-OD1 2.74Å; R161-D179 IonicContact NH2-OD2 3.36Å; R161-D179 PolarHBondContact NH2-OD2 2.83Å; Y162-D179 PolarHBondContact OH-OD1 3.06Å; I175-D179 HydrophobicContact CG1-CB 3.9Å; K176-D179 PolarHBondContact N-OD2 2.89Å; K176-D179 WeakPolarHBondContact O-CA 3.27Å; K176-D179 VanDerWaalsContact O-CB 3.28Å; K176-D179 WeakPolarHBondContact O-CB 3.5Å; K176-D179 PolarHBondContact O-N 2.83Å; K177-D179 VanDerWaalsContact C-N 3.3Å; K177-D179 PolarHBondContact O-N 2.83Å; D179-Y183 VanDerWaalsContact O-CE2 3.29Å; D179-Y183 WeakPolarHBondContact O-CE2 3.35Å; D179-Y183 PolarHBondContact O-OH 2.76Å
180	E	93.6	Very high	92.3	Very high	54 Å²	54	42.6 Å²	42.6	25%	0.252	21%	0.212	S	C	.	.			trans	-58.5	142.3	174.6	-172.1	167.2	78.3	0	0	111.7	K150 K177 V178 V202 I203 V204	K150-E180 PolarHBondContact NZ-O 2.88Å; K177-E180 HydrophobicContact CD-CB 4.49Å; K177-E180 WeakPolarHBondContact CE-OE1 3.39Å; K177-E180 IonicContact NZ-OE1 2.65Å; K177-E180 PolarHBondContact NZ-OE1 3.15Å; K177-E180 IonicContact NZ-OE2 2.77Å; K177-E180 PolarHBondContact NZ-OE2 3.15Å; K177-E180 WeakPolarHBondContact O-CB 3.34Å; K177-E180 PolarHBondContact O-N 2.9Å; V178-E180 VanDerWaalsContact C-N 3.31Å; E180-V202 WeakPolarHBondContact CG-O 3.38Å; E180-I203 WeakPolarHBondContact OE2-CA 3.31Å; E180-V204 HydrophobicContact CB-CB 4.41Å; E180-V204 HydrophobicContact CB-CG2 4.04Å; E180-V204 PolarHBondContact OE2-N 2.82Å
181	G	92.6	Very high	91.7	Very high	21 Å²	21	46.7 Å²	46.7	22%	0.216	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	152.4	-167.2	176.2	0	0	0	0	0	115.2	V202	G181-V202 PolarHBondContact N-O 3Å; G181-V202 PolarHBondContact O-N 2.94Å
182	M	93.9	Very high	91.2	Very high	89 Å²	89	48.3 Å²	48.3	44%	0.438	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	117	175.9	-62.7	-56.5	-58	0	0	110.6	M199 I200 K201	M182-M199 HydrophobicContact CB-CE 3.84Å; M182-M199 HydrophobicContact CE-CB 3.89Å; M182-I200 WeakPolarHBondContact CA-O 3.09Å; M182-K201 HydrophobicContact CE-CB 4.12Å; M182-K201 HydrophobicContact SD-CB 3.59Å; M182-K201 VanDerWaalsContact SD-CB 3.59Å; M182-K201 HydrophobicContact SD-CG 3.79Å
183	Y	93.9	Very high	90.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	138.6	174.2	-76.9	-111.6	0	0	0	109.6	I133 W147 H149 L154 L170 I172 D179 M199 I200 V202	I133-Y183 HydrophobicContact CD1-CD1 4.05Å; I133-Y183 HydrophobicContact CD1-CE1 4Å; I133-Y183 HydrophobicContact CD1-CG 4.4Å; W147-Y183 HydrophobicContact CE3-CD1 4.34Å; H149-Y183 HydrophobicContact CB-CD1 4.06Å; H149-Y183 HydrophobicContact CB-CE1 3.84Å; H149-Y183 HydrophobicContact CB-CE2 4.5Å; H149-Y183 HydrophobicContact CB-CG 4.49Å; H149-Y183 AromaticContact CD2-CE2 3.76Å; H149-Y183 AromaticContact CE1-CE2 3.57Å; H149-Y183 AromaticContact CE1-CZ 3.63Å; H149-Y183 PolarHBondContact CE1-OH 2.69Å; H149-Y183 AromaticContact CG-CE1 3.93Å; H149-Y183 AromaticContact CG-CE2 3.78Å; H149-Y183 AromaticContact CG-CZ 3.61Å; H149-Y183 AromaticContact ND1-CE1 3.95Å; H149-Y183 AromaticContact ND1-CE2 3.67Å; H149-Y183 AromaticContact ND1-CZ 3.3Å; H149-Y183 VanDerWaalsContact ND1-CZ 3.3Å; H149-Y183 PolarHBondContact ND1-OH 3.36Å; H149-Y183 VanDerWaalsContact ND1-OH 3.08Å; H149-Y183 AromaticContact NE2-CE2 3.71Å; L154-Y183 HydrophobicContact CD1-CD1 4.21Å; L154-Y183 HydrophobicContact CD1-CE1 3.87Å; L170-Y183 HydrophobicContact CD2-CD1 3.66Å; L170-Y183 HydrophobicContact CD2-CE1 3.69Å; I172-Y183 HydrophobicContact CD1-CE1 3.85Å; I172-Y183 VanDerWaalsContact CD1-OH 3.25Å; I172-Y183 WeakPolarHBondContact CD1-OH 3.15Å; D179-Y183 VanDerWaalsContact O-CE2 3.29Å; D179-Y183 WeakPolarHBondContact O-CE2 3.35Å; D179-Y183 PolarHBondContact O-OH 2.76Å; Y183-M199 CarbonylContact O-C 3.59Å; Y183-M199 WeakPolarHBondContact O-CA 3.43Å; Y183-I200 PolarHBondContact N-O 2.03Å; Y183-I200 PolarHBondContact O-N 3.07Å; Y183-V202 HydrophobicContact CD2-CB 3.96Å; Y183-V202 HydrophobicContact CD2-CG2 3.43Å; Y183-V202 VanDerWaalsContact CD2-CG2 3.43Å; Y183-V202 HydrophobicContact CE2-CB 4.02Å; Y183-V202 HydrophobicContact CE2-CG2 3.8Å; Y183-V202 HydrophobicContact CG-CG2 4.03Å
184	N	93.9	Very high	90.5	Very high	26 Å²	26	46.9 Å²	46.9	14%	0.139	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	113.3	175.4	-179.2	-27.3	0	0	0	108.5	W147 K148 F197 R198 M199	W147-N184 CarbonylContact C-O 3.54Å; W147-N184 WeakPolarHBondContact CA-O 3.49Å; K148-N184 HydrophobicContact CB-CB 4.23Å; K148-N184 PolarHBondContact N-O 3.44Å; K148-N184 PolarHBondContact O-N 3.47Å; N184-F197 WeakPolarHBondContact OD1-CB 3.3Å; N184-R198 WeakPolarHBondContact CA-O 3.34Å; N184-M199 HydrophobicContact CB-SD 3.7Å
185	C	93.6	Very high	90.5	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	105	167.5	179.4	0	0	0	0	108.7	C135 W147 F197 R198 I200	C135-C185 HydrophobicContact CB-CB 3.84Å; C135-C185 WeakPolarHBondContact CB-SG 3.45Å; C135-C185 WeakPolarHBondContact SG-CB 3.15Å; C135-C185 CovalentContact SG-SG 2.03Å; C135-C185 PolarHBondContact SG-SG 2.88Å; W147-C185 HydrophobicContact CD2-CB 4.27Å; W147-C185 HydrophobicContact CE3-CB 4.02Å; W147-C185 HydrophobicContact CH2-CB 3.86Å; W147-C185 HydrophobicContact CZ2-CB 4.08Å; W147-C185 HydrophobicContact CZ3-CB 3.81Å; C185-F197 CarbonylContact O-C 3.5Å; C185-F197 VanDerWaalsContact O-CA 3.31Å; C185-F197 WeakPolarHBondContact O-CA 3.31Å; C185-R198 PolarHBondContact N-O 2.88Å; C185-R198 PolarHBondContact O-N 2.89Å; C185-I200 HydrophobicContact CB-CD1 4.35Å
186	E	93.6	Very high	90.5	Very high	15 Å²	15	53.4 Å²	53.4	7%	0.07	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	114.9	-178.9	179.5	-172.6	77.8	0	0	109.8	I146 K148 R188 I195 F197	I146-E186 HydrophobicContact CB-CB 4.23Å; I146-E186 PolarHBondContact N-O 3.42Å; I146-E186 WeakPolarHBondContact O-CB 3.41Å; I146-E186 PolarHBondContact O-N 2.71Å; K148-E186 WeakPolarHBondContact CE-OE1 3.38Å; K148-E186 WeakPolarHBondContact CE-OE2 3.32Å; K148-E186 VanDerWaalsContact NZ-CD 3.29Å; K148-E186 IonicContact NZ-OE1 3.92Å; K148-E186 IonicContact NZ-OE2 3.73Å; K148-E186 PolarHBondContact NZ-OE2 2.98Å; E186-R188 VanDerWaalsContact CD-NE 3.32Å; E186-R188 HydrophobicContact CG-CG 4.34Å; E186-R188 IonicContact OE1-CZ 2.72Å; E186-R188 VanDerWaalsContact OE1-CZ 3.28Å; E186-R188 IonicContact OE1-NE 3.79Å; E186-R188 PolarHBondContact OE1-NE 3.27Å; E186-R188 IonicContact OE1-NH2 2.84Å; E186-R188 PolarHBondContact OE1-NH2 2.73Å; E186-R188 IonicContact OE2-CZ 3.58Å; E186-R188 IonicContact OE2-NE 2.71Å; E186-R188 IonicContact OE2-NH2 3.76Å; E186-R188 PolarHBondContact OE2-NH2 3.28Å; E186-I195 HydrophobicContact CG-CG2 4.06Å; E186-F197 HydrophobicContact CB-CB 4.17Å; E186-F197 HydrophobicContact CG-CB 4.38Å
187	A	93.4	Very high	90.5	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	138.2	177.7	0	0	0	0	0	110.4	I114 F116 V137 P143 I145 I195 D196	I114-A187 HydrophobicContact CD1-CB 4.3Å; I114-A187 WeakPolarHBondContact CD1-O 3.47Å; I114-A187 HydrophobicContact CG2-CB 3.72Å; F116-A187 HydrophobicContact CZ-CB 4.37Å; V137-A187 HydrophobicContact CG1-CB 4.3Å; V137-A187 HydrophobicContact CG2-CB 4.04Å; P143-A187 HydrophobicContact CB-CB 4.02Å; I145-A187 HydrophobicContact CD1-CB 3.9Å; A187-I195 WeakPolarHBondContact O-CA 3.42Å; A187-D196 PolarHBondContact N-O 2.96Å; A187-D196 PolarHBondContact O-N 3.13Å
188	R	92.9	Very high	90.6	Very high	69 Å²	69	52.6 Å²	52.6	26%	0.26	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	126.1	-177.7	-62.9	-171.9	173.8	-102.1	-7.4	112.9	T144 E186 E194 I195	T144-R188 PolarHBondContact N-O 3.33Å; T144-R188 PolarHBondContact O-N 3.27Å; E186-R188 VanDerWaalsContact CD-NE 3.32Å; E186-R188 HydrophobicContact CG-CG 4.34Å; E186-R188 IonicContact OE1-CZ 2.72Å; E186-R188 VanDerWaalsContact OE1-CZ 3.28Å; E186-R188 IonicContact OE1-NE 3.79Å; E186-R188 PolarHBondContact OE1-NE 3.27Å; E186-R188 IonicContact OE1-NH2 2.84Å; E186-R188 PolarHBondContact OE1-NH2 2.73Å; E186-R188 IonicContact OE2-CZ 3.58Å; E186-R188 IonicContact OE2-NE 2.71Å; E186-R188 IonicContact OE2-NH2 3.76Å; E186-R188 PolarHBondContact OE2-NH2 3.28Å; R188-E194 WeakPolarHBondContact CA-O 3.39Å; R188-I195 HydrophobicContact CG-CG1 4.27Å; R188-I195 HydrophobicContact CG-CG2 4.24Å
189	V	90.9	Very high	90.7	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.012	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	83.3	174.5	-175.1	0	0	0	0	109	I114 S139 P141 P143 A191 R192 G193 E194	I114-V189 HydrophobicContact CD1-CG2 4.01Å; I114-V189 HydrophobicContact CG1-CG2 3.75Å; S139-V189 VanDerWaalsContact OG-CG2 3.29Å; S139-V189 WeakPolarHBondContact OG-CG2 3.46Å; P141-V189 HydrophobicContact CG-CG1 3.9Å; P143-V189 HydrophobicContact CB-CG2 4.32Å; V189-A191 PolarHBondContact O-N 2.86Å; V189-R192 HydrophobicContact CG1-CB 4.36Å; V189-R192 PolarHBondContact O-N 2.75Å; V189-G193 PolarHBondContact O-N 2.71Å; V189-E194 HydrophobicContact CB-CB 4.16Å; V189-E194 HydrophobicContact CG2-CB 4.47Å; V189-E194 PolarHBondContact N-O 3.03Å
190	M	83.4	Confident	90.8	Very high	153 Å²	153	51.5 Å²	51.5	75%	0.754	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-34.1	-172.2	-65.6	-62.2	-65.3	0	0	114.1	R192	M190-R192 VanDerWaalsContact C-N 3.29Å; M190-R192 PolarHBondContact O-N 2.85Å
191	A	81.4	Confident	90.8	Very high	86 Å²	86	53.9 Å²	53.9	71%	0.711	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-19.3	-179.5	0	0	0	0	0	114.6	P141 V189	P141-A191 HydrophobicContact CG-CB 4.38Å; V189-A191 PolarHBondContact O-N 2.86Å
192	R	81.4	Confident	90.9	Very high	63 Å²	63	52.9 Å²	52.9	24%	0.238	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128	3.1	-176.9	-58.5	-168	-64.5	88.5	7	113.3	Q112 S140 V189 M190 E194	Q112-R192 PolarHBondContact O-NH2 2.94Å; S140-R192 PolarHBondContact O-NE 2.7Å; S140-R192 PolarHBondContact O-NH2 2.87Å; V189-R192 HydrophobicContact CG1-CB 4.36Å; V189-R192 PolarHBondContact O-N 2.75Å; M190-R192 VanDerWaalsContact C-N 3.29Å; M190-R192 PolarHBondContact O-N 2.85Å; R192-E194 HydrophobicContact CB-CG 4.45Å; R192-E194 IonicContact CZ-OE1 3.79Å; R192-E194 IonicContact CZ-OE2 2.64Å; R192-E194 IonicContact NH1-OE1 2.71Å; R192-E194 PolarHBondContact NH1-OE1 2.88Å; R192-E194 IonicContact NH1-OE2 2.67Å; R192-E194 PolarHBondContact NH1-OE2 2.65Å; R192-E194 IonicContact NH2-OE1 3.47Å; R192-E194 IonicContact NH2-OE2 2.69Å; R192-E194 PolarHBondContact NH2-OE2 2.77Å; R192-E194 PolarHBondContact O-N 2.87Å
193	G	83.4	Confident	90.9	Very high	58 Å²	58	49.4 Å²	49.4	60%	0.598	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	2.3	178.6	0	0	0	0	0	115.5	V189	V189-G193 PolarHBondContact O-N 2.71Å
194	E	89.1	Confident	90.9	Very high	39 Å²	39	49.4 Å²	49.4	18%	0.182	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	137.1	-178.6	-58.2	-175.6	156.8	0	0	111.4	I114 R188 V189 R192	I114-E194 HydrophobicContact CD1-CB 3.82Å; I114-E194 HydrophobicContact CG1-CB 4.23Å; R188-E194 WeakPolarHBondContact CA-O 3.39Å; V189-E194 HydrophobicContact CB-CB 4.16Å; V189-E194 HydrophobicContact CG2-CB 4.47Å; V189-E194 PolarHBondContact N-O 3.03Å; R192-E194 HydrophobicContact CB-CG 4.45Å; R192-E194 IonicContact CZ-OE1 3.79Å; R192-E194 IonicContact CZ-OE2 2.64Å; R192-E194 IonicContact NH1-OE1 2.71Å; R192-E194 PolarHBondContact NH1-OE1 2.88Å; R192-E194 IonicContact NH1-OE2 2.67Å; R192-E194 PolarHBondContact NH1-OE2 2.65Å; R192-E194 IonicContact NH2-OE1 3.47Å; R192-E194 IonicContact NH2-OE2 2.69Å; R192-E194 PolarHBondContact NH2-OE2 2.77Å; R192-E194 PolarHBondContact O-N 2.87Å
195	I	91.9	Very high	90.9	Very high	92 Å²	92	48.4 Å²	48.4	47%	0.472	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	127.8	175.4	-53	158	0	0	0	106.2	E186 A187 R188	E186-I195 HydrophobicContact CG-CG2 4.06Å; A187-I195 WeakPolarHBondContact O-CA 3.42Å; R188-I195 HydrophobicContact CG-CG1 4.27Å; R188-I195 HydrophobicContact CG-CG2 4.24Å
196	D	93.3	Very high	90.9	Very high	68 Å²	68	50 Å²	50	36%	0.364	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	158.8	166.4	-171.7	25.5	0	0	0	109	I114 F116 A187	I114-D196 HydrophobicContact CB-CB 4.15Å; I114-D196 HydrophobicContact CD1-CB 4.29Å; I114-D196 HydrophobicContact CG2-CB 3.93Å; F116-D196 HydrophobicContact CE2-CB 4.26Å; F116-D196 WeakPolarHBondContact CE2-OD2 3.31Å; A187-D196 PolarHBondContact N-O 2.96Å; A187-D196 PolarHBondContact O-N 3.13Å
197	F	92.8	Very high	90.8	Very high	113 Å²	113	53.6 Å²	53.6	50%	0.496	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	151	-171.3	73	-86.3	0	0	0	114.1	N184 C185 E186 M199	N184-F197 WeakPolarHBondContact OD1-CB 3.3Å; C185-F197 CarbonylContact O-C 3.5Å; C185-F197 VanDerWaalsContact O-CA 3.31Å; C185-F197 WeakPolarHBondContact O-CA 3.31Å; E186-F197 HydrophobicContact CB-CB 4.17Å; E186-F197 HydrophobicContact CG-CB 4.38Å; F197-M199 HydrophobicContact CD2-SD 4.49Å; F197-M199 HydrophobicContact CE2-CG 4.33Å; F197-M199 HydrophobicContact CE2-SD 4.48Å
198	R	91.8	Very high	90.7	Very high	44 Å²	44	53.7 Å²	53.7	17%	0.166	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	130.7	179.5	176.4	168.2	-74	-142.2	-10.2	111.3	F116 S118 A119 N184 C185 I200	F116-R198 HydrophobicContact CD1-CB 3.87Å; F116-R198 HydrophobicContact CD2-CB 4.47Å; F116-R198 HydrophobicContact CE1-CB 3.58Å; F116-R198 HydrophobicContact CE2-CB 4.2Å; F116-R198 HydrophobicContact CG-CB 4.33Å; F116-R198 HydrophobicContact CZ-CB 3.77Å; S118-R198 PolarHBondContact O-NH1 2.92Å; S118-R198 PolarHBondContact O-NH2 3.04Å; A119-R198 PolarHBondContact O-NH1 2.77Å; N184-R198 WeakPolarHBondContact CA-O 3.34Å; C185-R198 PolarHBondContact N-O 2.88Å; C185-R198 PolarHBondContact O-N 2.89Å; R198-I200 HydrophobicContact CG-CG1 3.96Å
199	M	92	Very high	90.6	Very high	85 Å²	85	53.7 Å²	53.7	42%	0.419	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	125.9	169.1	-61.7	-62.7	-75.8	0	0	109.4	M182 Y183 N184 F197	M182-M199 HydrophobicContact CB-CE 3.84Å; M182-M199 HydrophobicContact CE-CB 3.89Å; Y183-M199 CarbonylContact O-C 3.59Å; Y183-M199 WeakPolarHBondContact O-CA 3.43Å; N184-M199 HydrophobicContact CB-SD 3.7Å; F197-M199 HydrophobicContact CD2-SD 4.49Å; F197-M199 HydrophobicContact CE2-CG 4.33Å; F197-M199 HydrophobicContact CE2-SD 4.48Å
200	I	93.7	Very high	90.5	Very high	4 Å²	4	54.7 Å²	54.7	2%	0.021	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	128.3	178.7	-61.1	168.2	0	0	0	107.2	Q123 I133 V134 C135 W147 M182 Y183 C185 R198	Q123-I200 HydrophobicContact CG-CG2 4.16Å; I133-I200 HydrophobicContact CG2-CD1 4.39Å; I133-I200 HydrophobicContact CG2-CG2 4.12Å; V134-I200 WeakPolarHBondContact O-CD1 3.33Å; C135-I200 HydrophobicContact CB-CD1 4.31Å; W147-I200 HydrophobicContact CH2-CD1 3.64Å; W147-I200 HydrophobicContact CZ3-CD1 3.93Å; M182-I200 WeakPolarHBondContact CA-O 3.09Å; Y183-I200 PolarHBondContact N-O 2.03Å; Y183-I200 PolarHBondContact O-N 3.07Å; C185-I200 HydrophobicContact CB-CD1 4.35Å; R198-I200 HydrophobicContact CG-CG1 3.96Å
201	K	94.6	Very high	90.2	Very high	104 Å²	104	53.2 Å²	53.2	45%	0.452	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	113.9	172.1	-172.3	-177.4	179.5	-168.3	0	108.3	P122 Q123 M182 I203	P122-K201 CarbonylContact C-O 3.58Å; P122-K201 VanDerWaalsContact CA-O 3.24Å; P122-K201 WeakPolarHBondContact CA-O 3.35Å; P122-K201 HydrophobicContact CB-CB 4.26Å; Q123-K201 PolarHBondContact N-O 2.81Å; M182-K201 HydrophobicContact CE-CB 4.12Å; M182-K201 HydrophobicContact SD-CB 3.59Å; M182-K201 VanDerWaalsContact SD-CB 3.59Å; M182-K201 HydrophobicContact SD-CG 3.79Å; K201-I203 HydrophobicContact CD-CD1 4.04Å; K201-I203 HydrophobicContact CD-CG1 4.08Å; K201-I203 HydrophobicContact CG-CG1 4.08Å
202	V	94.7	Very high	89	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	134	166.8	178.8	0	0	0	0	107.7	Q123 F125 I133 I175 E180 G181 Y183 V204	Q123-V202 WeakPolarHBondContact O-CA 3.45Å; F125-V202 HydrophobicContact CD2-CG1 4.09Å; F125-V202 HydrophobicContact CE2-CG1 4.27Å; I133-V202 HydrophobicContact CD1-CG2 3.67Å; I133-V202 HydrophobicContact CG1-CG2 4.12Å; I133-V202 HydrophobicContact CG2-CG2 4.19Å; I175-V202 HydrophobicContact CD1-CG1 3.79Å; E180-V202 WeakPolarHBondContact CG-O 3.38Å; G181-V202 PolarHBondContact N-O 3Å; G181-V202 PolarHBondContact O-N 2.94Å; Y183-V202 HydrophobicContact CD2-CB 3.96Å; Y183-V202 HydrophobicContact CD2-CG2 3.43Å; Y183-V202 VanDerWaalsContact CD2-CG2 3.43Å; Y183-V202 HydrophobicContact CE2-CB 4.02Å; Y183-V202 HydrophobicContact CE2-CG2 3.8Å; Y183-V202 HydrophobicContact CG-CG2 4.03Å; V202-V204 HydrophobicContact CG1-CG2 4.43Å
203	I	93.9	Very high	87.6	Confident	16 Å²	16	61 Å²	61	8%	0.082	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	133.1	174.4	-61.2	176	0	0	0	107.8	P122 Q123 E124 F125 E180 K201 F236	P122-I203 HydrophobicContact CB-CD1 3.85Å; P122-I203 HydrophobicContact CB-CG1 4.45Å; Q123-I203 PolarHBondContact O-N 2.59Å; E124-I203 WeakPolarHBondContact CA-O 3.31Å; E124-I203 HydrophobicContact CB-CB 4.47Å; E124-I203 HydrophobicContact CG-CB 4.12Å; E124-I203 HydrophobicContact CG-CD1 4.41Å; E124-I203 WeakPolarHBondContact OE1-CD1 3.41Å; F125-I203 PolarHBondContact N-O 2.69Å; E180-I203 WeakPolarHBondContact OE2-CA 3.31Å; K201-I203 HydrophobicContact CD-CD1 4.04Å; K201-I203 HydrophobicContact CD-CG1 4.08Å; K201-I203 HydrophobicContact CG-CG1 4.08Å; I203-F236 HydrophobicContact CG2-CE1 4.09Å
204	V	94.3	Very high	86.2	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	113.6	178.2	-175	0	0	0	0	108.7	F125 E127 I175 K177 E180 V202 F236	F125-V204 WeakPolarHBondContact O-CA 3.4Å; E127-V204 HydrophobicContact CB-CG1 3.94Å; I175-V204 HydrophobicContact CD1-CG2 3.7Å; I175-V204 HydrophobicContact CG1-CG2 3.84Å; K177-V204 HydrophobicContact CD-CB 4.09Å; K177-V204 WeakPolarHBondContact CD-O 3.3Å; K177-V204 PolarHBondContact NZ-O 2.98Å; E180-V204 HydrophobicContact CB-CB 4.41Å; E180-V204 HydrophobicContact CB-CG2 4.04Å; E180-V204 PolarHBondContact OE2-N 2.82Å; V202-V204 HydrophobicContact CG1-CG2 4.43Å; V204-F236 WeakPolarHBondContact O-CD1 3.41Å
205	N	93.7	Very high	84.4	Confident	6 Å²	6	62.4 Å²	62.4	3%	0.032	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	137.9	175.8	-47.6	-38.1	0	0	0	109	F125 N126 E127 F236 K288 A289	F125-N205 PolarHBondContact O-N 2.9Å; N126-N205 CarbonylContact C-O 3.56Å; N126-N205 WeakPolarHBondContact CA-O 3.46Å; N126-N205 WeakPolarHBondContact OD1-CB 3.2Å; N126-N205 PolarHBondContact OD1-ND2 2.86Å; E127-N205 PolarHBondContact N-O 3.32Å; N205-F236 CarbonylContact C-O 3.54Å; N205-F236 VanDerWaalsContact CA-O 3.26Å; N205-F236 WeakPolarHBondContact CA-O 3.41Å; N205-K288 VanDerWaalsContact OD1-CE 3.24Å; N205-K288 WeakPolarHBondContact OD1-CE 3.09Å; N205-K288 PolarHBondContact OD1-NZ 3.21Å; N205-A289 HydrophobicContact CB-CB 3.76Å
206	V	92.3	Very high	82.8	Confident	32 Å²	32	65.4 Å²	65.4	19%	0.194	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	125.6	179.7	-177.4	0	0	0	0	108	K177 F236 N287	K177-V206 HydrophobicContact CB-CG2 4.27Å; K177-V206 HydrophobicContact CD-CG2 4.12Å; K177-V206 HydrophobicContact CG-CG2 4.27Å; V206-F236 HydrophobicContact CB-CB 4.03Å; V206-F236 HydrophobicContact CG2-CB 4.11Å; V206-F236 PolarHBondContact N-O 2.98Å; V206-F236 PolarHBondContact O-N 2.91Å; V206-N287 PolarHBondContact O-ND2 3.26Å
207	L	91	Very high	81.1	Confident	91 Å²	91	66.6 Å²	66.6	48%	0.476	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	144	179.9	-172.6	70.9	0	0	0	110.8	A289 G290	L207-A289 HydrophobicContact CB-CB 4.43Å; L207-G290 VanDerWaalsContact CD1-CA 3.49Å
208	P	92.4	Very high	79.7	Confident	3 Å²	3	65.9 Å²	65.9	2%	0.019	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	140.1	177.1	-22.5	35.1	0	0	0	112.2	D234 P239 A285 N287 K292	P208-D234 CarbonylContact C-O 3.56Å; P208-D234 WeakPolarHBondContact CA-O 3.38Å; P208-P239 HydrophobicContact CB-CB 4.06Å; P208-P239 HydrophobicContact CB-CG 4.43Å; P208-P239 HydrophobicContact CG-CB 4Å; P208-A285 HydrophobicContact CB-CB 3.96Å; P208-N287 WeakPolarHBondContact CD-OD1 3.48Å; P208-N287 HydrophobicContact CG-CB 4.29Å; P208-K292 HydrophobicContact CB-CB 4.32Å; P208-K292 VanDerWaalsContact O-CB 3.29Å; P208-K292 WeakPolarHBondContact O-CB 3.35Å
209	T	90.6	Very high	78.7	Confident	69 Å²	69	64.5 Å²	64.5	42%	0.423	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	130.8	176.1	59.5	0	0	0	0	109.1	A233 D234	T209-A233 CarbonylContact O-C 3.5Å; T209-A233 WeakPolarHBondContact O-CA 3.19Å; T209-D234 PolarHBondContact N-O 3.38Å; T209-D234 PolarHBondContact O-N 3.37Å; T209-D234 PolarHBondContact OG1-O 2.93Å
210	I	88	Confident	78.2	Confident	23 Å²	23	65 Å²	65	12%	0.118	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	133.2	-179.9	-62.7	170.1	0	0	0	108.8	D232 A233 A285 K292 E294	I210-D232 WeakPolarHBondContact CA-O 3.28Å; I210-A233 HydrophobicContact CG1-CB 4.38Å; I210-A285 HydrophobicContact CD1-CB 4.09Å; I210-A285 HydrophobicContact CG1-CB 4.09Å; I210-K292 HydrophobicContact CD1-CG 4.15Å; I210-K292 WeakPolarHBondContact CD1-O 3.24Å; I210-K292 HydrophobicContact CG1-CG 4.26Å; I210-E294 HydrophobicContact CB-CB 4.22Å; I210-E294 HydrophobicContact CD1-CB 3.81Å; I210-E294 HydrophobicContact CG2-CB 3.83Å; I210-E294 HydrophobicContact CG2-CG 4.27Å
211	R	77.6	Confident	77.6	Confident	122 Å²	122	65.3 Å²	65.3	46%	0.46	33%	0.329	S	S	.	.			trans	-103	102.1	-174.8	-65.4	168.9	172.9	-171.5	5.6	110.5	R213 K214 D232 D234	R211-R213 PolarHBondContact O-N 2.89Å; R211-K214 PolarHBondContact O-N 2.89Å; R211-D232 HydrophobicContact CB-CB 4.13Å; R211-D232 WeakPolarHBondContact CB-OD2 3.24Å; R211-D232 WeakPolarHBondContact CD-OD2 3.35Å; R211-D232 PolarHBondContact N-O 3.33Å; R211-D232 IonicContact NH1-OD2 3.51Å; R211-D234 IonicContact CZ-OD2 2.78Å; R211-D234 IonicContact NE-OD2 2.95Å; R211-D234 IonicContact NH2-OD2 3.28Å; R211-D234 PolarHBondContact NH2-OD2 3.09Å
212	A	55.7	Low	77.1	Confident	68 Å²	68	63 Å²	63	56%	0.562	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	37	177.7	0	0	0	0	0	115.1
213	R	53.5	Low	76.6	Confident	243 Å²	243	66.4 Å²	66.4	92%	0.917	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.4	-4.9	175.5	-129.2	-170.3	-60.2	-161	2.1	114.4	R211	R211-R213 PolarHBondContact O-N 2.89Å
214	K	52.4	Low	76	Confident	118 Å²	118	67.9 Å²	67.9	51%	0.513	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117	-19.2	164.7	-141.7	-162.2	176.3	-142.3	0	111.9	R211 D232 E267	R211-K214 PolarHBondContact O-N 2.89Å; K214-D232 HydrophobicContact CB-CB 3.67Å; K214-D232 HydrophobicContact CD-CB 4.16Å; K214-E267 IonicContact NZ-OE1 2.75Å; K214-E267 PolarHBondContact NZ-OE1 3.25Å
215	S	53	Low	75.6	Confident	9 Å²	9	74 Å²	74	6%	0.063	39%	0.391	C	S	.	.	S	Bend	trans	-88.7	102	165	-149.4	0	0	0	0	107.6	V217 A230 V296	S215-V217 PolarHBondContact O-N 2.96Å; S215-A230 WeakPolarHBondContact CA-O 3.34Å; S215-A230 WeakPolarHBondContact CB-O 3.02Å; S215-A230 PolarHBondContact OG-O 2.87Å; S215-V296 WeakPolarHBondContact OG-CG2 3.5Å
216	E	56.5	Low	75.3	Confident	156 Å²	156	77 Å²	77	73%	0.729	41%	0.412	S	S	*	.			trans	-73.6	119.1	170.4	-65.4	-166.8	148	0	0	107.7	N218 V296	E216-N218 PolarHBondContact O-N 2.92Å; E216-V296 WeakPolarHBondContact O-CG1 3.45Å
217	V	57.6	Low	75	Confident	92 Å²	92	75.8 Å²	75.8	56%	0.558	41%	0.405	S	S	*	.	S	Bend	trans	-56.5	-30.2	-169.8	-178.3	0	0	0	0	112.4	S215 V296 S297	S215-V217 PolarHBondContact O-N 2.96Å; V217-V296 WeakPolarHBondContact O-CA 3.44Å; V217-S297 PolarHBondContact O-N 2.84Å
218	N	64.7	Low	74.9	Confident	99 Å²	99	76.1 Å²	76.1	53%	0.529	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	112.1	172.7	-62.9	-4.1	0	0	0	108.9	E216 S297	E216-N218 PolarHBondContact O-N 2.92Å; N218-S297 CarbonylContact C-O 3.55Å; N218-S297 VanDerWaalsContact CA-O 3.31Å; N218-S297 WeakPolarHBondContact CA-O 3.24Å
219	A	70.4	Confident	74.7	Confident	15 Å²	15	76.1 Å²	76.1	12%	0.124	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	157	165.3	0	0	0	0	0	110.4	L229 S297 L298 N299	A219-L229 HydrophobicContact CB-CD2 3.38Å; A219-S297 PolarHBondContact N-O 3.34Å; A219-L298 HydrophobicContact CB-CD1 3.93Å; A219-N299 PolarHBondContact O-N 2.79Å; A219-N299 PolarHBondContact O-ND2 2.86Å
220	T	82.1	Confident	74.6	Confident	95 Å²	95	73.6 Å²	73.6	58%	0.583	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.3	134.1	178.4	56.9	0	0	0	0	110.8	N299 F301	T220-N299 WeakPolarHBondContact CA-O 3.11Å; T220-N299 HydrophobicContact CG2-CB 4.39Å; T220-F301 HydrophobicContact CG2-CE2 3.67Å; T220-F301 HydrophobicContact CG2-CZ 4.18Å
221	A	81.2	Confident	74.5	Confident	10 Å²	10	72.6 Å²	72.6	8%	0.083	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	152.6	172.3	0	0	0	0	0	112	A227 V273 L298 N299 V300 F301	A221-A227 HydrophobicContact CB-CB 3.77Å; A221-V273 HydrophobicContact CB-CB 4.49Å; A221-V273 HydrophobicContact CB-CG1 4.29Å; A221-V273 HydrophobicContact CB-CG2 4.22Å; A221-L298 HydrophobicContact CB-CD1 4.33Å; A221-N299 PolarHBondContact N-O 2.71Å; A221-N299 VanDerWaalsContact N-O 3.16Å; A221-V300 WeakPolarHBondContact O-CA 3.34Å; A221-F301 PolarHBondContact O-N 3.29Å
222	D	83.4	Confident	75	Confident	55 Å²	55	69.1 Å²	69.1	29%	0.294	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	150.9	174.7	-62.2	-37.1	0	0	0	110.9	G224 E225 I397	D222-G224 PolarHBondContact O-N 2.8Å; D222-E225 HydrophobicContact CB-CG 4.48Å; D222-E225 PolarHBondContact O-N 2.87Å; D222-E225 VanDerWaalsContact O-N 3.14Å; D222-I397 VanDerWaalsContact OD1-CG2 3.28Å; D222-I397 WeakPolarHBondContact OD1-CG2 3.17Å
223	V	84.1	Confident	76.6	Confident	72 Å²	72	67 Å²	67	44%	0.436	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	125.9	177.5	168.7	0	0	0	0	111.8	V273 V300 F301 V302	V223-V273 CarbonylContact C-O 3.57Å; V223-V273 VanDerWaalsContact CA-O 3.26Å; V223-V273 WeakPolarHBondContact CA-O 3.42Å; V223-V300 HydrophobicContact CG2-CG1 3.64Å; V223-F301 PolarHBondContact N-O 3.14Å; V223-V302 HydrophobicContact CG2-CG2 3.89Å
224	G	81.9	Confident	78.3	Confident	48 Å²	48	58.9 Å²	58.9	50%	0.495	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.9	-25	-176.6	0	0	0	0	0	114.2	D222 V273	D222-G224 PolarHBondContact O-N 2.8Å; G224-V273 PolarHBondContact N-O 2.89Å
225	E	85.1	Confident	80.1	Confident	129 Å²	129	53.9 Å²	53.9	60%	0.603	32%	0.318	S	S	*	.	S	Bend	trans	-77.3	177.8	174.3	-73.7	-62.8	158.6	0	0	111.9	D222 E272 V273	D222-E225 HydrophobicContact CB-CG 4.48Å; D222-E225 PolarHBondContact O-N 2.87Å; D222-E225 VanDerWaalsContact O-N 3.14Å; E225-E272 PolarHBondContact O-N 2.85Å; E225-V273 WeakPolarHBondContact O-CB 3.47Å; E225-V273 WeakPolarHBondContact O-CG2 3.24Å; E225-V273 PolarHBondContact O-N 2.87Å
226	S	86.8	Confident	81.9	Confident	69 Å²	69	57.4 Å²	57.4	48%	0.483	33%	0.332	S	S	.	.			trans	-106.8	129	175.7	-57.9	0	0	0	0	111.9	I270	S226-I270 CarbonylContact C-O 3.53Å; S226-I270 VanDerWaalsContact CA-O 3.24Å; S226-I270 WeakPolarHBondContact CA-O 3.34Å
227	A	87.9	Confident	83.5	Confident	5 Å²	5	52 Å²	52	4%	0.041	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	143.6	172.6	0	0	0	0	0	110.9	A221 V269 I270 V273 L298	A221-A227 HydrophobicContact CB-CB 3.77Å; A227-V269 CarbonylContact O-C 3.56Å; A227-V269 WeakPolarHBondContact O-CA 3.3Å; A227-I270 HydrophobicContact CB-CB 4.31Å; A227-I270 HydrophobicContact CB-CD1 4.47Å; A227-I270 PolarHBondContact N-O 2.79Å; A227-I270 PolarHBondContact O-N 2.94Å; A227-V273 HydrophobicContact CB-CG2 3.8Å; A227-L298 HydrophobicContact CB-CD1 3.87Å; A227-L298 HydrophobicContact CB-CD2 3.92Å
228	L	88.6	Confident	85.1	Confident	99 Å²	99	56 Å²	56	52%	0.518	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	118.9	171.7	171.2	60.8	0	0	0	109.4	E267 V269	L228-E267 HydrophobicContact CD1-CB 3.9Å; L228-E267 HydrophobicContact CD1-CG 4.3Å; L228-V269 HydrophobicContact CD1-CG2 4.09Å
229	L	88.4	Confident	86.3	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.01	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	129.3	171.5	-51.4	-175.8	0	0	0	108.7	A219 W243 E267 L268 I270 Y281 V296 L298	A219-L229 HydrophobicContact CB-CD2 3.38Å; L229-W243 HydrophobicContact CB-CH2 3.69Å; L229-W243 HydrophobicContact CB-CZ2 4.24Å; L229-W243 HydrophobicContact CB-CZ3 3.92Å; L229-W243 HydrophobicContact CD1-CZ3 4.39Å; L229-E267 WeakPolarHBondContact O-CA 3.05Å; L229-L268 HydrophobicContact CB-CB 4.4Å; L229-L268 HydrophobicContact CD1-CD2 4.3Å; L229-L268 PolarHBondContact N-O 3.11Å; L229-L268 PolarHBondContact O-N 3.15Å; L229-I270 HydrophobicContact CD1-CD1 3.81Å; L229-I270 HydrophobicContact CG-CD1 4.2Å; L229-Y281 HydrophobicContact CD1-CD1 3.93Å; L229-Y281 HydrophobicContact CD1-CD2 3.64Å; L229-Y281 HydrophobicContact CD1-CE2 4.3Å; L229-Y281 HydrophobicContact CD1-CG 3.43Å; L229-Y281 VanDerWaalsContact CD1-CG 3.43Å; L229-V296 HydrophobicContact CD2-CG1 4.11Å; L229-L298 HydrophobicContact CD2-CB 4.5Å
230	A	86.8	Confident	87.3	Confident	16 Å²	16	56 Å²	56	13%	0.132	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	142.3	-174.8	0	0	0	0	0	112	S215 S266 E267	S215-A230 WeakPolarHBondContact CA-O 3.34Å; S215-A230 WeakPolarHBondContact CB-O 3.02Å; S215-A230 PolarHBondContact OG-O 2.87Å; A230-S266 CarbonylContact C-O 3.59Å; A230-S266 WeakPolarHBondContact CA-O 3.2Å; A230-E267 HydrophobicContact CB-CG 4.18Å
231	C	87.3	Confident	87.7	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.014	30%	0.3	C	S	.	.			trans	-136.3	97.4	-178.9	-169.7	0	0	0	0	111.4	A233 V241 W243 S266 C283	C231-A233 PolarHBondContact O-N 2.76Å; C231-A233 VanDerWaalsContact O-N 3.15Å; C231-V241 HydrophobicContact CB-CG1 4.26Å; C231-W243 HydrophobicContact CB-CH2 3.88Å; C231-W243 HydrophobicContact CB-CZ2 3.58Å; C231-S266 PolarHBondContact N-O 3.03Å; C231-S266 WeakPolarHBondContact O-CB 3.48Å; C231-C283 HydrophobicContact CB-CB 3.7Å; C231-C283 WeakPolarHBondContact CB-SG 3.23Å; C231-C283 WeakPolarHBondContact SG-CB 3.44Å; C231-C283 CovalentContact SG-SG 2.03Å; C231-C283 PolarHBondContact SG-SG 3.26Å
232	D	87.1	Confident	88.1	Confident	49 Å²	49	54 Å²	54	26%	0.262	31%	0.313	S	S	.	.			trans	-76.4	95.7	177.7	177.9	24.4	0	0	0	110.1	I210 R211 K214	I210-D232 WeakPolarHBondContact CA-O 3.28Å; R211-D232 HydrophobicContact CB-CB 4.13Å; R211-D232 WeakPolarHBondContact CB-OD2 3.24Å; R211-D232 WeakPolarHBondContact CD-OD2 3.35Å; R211-D232 PolarHBondContact N-O 3.33Å; R211-D232 IonicContact NH1-OD2 3.51Å; K214-D232 HydrophobicContact CB-CB 3.67Å; K214-D232 HydrophobicContact CD-CB 4.16Å
233	A	90	Very high	88.4	Confident	24 Å²	24	51.4 Å²	51.4	20%	0.198	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	130.7	-175.4	0	0	0	0	0	112.6	T209 I210 C231 P239 V241 A285	T209-A233 CarbonylContact O-C 3.5Å; T209-A233 WeakPolarHBondContact O-CA 3.19Å; I210-A233 HydrophobicContact CG1-CB 4.38Å; C231-A233 PolarHBondContact O-N 2.76Å; C231-A233 VanDerWaalsContact O-N 3.15Å; A233-P239 HydrophobicContact CB-CG 3.98Å; A233-V241 HydrophobicContact CB-CG2 3.85Å; A233-A285 HydrophobicContact CB-CB 3.67Å
234	D	89.8	Confident	88.6	Confident	72 Å²	72	48.3 Å²	48.3	39%	0.385	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	134.5	-173.9	-179.3	11.7	0	0	0	110.7	P208 T209 R211	P208-D234 CarbonylContact C-O 3.56Å; P208-D234 WeakPolarHBondContact CA-O 3.38Å; T209-D234 PolarHBondContact N-O 3.38Å; T209-D234 PolarHBondContact O-N 3.37Å; T209-D234 PolarHBondContact OG1-O 2.93Å; R211-D234 IonicContact CZ-OD2 2.78Å; R211-D234 IonicContact NE-OD2 2.95Å; R211-D234 IonicContact NH2-OD2 3.28Å; R211-D234 PolarHBondContact NH2-OD2 3.09Å
235	G	90.3	Very high	88.7	Confident	13 Å²	13	47 Å²	47	13%	0.134	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.3	174.9	-175.2	0	0	0	0	0	113.2	P237	G235-P237 CarbonylContact C-O 3.48Å; G235-P237 CarbonylContact O-C 3.45Å
236	F	89.8	Confident	88.1	Confident	84 Å²	84	45.9 Å²	45.9	37%	0.368	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	122.1	177.2	-174.2	-91.3	0	0	0	113.1	I203 V204 N205 V206 N287	I203-F236 HydrophobicContact CG2-CE1 4.09Å; V204-F236 WeakPolarHBondContact O-CD1 3.41Å; N205-F236 CarbonylContact C-O 3.54Å; N205-F236 VanDerWaalsContact CA-O 3.26Å; N205-F236 WeakPolarHBondContact CA-O 3.41Å; V206-F236 HydrophobicContact CB-CB 4.03Å; V206-F236 HydrophobicContact CG2-CB 4.11Å; V206-F236 PolarHBondContact N-O 2.98Å; V206-F236 PolarHBondContact O-N 2.91Å; F236-N287 PolarHBondContact N-ND2 2.69Å
237	P	90.9	Very high	87	Confident	42 Å²	42	48.5 Å²	48.5	27%	0.273	26%	0.262	S	S	.	.	S	Bend	cis	-57.8	164.3	-6.5	-22	34.6	0	0	0	112.2	G235 N287 K288	G235-P237 CarbonylContact C-O 3.48Å; G235-P237 CarbonylContact O-C 3.45Å; P237-N287 WeakPolarHBondContact O-CB 3.45Å; P237-N287 PolarHBondContact O-ND2 2.74Å; P237-K288 VanDerWaalsContact CD-CE 3.49Å; P237-K288 HydrophobicContact CG-CD 4.22Å; P237-K288 HydrophobicContact CG-CG 3.9Å
238	E	90.1	Very high	85.9	Confident	176 Å²	176	57 Å²	57	82%	0.822	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-50.3	127	176.3	-70.9	160.8	175.1	0	0	109.3
239	P	91.2	Very high	85.1	Confident	17 Å²	17	56.5 Å²	56.5	11%	0.11	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-76.4	139	-175	30.3	-33.5	0	0	0	111	P208 A233 A285 K286 N287	P208-P239 HydrophobicContact CB-CB 4.06Å; P208-P239 HydrophobicContact CB-CG 4.43Å; P208-P239 HydrophobicContact CG-CB 4Å; A233-P239 HydrophobicContact CB-CG 3.98Å; P239-A285 HydrophobicContact CB-CB 4.3Å; P239-K286 CarbonylContact C-O 3.56Å; P239-K286 VanDerWaalsContact CA-O 3.31Å; P239-K286 WeakPolarHBondContact CA-O 3.35Å; P239-N287 HydrophobicContact CB-CB 4.39Å
240	T	90.8	Very high	84.4	Confident	96 Å²	96	60.5 Å²	60.5	59%	0.589	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	130.5	163.4	-49.6	0	0	0	0	108	K286	T240-K286 PolarHBondContact N-O 2.79Å; T240-K286 PolarHBondContact O-N 3.11Å
241	V	90.4	Very high	83.8	Confident	8 Å²	8	60 Å²	60	5%	0.048	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	139	173.2	-178.9	0	0	0	0	109.6	C231 A233 D264 G265 C283 A285	C231-V241 HydrophobicContact CB-CG1 4.26Å; A233-V241 HydrophobicContact CB-CG2 3.85Å; V241-D264 PolarHBondContact N-O 3.13Å; V241-G265 VanDerWaalsContact CG1-O 3.24Å; V241-G265 WeakPolarHBondContact CG1-O 3.32Å; V241-C283 VanDerWaalsContact CG1-SG 3.58Å; V241-A285 HydrophobicContact CG2-CB 4.39Å
242	T	90.1	Very high	83.1	Confident	57 Å²	57	62.3 Å²	62.3	35%	0.35	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	154.7	174.1	49.7	0	0	0	0	109.1	I284	T242-I284 PolarHBondContact N-O 3.17Å; T242-I284 PolarHBondContact O-N 3.47Å; T242-I284 PolarHBondContact OG1-O 3.21Å
243	W	89.6	Confident	82.1	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	148	-175.5	-68.7	86.7	0	0	0	111.5	L229 C231 V250 V251 G265 L268 T282 C283 V296	L229-W243 HydrophobicContact CB-CH2 3.69Å; L229-W243 HydrophobicContact CB-CZ2 4.24Å; L229-W243 HydrophobicContact CB-CZ3 3.92Å; L229-W243 HydrophobicContact CD1-CZ3 4.39Å; C231-W243 HydrophobicContact CB-CH2 3.88Å; C231-W243 HydrophobicContact CB-CZ2 3.58Å; W243-V250 WeakPolarHBondContact O-CA 3.34Å; W243-V251 HydrophobicContact CB-CB 4.19Å; W243-V251 PolarHBondContact O-N 2.93Å; W243-G265 PolarHBondContact NE1-O 3.36Å; W243-L268 HydrophobicContact CB-CD2 3.77Å; W243-L268 HydrophobicContact CD2-CB 4.05Å; W243-L268 HydrophobicContact CD2-CD2 3.89Å; W243-L268 HydrophobicContact CE3-CD2 4.24Å; W243-L268 HydrophobicContact CG-CB 4.06Å; W243-L268 HydrophobicContact CG-CD2 3.7Å; W243-L268 HydrophobicContact CG-CG 4.46Å; W243-L268 HydrophobicContact CZ2-CB 4.35Å; W243-T282 CarbonylContact C-O 3.55Å; W243-T282 WeakPolarHBondContact CA-O 3.5Å; W243-C283 HydrophobicContact CD2-CB 4.45Å; W243-C283 HydrophobicContact CE3-CB 4.11Å; W243-C283 HydrophobicContact CH2-CB 4.1Å; W243-C283 HydrophobicContact CZ2-CB 4.41Å; W243-C283 HydrophobicContact CZ3-CB 3.93Å; W243-V296 HydrophobicContact CZ3-CG2 4.39Å
244	A	87.1	Confident	81.1	Confident	6 Å²	6	73.2 Å²	73.2	5%	0.05	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	132.6	174	0	0	0	0	0	112.6	K249 T282 I284	A244-K249 CarbonylContact C-O 3.45Å; A244-K249 WeakPolarHBondContact CA-O 3.45Å; A244-K249 WeakPolarHBondContact CB-O 3.41Å; A244-T282 PolarHBondContact N-O 3.21Å; A244-T282 PolarHBondContact O-N 3.17Å; A244-I284 HydrophobicContact CB-CD1 4.18Å
245	Q	84.4	Confident	79.9	Confident	20 Å²	20	71.7 Å²	71.7	9%	0.093	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	141.5	172.4	-167.1	176.3	3.9	0	0	110	K247 Q248 K249 V251 Y259 Y281	Q245-K247 PolarHBondContact O-N 2.8Å; Q245-Q248 PolarHBondContact O-N 3.04Å; Q245-Q248 VanDerWaalsContact O-N 3.14Å; Q245-K249 PolarHBondContact N-O 3.06Å; Q245-K249 PolarHBondContact O-N 2.79Å; Q245-V251 HydrophobicContact CB-CG2 4.23Å; Q245-Y259 PolarHBondContact OE1-OH 2.79Å; Q245-Y281 HydrophobicContact CB-CD1 4.18Å; Q245-Y281 HydrophobicContact CB-CE1 3.88Å; Q245-Y281 HydrophobicContact CG-CD1 4.41Å; Q245-Y281 HydrophobicContact CG-CE1 3.92Å; Q245-Y281 HydrophobicContact CG-CE2 4.48Å; Q245-Y281 PolarHBondContact NE2-OH 3.1Å; Q245-Y281 PolarHBondContact OE1-OH 3.5Å
246	D	71.6	Confident	78.6	Confident	107 Å²	107	78.7 Å²	78.7	57%	0.572	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	25.5	178.5	-60.3	-41.5	0	0	0	114.8	Q248 D280	D246-Q248 PolarHBondContact O-N 3.05Å; D246-D280 PolarHBondContact N-O 3.26Å
247	K	65	Low	78	Confident	124 Å²	124	80.7 Å²	80.7	54%	0.539	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	18.6	-177.1	-65.5	145.6	-179.4	153.3	0	114.5	Q245 T282 E295	Q245-K247 PolarHBondContact O-N 2.8Å; K247-T282 WeakPolarHBondContact CG-OG1 3.42Å; K247-E295 VanDerWaalsContact CE-CD 3.43Å; K247-E295 WeakPolarHBondContact CE-OE1 3.29Å; K247-E295 WeakPolarHBondContact CE-OE2 3.32Å; K247-E295 IonicContact NZ-OE1 2.71Å; K247-E295 PolarHBondContact NZ-OE1 3.1Å; K247-E295 IonicContact NZ-OE2 3.64Å; K247-E295 PolarHBondContact NZ-OE2 3.46Å
248	Q	64.9	Low	77.8	Confident	182 Å²	182	80 Å²	80	85%	0.85	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.4	-35	-179	-66.7	-169.3	24.5	0	0	114.6	Q245 D246	Q245-Q248 PolarHBondContact O-N 3.04Å; Q245-Q248 VanDerWaalsContact O-N 3.14Å; D246-Q248 PolarHBondContact O-N 3.05Å
249	K	71.7	Confident	77.7	Confident	90 Å²	90	72.1 Å²	72.1	39%	0.391	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	113.8	178.3	-165.1	-160.5	176.1	-166.9	0	110.2	A244 Q245 V251 D255	A244-K249 CarbonylContact C-O 3.45Å; A244-K249 WeakPolarHBondContact CA-O 3.45Å; A244-K249 WeakPolarHBondContact CB-O 3.41Å; Q245-K249 PolarHBondContact N-O 3.06Å; Q245-K249 PolarHBondContact O-N 2.79Å; K249-V251 PolarHBondContact O-N 2.97Å; K249-D255 VanDerWaalsContact CE-OD1 3.25Å; K249-D255 WeakPolarHBondContact CE-OD1 3.05Å; K249-D255 WeakPolarHBondContact CE-OD2 3.03Å; K249-D255 IonicContact NZ-OD1 2.66Å; K249-D255 PolarHBondContact NZ-OD1 2.88Å; K249-D255 IonicContact NZ-OD2 3.9Å; K249-D255 PolarHBondContact NZ-OD2 2.97Å
250	V	72.6	Confident	77.6	Confident	85 Å²	85	73.3 Å²	73.3	52%	0.515	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	131	166.9	-177.7	0	0	0	0	108.5	W243 T252	W243-V250 WeakPolarHBondContact O-CA 3.34Å; V250-T252 HydrophobicContact CG1-CG2 4.08Å
251	V	74.2	Confident	77.4	Confident	5 Å²	5	71 Å²	71	3%	0.03	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	126.6	178.4	178.3	0	0	0	0	108.6	W243 Q245 K249 Y259 L268 Y281	W243-V251 HydrophobicContact CB-CB 4.19Å; W243-V251 PolarHBondContact O-N 2.93Å; Q245-V251 HydrophobicContact CB-CG2 4.23Å; K249-V251 PolarHBondContact O-N 2.97Å; V251-Y259 HydrophobicContact CG1-CD1 3.42Å; V251-Y259 VanDerWaalsContact CG1-CD1 3.42Å; V251-Y259 HydrophobicContact CG1-CD2 3.69Å; V251-Y259 HydrophobicContact CG1-CE1 3.76Å; V251-Y259 HydrophobicContact CG1-CE2 4.01Å; V251-Y259 HydrophobicContact CG1-CG 3.36Å; V251-L268 HydrophobicContact CB-CD2 4.46Å; V251-L268 HydrophobicContact CG1-CD1 3.8Å; V251-L268 HydrophobicContact CG1-CD2 4.01Å; V251-Y281 HydrophobicContact CG2-CD1 4.37Å; V251-Y281 HydrophobicContact CG2-CE1 4.15Å
252	T	72.5	Confident	77.2	Confident	51 Å²	51	73 Å²	73	31%	0.313	37%	0.373	S	S	.	.			trans	-134.8	162.4	-174.5	64.1	0	0	0	0	111.9	V250 E254 D255	V250-T252 HydrophobicContact CG1-CG2 4.08Å; T252-E254 PolarHBondContact O-N 3.07Å; T252-D255 PolarHBondContact N-OD2 3.04Å; T252-D255 WeakPolarHBondContact O-CB 3.4Å; T252-D255 PolarHBondContact O-N 2.92Å; T252-D255 PolarHBondContact OG1-OD2 2.96Å; T252-D255 VanDerWaalsContact OG1-OD2 3.05Å
253	E	67.6	Low	76.9	Confident	114 Å²	114	80.3 Å²	80.3	53%	0.533	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-17.1	173.7	-52.4	-162.8	126.4	0	0	112.7	D255 L261	E253-D255 PolarHBondContact O-N 3.18Å; E253-L261 HydrophobicContact CG-CB 4.36Å; E253-L261 HydrophobicContact CG-CD1 4.22Å; E253-L261 HydrophobicContact CG-CG 4.41Å; E253-L261 PolarHBondContact OE1-N 2.94Å
254	E	68.3	Low	76.5	Confident	188 Å²	188	84.7 Å²	84.7	88%	0.879	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-9.3	175.6	-59.7	-173.6	173.2	0	0	112.8	T252 D256	T252-E254 PolarHBondContact O-N 3.07Å; E254-D256 VanDerWaalsContact C-N 3.31Å; E254-D256 PolarHBondContact O-N 2.86Å
255	D	64.2	Low	76.4	Confident	40 Å²	40	84.7 Å²	84.7	21%	0.214	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	72.3	177.1	-81.1	-62.3	0	0	0	112.5	K249 T252 E253 D257 K258 Y259	K249-D255 VanDerWaalsContact CE-OD1 3.25Å; K249-D255 WeakPolarHBondContact CE-OD1 3.05Å; K249-D255 WeakPolarHBondContact CE-OD2 3.03Å; K249-D255 IonicContact NZ-OD1 2.66Å; K249-D255 PolarHBondContact NZ-OD1 2.88Å; K249-D255 IonicContact NZ-OD2 3.9Å; K249-D255 PolarHBondContact NZ-OD2 2.97Å; T252-D255 PolarHBondContact N-OD2 3.04Å; T252-D255 WeakPolarHBondContact O-CB 3.4Å; T252-D255 PolarHBondContact O-N 2.92Å; T252-D255 PolarHBondContact OG1-OD2 2.96Å; T252-D255 VanDerWaalsContact OG1-OD2 3.05Å; E253-D255 PolarHBondContact O-N 3.18Å; D255-D257 VanDerWaalsContact C-N 3.31Å; D255-D257 PolarHBondContact O-N 3.35Å; D255-D257 VanDerWaalsContact O-N 3.16Å; D255-K258 VanDerWaalsContact O-CB 3.32Å; D255-K258 WeakPolarHBondContact O-CB 3.25Å; D255-K258 PolarHBondContact O-N 2.81Å; D255-Y259 HydrophobicContact CB-CD2 3.72Å; D255-Y259 HydrophobicContact CB-CE2 4.01Å
256	D	63.5	Low	76.5	Confident	161 Å²	161	84.8 Å²	84.8	86%	0.861	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	39.4	161.6	-155.1	33	0	0	0	114.3	E254 K258	E254-D256 VanDerWaalsContact C-N 3.31Å; E254-D256 PolarHBondContact O-N 2.86Å; D256-K258 PolarHBondContact O-N 2.67Å
257	D	77.3	Confident	77.3	Confident	125 Å²	125	82.7 Å²	82.7	67%	0.668	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	1	-175.4	-116.3	-50.1	0	0	0	115.1	D255 Y259 K271	D255-D257 VanDerWaalsContact C-N 3.31Å; D255-D257 PolarHBondContact O-N 3.35Å; D255-D257 VanDerWaalsContact O-N 3.16Å; D257-Y259 PolarHBondContact O-N 2.79Å; D257-K271 VanDerWaalsContact O-CD 3.27Å; D257-K271 WeakPolarHBondContact O-CD 3.04Å; D257-K271 WeakPolarHBondContact O-CE 3.36Å; D257-K271 PolarHBondContact O-NZ 3.43Å; D257-K271 IonicContact OD1-NZ 2.6Å; D257-K271 PolarHBondContact OD1-NZ 2.93Å
258	K	86.8	Confident	78.4	Confident	27 Å²	27	76.8 Å²	76.8	12%	0.117	39%	0.391	C	S	.	.	S	Bend	trans	-64.8	-27	-173.8	178.6	56.6	176.7	170.2	0	113.3	D255 D256 K271 E272 D277	D255-K258 VanDerWaalsContact O-CB 3.32Å; D255-K258 WeakPolarHBondContact O-CB 3.25Å; D255-K258 PolarHBondContact O-N 2.81Å; D256-K258 PolarHBondContact O-N 2.67Å; K258-K271 WeakPolarHBondContact CD-O 3.42Å; K258-K271 WeakPolarHBondContact CE-O 3.32Å; K258-K271 PolarHBondContact NZ-O 2.84Å; K258-K271 PolarHBondContact O-N 2.92Å; K258-E272 PolarHBondContact NZ-O 3.2Å; K258-D277 VanDerWaalsContact CE-CG 3.45Å; K258-D277 WeakPolarHBondContact CE-OD1 3.33Å; K258-D277 VanDerWaalsContact CE-OD2 3.22Å; K258-D277 WeakPolarHBondContact CE-OD2 3.48Å; K258-D277 IonicContact NZ-OD1 2.74Å; K258-D277 IonicContact NZ-OD2 3.52Å; K258-D277 PolarHBondContact NZ-OD2 3.46Å
259	Y	88.8	Confident	79.6	Confident	12 Å²	12	70.5 Å²	70.5	5%	0.047	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	157	-174.8	-55.2	-76.6	0	0	0	111.1	Q245 V251 D255 D257 L268 V269 I270 K271	Q245-Y259 PolarHBondContact OE1-OH 2.79Å; V251-Y259 HydrophobicContact CG1-CD1 3.42Å; V251-Y259 VanDerWaalsContact CG1-CD1 3.42Å; V251-Y259 HydrophobicContact CG1-CD2 3.69Å; V251-Y259 HydrophobicContact CG1-CE1 3.76Å; V251-Y259 HydrophobicContact CG1-CE2 4.01Å; V251-Y259 HydrophobicContact CG1-CG 3.36Å; D255-Y259 HydrophobicContact CB-CD2 3.72Å; D255-Y259 HydrophobicContact CB-CE2 4.01Å; D257-Y259 PolarHBondContact O-N 2.79Å; Y259-L268 HydrophobicContact CD1-CD1 3.98Å; Y259-L268 HydrophobicContact CG-CD1 4.39Å; Y259-V269 CarbonylContact C-O 3.55Å; Y259-V269 WeakPolarHBondContact CA-O 3.33Å; Y259-I270 HydrophobicContact CD1-CB 4.36Å; Y259-I270 HydrophobicContact CD1-CG1 3.88Å; Y259-I270 HydrophobicContact CD1-CG2 4.27Å; Y259-I270 HydrophobicContact CE1-CB 4.41Å; Y259-I270 HydrophobicContact CE1-CG1 3.88Å; Y259-I270 HydrophobicContact CE1-CG2 3.97Å; Y259-K271 PolarHBondContact O-NZ 2.84Å
260	S	87.6	Confident	80.5	Confident	42 Å²	42	66.2 Å²	66.2	29%	0.294	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	140.5	167.8	-156.5	0	0	0	0	108.5	V269	S260-V269 PolarHBondContact N-O 3.5Å; S260-V269 PolarHBondContact O-N 2.83Å
261	L	87.7	Confident	81.2	Confident	47 Å²	47	65.1 Å²	65.1	25%	0.246	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	164	173.5	-69	163.5	0	0	0	109.9	E253 E267 L268	E253-L261 HydrophobicContact CG-CB 4.36Å; E253-L261 HydrophobicContact CG-CD1 4.22Å; E253-L261 HydrophobicContact CG-CG 4.41Å; E253-L261 PolarHBondContact OE1-N 2.94Å; L261-E267 WeakPolarHBondContact CA-O 3.16Å; L261-L268 HydrophobicContact CD2-CB 3.99Å; L261-L268 HydrophobicContact CD2-CD1 3.96Å; L261-L268 HydrophobicContact CG-CD1 4.49Å
262	N	86.7	Confident	81.8	Confident	50 Å²	50	72 Å²	72	27%	0.267	37%	0.367	S	S	.	.			trans	-92.3	172.6	164.1	66.6	-15.6	0	0	0	111	D264 G265 S266 E267	N262-D264 PolarHBondContact ND2-OD1 2.97Å; N262-D264 VanDerWaalsContact ND2-OD1 3.15Å; N262-D264 PolarHBondContact O-N 3.01Å; N262-D264 PolarHBondContact OD1-OD1 3.16Å; N262-D264 VanDerWaalsContact OD1-OD1 3.13Å; N262-G265 PolarHBondContact O-N 3.17Å; N262-G265 WeakPolarHBondContact OD1-CA 3.39Å; N262-G265 PolarHBondContact OD1-N 2.56Å; N262-G265 VanDerWaalsContact OD1-N 3.12Å; N262-S266 PolarHBondContact ND2-OG 3.04Å; N262-S266 PolarHBondContact OD1-N 3.07Å; N262-E267 HydrophobicContact CB-CB 4.39Å; N262-E267 PolarHBondContact N-O 3.37Å; N262-E267 PolarHBondContact ND2-N 3.39Å; N262-E267 PolarHBondContact OD1-N 3.44Å; N262-E267 PolarHBondContact OD1-O 2.85Å
263	E	83.1	Confident	82.6	Confident	211 Å²	211	69.7 Å²	69.7	99%	0.986	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-22.5	-170	-62.8	-172.4	159.5	0	0	115.4
264	D	81.4	Confident	83.6	Confident	92 Å²	92	70.2 Å²	70.2	49%	0.492	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-3	177.3	63.9	15	0	0	0	114.3	V241 N262 S266	V241-D264 PolarHBondContact N-O 3.13Å; N262-D264 PolarHBondContact ND2-OD1 2.97Å; N262-D264 VanDerWaalsContact ND2-OD1 3.15Å; N262-D264 PolarHBondContact O-N 3.01Å; N262-D264 PolarHBondContact OD1-OD1 3.16Å; N262-D264 VanDerWaalsContact OD1-OD1 3.13Å; D264-S266 VanDerWaalsContact C-N 3.27Å; D264-S266 PolarHBondContact O-N 3.4Å; D264-S266 WeakPolarHBondContact OD1-CB 3.31Å; D264-S266 PolarHBondContact OD1-N 3.4Å; D264-S266 PolarHBondContact OD1-OG 3.48Å; D264-S266 PolarHBondContact OD2-OG 2.97Å
265	G	85.3	Confident	84.4	Confident	6 Å²	6	64.7 Å²	64.7	6%	0.062	32%	0.322	C	S	.	.	S	Bend	trans	76	2	-177.1	0	0	0	0	0	115.4	V241 W243 N262 E267	V241-G265 VanDerWaalsContact CG1-O 3.24Å; V241-G265 WeakPolarHBondContact CG1-O 3.32Å; W243-G265 PolarHBondContact NE1-O 3.36Å; N262-G265 PolarHBondContact O-N 3.17Å; N262-G265 WeakPolarHBondContact OD1-CA 3.39Å; N262-G265 PolarHBondContact OD1-N 2.56Å; N262-G265 VanDerWaalsContact OD1-N 3.12Å; G265-E267 VanDerWaalsContact C-N 3.25Å; G265-E267 PolarHBondContact O-N 2.96Å
266	S	85.7	Confident	85.4	Confident	21 Å²	21	68 Å²	68	15%	0.147	34%	0.344	C	S	.	.			trans	-68.1	-19.7	-177.7	63.4	0	0	0	0	114.3	A230 C231 N262 D264	A230-S266 CarbonylContact C-O 3.59Å; A230-S266 WeakPolarHBondContact CA-O 3.2Å; C231-S266 PolarHBondContact N-O 3.03Å; C231-S266 WeakPolarHBondContact O-CB 3.48Å; N262-S266 PolarHBondContact ND2-OG 3.04Å; N262-S266 PolarHBondContact OD1-N 3.07Å; D264-S266 VanDerWaalsContact C-N 3.27Å; D264-S266 PolarHBondContact O-N 3.4Å; D264-S266 WeakPolarHBondContact OD1-CB 3.31Å; D264-S266 PolarHBondContact OD1-N 3.4Å; D264-S266 PolarHBondContact OD1-OG 3.48Å; D264-S266 PolarHBondContact OD2-OG 2.97Å
267	E	87.9	Confident	86.5	Confident	63 Å²	63	60.6 Å²	60.6	29%	0.294	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	121.6	178.5	-69.3	177.3	176.9	0	0	110.1	K214 L228 L229 A230 L261 N262 G265	K214-E267 IonicContact NZ-OE1 2.75Å; K214-E267 PolarHBondContact NZ-OE1 3.25Å; L228-E267 HydrophobicContact CD1-CB 3.9Å; L228-E267 HydrophobicContact CD1-CG 4.3Å; L229-E267 WeakPolarHBondContact O-CA 3.05Å; A230-E267 HydrophobicContact CB-CG 4.18Å; L261-E267 WeakPolarHBondContact CA-O 3.16Å; N262-E267 HydrophobicContact CB-CB 4.39Å; N262-E267 PolarHBondContact N-O 3.37Å; N262-E267 PolarHBondContact ND2-N 3.39Å; N262-E267 PolarHBondContact OD1-N 3.44Å; N262-E267 PolarHBondContact OD1-O 2.85Å; G265-E267 VanDerWaalsContact C-N 3.25Å; G265-E267 PolarHBondContact O-N 2.96Å
268	L	88.5	Confident	87.1	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	117.8	176.9	167.9	61.7	0	0	0	109.4	L229 W243 V251 Y259 L261 I270 Y281	L229-L268 HydrophobicContact CB-CB 4.4Å; L229-L268 HydrophobicContact CD1-CD2 4.3Å; L229-L268 PolarHBondContact N-O 3.11Å; L229-L268 PolarHBondContact O-N 3.15Å; W243-L268 HydrophobicContact CB-CD2 3.77Å; W243-L268 HydrophobicContact CD2-CB 4.05Å; W243-L268 HydrophobicContact CD2-CD2 3.89Å; W243-L268 HydrophobicContact CE3-CD2 4.24Å; W243-L268 HydrophobicContact CG-CB 4.06Å; W243-L268 HydrophobicContact CG-CD2 3.7Å; W243-L268 HydrophobicContact CG-CG 4.46Å; W243-L268 HydrophobicContact CZ2-CB 4.35Å; V251-L268 HydrophobicContact CB-CD2 4.46Å; V251-L268 HydrophobicContact CG1-CD1 3.8Å; V251-L268 HydrophobicContact CG1-CD2 4.01Å; Y259-L268 HydrophobicContact CD1-CD1 3.98Å; Y259-L268 HydrophobicContact CG-CD1 4.39Å; L261-L268 HydrophobicContact CD2-CB 3.99Å; L261-L268 HydrophobicContact CD2-CD1 3.96Å; L261-L268 HydrophobicContact CG-CD1 4.49Å; L268-I270 HydrophobicContact CG-CG1 4.3Å; L268-Y281 HydrophobicContact CD2-CD1 4.24Å
269	V	90	Very high	87.1	Confident	51 Å²	51	57.7 Å²	57.7	31%	0.309	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	124.4	171.8	-178.1	0	0	0	0	109.4	A227 L228 Y259 S260	A227-V269 CarbonylContact O-C 3.56Å; A227-V269 WeakPolarHBondContact O-CA 3.3Å; L228-V269 HydrophobicContact CD1-CG2 4.09Å; Y259-V269 CarbonylContact C-O 3.55Å; Y259-V269 WeakPolarHBondContact CA-O 3.33Å; S260-V269 PolarHBondContact N-O 3.5Å; S260-V269 PolarHBondContact O-N 2.83Å
270	I	90.8	Very high	87.1	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	107	172.8	-53.5	166.8	0	0	0	106.6	S226 A227 L229 Y259 L268 V273 Y281 L298	S226-I270 CarbonylContact C-O 3.53Å; S226-I270 VanDerWaalsContact CA-O 3.24Å; S226-I270 WeakPolarHBondContact CA-O 3.34Å; A227-I270 HydrophobicContact CB-CB 4.31Å; A227-I270 HydrophobicContact CB-CD1 4.47Å; A227-I270 PolarHBondContact N-O 2.79Å; A227-I270 PolarHBondContact O-N 2.94Å; L229-I270 HydrophobicContact CD1-CD1 3.81Å; L229-I270 HydrophobicContact CG-CD1 4.2Å; Y259-I270 HydrophobicContact CD1-CB 4.36Å; Y259-I270 HydrophobicContact CD1-CG1 3.88Å; Y259-I270 HydrophobicContact CD1-CG2 4.27Å; Y259-I270 HydrophobicContact CE1-CB 4.41Å; Y259-I270 HydrophobicContact CE1-CG1 3.88Å; Y259-I270 HydrophobicContact CE1-CG2 3.97Å; L268-I270 HydrophobicContact CG-CG1 4.3Å; I270-V273 HydrophobicContact CB-CG2 4.36Å; I270-V273 HydrophobicContact CG2-CG2 4.13Å; I270-V273 WeakPolarHBondContact O-CG2 3.18Å; I270-Y281 HydrophobicContact CD1-CE1 4Å; I270-Y281 HydrophobicContact CD1-CE2 3.96Å; I270-L298 HydrophobicContact CD1-CD2 3.69Å
271	K	87.4	Confident	87.2	Confident	62 Å²	62	58 Å²	58	27%	0.27	29%	0.291	S	S	.	.			trans	-75.6	152.6	-178.8	-51.4	179.4	-159.2	141.4	0	110.1	D257 K258 Y259 V273	D257-K271 VanDerWaalsContact O-CD 3.27Å; D257-K271 WeakPolarHBondContact O-CD 3.04Å; D257-K271 WeakPolarHBondContact O-CE 3.36Å; D257-K271 PolarHBondContact O-NZ 3.43Å; D257-K271 IonicContact OD1-NZ 2.6Å; D257-K271 PolarHBondContact OD1-NZ 2.93Å; K258-K271 WeakPolarHBondContact CD-O 3.42Å; K258-K271 WeakPolarHBondContact CE-O 3.32Å; K258-K271 PolarHBondContact NZ-O 2.84Å; K258-K271 PolarHBondContact O-N 2.92Å; Y259-K271 PolarHBondContact O-NZ 2.84Å; K271-V273 PolarHBondContact O-N 2.85Å
272	E	86.8	Confident	87.2	Confident	150 Å²	150	56.3 Å²	56.3	70%	0.701	28%	0.282	S	S	*	.	S	Bend	trans	42.2	61.8	173.8	-61.8	-173	-176.2	0	0	113.6	E225 K258	E225-E272 PolarHBondContact O-N 2.85Å; K258-E272 PolarHBondContact NZ-O 3.2Å
273	V	88.7	Confident	87.4	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.006	27%	0.27	C	S	.	.			trans	-59.1	139.9	-174.1	173.6	0	0	0	0	111.4	A221 V223 G224 E225 A227 I270 K271 V300	A221-V273 HydrophobicContact CB-CB 4.49Å; A221-V273 HydrophobicContact CB-CG1 4.29Å; A221-V273 HydrophobicContact CB-CG2 4.22Å; V223-V273 CarbonylContact C-O 3.57Å; V223-V273 VanDerWaalsContact CA-O 3.26Å; V223-V273 WeakPolarHBondContact CA-O 3.42Å; G224-V273 PolarHBondContact N-O 2.89Å; E225-V273 WeakPolarHBondContact O-CB 3.47Å; E225-V273 WeakPolarHBondContact O-CG2 3.24Å; E225-V273 PolarHBondContact O-N 2.87Å; A227-V273 HydrophobicContact CB-CG2 3.8Å; I270-V273 HydrophobicContact CB-CG2 4.36Å; I270-V273 HydrophobicContact CG2-CG2 4.13Å; I270-V273 WeakPolarHBondContact O-CG2 3.18Å; K271-V273 PolarHBondContact O-N 2.85Å; V273-V300 HydrophobicContact CG1-CB 4.28Å; V273-V300 HydrophobicContact CG1-CG1 3.68Å; V273-V300 HydrophobicContact CG1-CG2 3.56Å
274	R	88.6	Confident	87.7	Confident	125 Å²	125	45.4 Å²	45.4	47%	0.472	23%	0.231	S	C	.	.			trans	-130.1	159.9	178.4	-51.9	162.1	-61.1	-171.8	6.8	108.4	V276 D277	R274-V276 HydrophobicContact CB-CG2 3.96Å; R274-V276 PolarHBondContact O-N 2.73Å; R274-D277 WeakPolarHBondContact CA-OD2 3.39Å; R274-D277 VanDerWaalsContact CB-OD2 3.27Å; R274-D277 WeakPolarHBondContact CB-OD2 3.45Å; R274-D277 IonicContact CZ-OD1 3.39Å; R274-D277 IonicContact CZ-OD2 3.55Å; R274-D277 PolarHBondContact N-OD2 3.05Å; R274-D277 IonicContact NE-OD1 2.75Å; R274-D277 PolarHBondContact NE-OD1 2.67Å; R274-D277 IonicContact NE-OD2 3.15Å; R274-D277 PolarHBondContact NE-OD2 2.82Å; R274-D277 IonicContact NH2-OD1 3.51Å; R274-D277 PolarHBondContact NH2-OD1 3.27Å; R274-D277 IonicContact NH2-OD2 2.79Å; R274-D277 WeakPolarHBondContact O-CB 3.49Å; R274-D277 PolarHBondContact O-N 3.01Å
275	K	85.8	Confident	88.2	Confident	73 Å²	73	41 Å²	41	32%	0.317	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-62	-14.4	177.4	-165.6	54.7	165.4	-179	0	114.7	E278 V300 D330	K275-E278 WeakPolarHBondContact CD-OE2 3.47Å; K275-E278 WeakPolarHBondContact CE-OE2 3.26Å; K275-E278 IonicContact NZ-OE1 3.52Å; K275-E278 PolarHBondContact NZ-OE1 2.93Å; K275-E278 IonicContact NZ-OE2 2.72Å; K275-E278 PolarHBondContact NZ-OE2 3.08Å; K275-E278 WeakPolarHBondContact O-CB 3.39Å; K275-V300 HydrophobicContact CD-CB 4.07Å; K275-V300 HydrophobicContact CD-CG1 4.32Å; K275-V300 WeakPolarHBondContact CD-O 3.31Å; K275-V300 PolarHBondContact NZ-O 3.02Å; K275-D330 WeakPolarHBondContact CE-OD2 3.32Å; K275-D330 IonicContact NZ-OD2 3.88Å; K275-D330 PolarHBondContact NZ-OD2 2.78Å
276	V	85.7	Confident	88.6	Confident	110 Å²	110	46 Å²	46	67%	0.667	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-85.2	-7	171.9	-62.1	0	0	0	0	114	R274	R274-V276 HydrophobicContact CB-CG2 3.96Å; R274-V276 PolarHBondContact O-N 2.73Å
277	D	86.9	Confident	88.9	Confident	4 Å²	4	46.1 Å²	46.1	2%	0.021	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-97.7	4.5	174.7	-44.8	-52.3	0	0	0	111.1	K258 R274 Y281	K258-D277 VanDerWaalsContact CE-CG 3.45Å; K258-D277 WeakPolarHBondContact CE-OD1 3.33Å; K258-D277 VanDerWaalsContact CE-OD2 3.22Å; K258-D277 WeakPolarHBondContact CE-OD2 3.48Å; K258-D277 IonicContact NZ-OD1 2.74Å; K258-D277 IonicContact NZ-OD2 3.52Å; K258-D277 PolarHBondContact NZ-OD2 3.46Å; R274-D277 WeakPolarHBondContact CA-OD2 3.39Å; R274-D277 VanDerWaalsContact CB-OD2 3.27Å; R274-D277 WeakPolarHBondContact CB-OD2 3.45Å; R274-D277 IonicContact CZ-OD1 3.39Å; R274-D277 IonicContact CZ-OD2 3.55Å; R274-D277 PolarHBondContact N-OD2 3.05Å; R274-D277 IonicContact NE-OD1 2.75Å; R274-D277 PolarHBondContact NE-OD1 2.67Å; R274-D277 IonicContact NE-OD2 3.15Å; R274-D277 PolarHBondContact NE-OD2 2.82Å; R274-D277 IonicContact NH2-OD1 3.51Å; R274-D277 PolarHBondContact NH2-OD1 3.27Å; R274-D277 IonicContact NH2-OD2 2.79Å; R274-D277 WeakPolarHBondContact O-CB 3.49Å; R274-D277 PolarHBondContact O-N 3.01Å; D277-Y281 PolarHBondContact O-OH 3.38Å
278	E	88.3	Confident	88.9	Confident	73 Å²	73	47.7 Å²	47.7	34%	0.341	23%	0.232	S	C	.	.			trans	-72.3	137.3	170.4	-179.6	164.9	-104.8	0	0	110.6	K275 L298 V300	K275-E278 WeakPolarHBondContact CD-OE2 3.47Å; K275-E278 WeakPolarHBondContact CE-OE2 3.26Å; K275-E278 IonicContact NZ-OE1 3.52Å; K275-E278 PolarHBondContact NZ-OE1 2.93Å; K275-E278 IonicContact NZ-OE2 2.72Å; K275-E278 PolarHBondContact NZ-OE2 3.08Å; K275-E278 WeakPolarHBondContact O-CB 3.39Å; E278-L298 WeakPolarHBondContact CG-O 3.42Å; E278-V300 HydrophobicContact CB-CB 4.08Å; E278-V300 HydrophobicContact CB-CG2 3.78Å; E278-V300 PolarHBondContact OE1-N 3.1Å
279	G	87.8	Confident	89	Confident	18 Å²	18	48.5 Å²	48.5	19%	0.186	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	150	-171.1	179.3	0	0	0	0	0	114.5	L298	G279-L298 PolarHBondContact N-O 2.71Å; G279-L298 VanDerWaalsContact N-O 3.17Å; G279-L298 PolarHBondContact O-N 3.35Å
280	D	88	Confident	89	Confident	61 Å²	61	47.2 Å²	47.2	33%	0.326	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	115.3	-174.7	-62.9	-46	0	0	0	111.9	D246 E295 S297	D246-D280 PolarHBondContact N-O 3.26Å; D280-E295 HydrophobicContact CB-CG 4.16Å; D280-S297 WeakPolarHBondContact OD1-CB 3.16Å; D280-S297 PolarHBondContact OD1-OG 3.29Å
281	Y	89.4	Confident	89.1	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	120	176.7	-73.4	-93.2	0	0	0	110.1	L229 Q245 V251 L268 I270 D277 V296 L298	L229-Y281 HydrophobicContact CD1-CD1 3.93Å; L229-Y281 HydrophobicContact CD1-CD2 3.64Å; L229-Y281 HydrophobicContact CD1-CE2 4.3Å; L229-Y281 HydrophobicContact CD1-CG 3.43Å; L229-Y281 VanDerWaalsContact CD1-CG 3.43Å; Q245-Y281 HydrophobicContact CB-CD1 4.18Å; Q245-Y281 HydrophobicContact CB-CE1 3.88Å; Q245-Y281 HydrophobicContact CG-CD1 4.41Å; Q245-Y281 HydrophobicContact CG-CE1 3.92Å; Q245-Y281 HydrophobicContact CG-CE2 4.48Å; Q245-Y281 PolarHBondContact NE2-OH 3.1Å; Q245-Y281 PolarHBondContact OE1-OH 3.5Å; V251-Y281 HydrophobicContact CG2-CD1 4.37Å; V251-Y281 HydrophobicContact CG2-CE1 4.15Å; L268-Y281 HydrophobicContact CD2-CD1 4.24Å; I270-Y281 HydrophobicContact CD1-CE1 4Å; I270-Y281 HydrophobicContact CD1-CE2 3.96Å; D277-Y281 PolarHBondContact O-OH 3.38Å; Y281-V296 PolarHBondContact N-O 3.33Å; Y281-V296 PolarHBondContact O-N 2.68Å; Y281-L298 HydrophobicContact CD2-CB 4.09Å; Y281-L298 HydrophobicContact CE2-CB 4.03Å; Y281-L298 HydrophobicContact CE2-CD2 4.22Å
282	T	89.1	Confident	89.3	Confident	11 Å²	11	52.4 Å²	52.4	7%	0.067	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	117.6	177	-54.5	0	0	0	0	110	W243 A244 K247 I284 T293 E294	W243-T282 CarbonylContact C-O 3.55Å; W243-T282 WeakPolarHBondContact CA-O 3.5Å; A244-T282 PolarHBondContact N-O 3.21Å; A244-T282 PolarHBondContact O-N 3.17Å; K247-T282 WeakPolarHBondContact CG-OG1 3.42Å; T282-I284 HydrophobicContact CG2-CG1 4.07Å; T282-T293 HydrophobicContact CG2-CG2 4.36Å; T282-E294 CarbonylContact C-O 3.47Å; T282-E294 WeakPolarHBondContact CA-O 3.5Å
283	C	89.7	Confident	89.5	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	137.2	163.1	170.7	0	0	0	0	109.6	C231 V241 W243 T293 E294	C231-C283 HydrophobicContact CB-CB 3.7Å; C231-C283 WeakPolarHBondContact CB-SG 3.23Å; C231-C283 WeakPolarHBondContact SG-CB 3.44Å; C231-C283 CovalentContact SG-SG 2.03Å; C231-C283 PolarHBondContact SG-SG 3.26Å; V241-C283 VanDerWaalsContact CG1-SG 3.58Å; W243-C283 HydrophobicContact CD2-CB 4.45Å; W243-C283 HydrophobicContact CE3-CB 4.11Å; W243-C283 HydrophobicContact CH2-CB 4.1Å; W243-C283 HydrophobicContact CZ2-CB 4.41Å; W243-C283 HydrophobicContact CZ3-CB 3.93Å; C283-T293 CarbonylContact O-C 3.47Å; C283-T293 WeakPolarHBondContact O-CA 3.17Å; C283-T293 WeakPolarHBondContact O-CB 2.92Å; C283-E294 PolarHBondContact N-O 3.04Å; C283-E294 PolarHBondContact O-N 2.97Å
284	I	90.9	Very high	89.5	Confident	32 Å²	32	51.9 Å²	51.9	16%	0.164	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	103.8	179.2	-52.3	176	0	0	0	108	T242 A244 T282 E291 T293	T242-I284 PolarHBondContact N-O 3.17Å; T242-I284 PolarHBondContact O-N 3.47Å; T242-I284 PolarHBondContact OG1-O 3.21Å; A244-I284 HydrophobicContact CB-CD1 4.18Å; T282-I284 HydrophobicContact CG2-CG1 4.07Å; I284-E291 HydrophobicContact CG2-CG 3.8Å; I284-T293 HydrophobicContact CB-CG2 4.26Å; I284-T293 HydrophobicContact CG1-CG2 3.9Å; I284-T293 HydrophobicContact CG2-CG2 4.1Å
285	A	92	Very high	89.4	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	124.5	177.4	0	0	0	0	0	110.4	P208 I210 A233 P239 V241 E291 K292	P208-A285 HydrophobicContact CB-CB 3.96Å; I210-A285 HydrophobicContact CD1-CB 4.09Å; I210-A285 HydrophobicContact CG1-CB 4.09Å; A233-A285 HydrophobicContact CB-CB 3.67Å; P239-A285 HydrophobicContact CB-CB 4.3Å; V241-A285 HydrophobicContact CG2-CB 4.39Å; A285-E291 WeakPolarHBondContact O-CA 3.4Å; A285-K292 PolarHBondContact N-O 3.27Å; A285-K292 PolarHBondContact O-N 3.05Å
286	K	92.3	Very high	89.4	Confident	112 Å²	112	46.3 Å²	46.3	49%	0.487	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	133.9	-168	-167.5	171.5	-169.7	146.9	0	113.4	P239 T240 E291	P239-K286 CarbonylContact C-O 3.56Å; P239-K286 VanDerWaalsContact CA-O 3.31Å; P239-K286 WeakPolarHBondContact CA-O 3.35Å; T240-K286 PolarHBondContact N-O 2.79Å; T240-K286 PolarHBondContact O-N 3.11Å; K286-E291 HydrophobicContact CB-CG 4.29Å; K286-E291 HydrophobicContact CD-CG 4.39Å; K286-E291 VanDerWaalsContact CD-OE2 3.29Å; K286-E291 WeakPolarHBondContact CD-OE2 3.33Å; K286-E291 WeakPolarHBondContact CE-OE2 3.37Å; K286-E291 HydrophobicContact CG-CB 4.28Å; K286-E291 HydrophobicContact CG-CG 4.24Å; K286-E291 IonicContact NZ-OE2 3.42Å; K286-E291 PolarHBondContact NZ-OE2 2.9Å
287	N	92.3	Very high	89.5	Confident	22 Å²	22	42.6 Å²	42.6	12%	0.118	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	-172.7	169.3	74.6	14.7	0	0	0	111	V206 P208 F236 P237 P239 A289 G290	V206-N287 PolarHBondContact O-ND2 3.26Å; P208-N287 WeakPolarHBondContact CD-OD1 3.48Å; P208-N287 HydrophobicContact CG-CB 4.29Å; F236-N287 PolarHBondContact N-ND2 2.69Å; P237-N287 WeakPolarHBondContact O-CB 3.45Å; P237-N287 PolarHBondContact O-ND2 2.74Å; P239-N287 HydrophobicContact CB-CB 4.39Å; N287-A289 VanDerWaalsContact C-N 3.29Å; N287-A289 PolarHBondContact O-N 2.86Å; N287-A289 WeakPolarHBondContact OD1-CA 3.29Å; N287-A289 WeakPolarHBondContact OD1-CB 3.47Å; N287-A289 PolarHBondContact OD1-N 2.8Å; N287-G290 PolarHBondContact N-O 3.2Å; N287-G290 PolarHBondContact O-N 2.83Å; N287-G290 VanDerWaalsContact O-N 3.14Å; N287-G290 PolarHBondContact OD1-N 2.91Å
288	K	88.9	Confident	89.5	Confident	96 Å²	96	42.6 Å²	42.6	42%	0.417	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-10.8	-179.8	56.9	157.2	163.8	149.5	0	116.1	E124 N205 P237	E124-K288 IonicContact OE1-NZ 2.64Å; E124-K288 PolarHBondContact OE1-NZ 2.86Å; E124-K288 IonicContact OE2-NZ 3.53Å; E124-K288 PolarHBondContact OE2-NZ 2.58Å; N205-K288 VanDerWaalsContact OD1-CE 3.24Å; N205-K288 WeakPolarHBondContact OD1-CE 3.09Å; N205-K288 PolarHBondContact OD1-NZ 3.21Å; P237-K288 VanDerWaalsContact CD-CE 3.49Å; P237-K288 HydrophobicContact CG-CD 4.22Å; P237-K288 HydrophobicContact CG-CG 3.9Å
289	A	89.7	Confident	89.4	Confident	17 Å²	17	41.7 Å²	41.7	14%	0.14	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-24.3	167.9	0	0	0	0	0	112.4	N126 N205 L207 N287	N126-A289 HydrophobicContact CB-CB 4.46Å; N205-A289 HydrophobicContact CB-CB 3.76Å; L207-A289 HydrophobicContact CB-CB 4.43Å; N287-A289 VanDerWaalsContact C-N 3.29Å; N287-A289 PolarHBondContact O-N 2.86Å; N287-A289 WeakPolarHBondContact OD1-CA 3.29Å; N287-A289 WeakPolarHBondContact OD1-CB 3.47Å; N287-A289 PolarHBondContact OD1-N 2.8Å
290	G	90.7	Very high	89.5	Confident	25 Å²	25	40.9 Å²	40.9	26%	0.258	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	149.3	-151.5	177.6	0	0	0	0	0	113	L207 N287	L207-G290 VanDerWaalsContact CD1-CA 3.49Å; N287-G290 PolarHBondContact N-O 3.2Å; N287-G290 PolarHBondContact O-N 2.83Å; N287-G290 VanDerWaalsContact O-N 3.14Å; N287-G290 PolarHBondContact OD1-N 2.91Å
291	E	92.6	Very high	89.5	Confident	91 Å²	91	40.5 Å²	40.5	43%	0.425	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	141.5	-167	-169.4	175.5	125.6	0	0	110.1	I284 A285 K286	I284-E291 HydrophobicContact CG2-CG 3.8Å; A285-E291 WeakPolarHBondContact O-CA 3.4Å; K286-E291 HydrophobicContact CB-CG 4.29Å; K286-E291 HydrophobicContact CD-CG 4.39Å; K286-E291 VanDerWaalsContact CD-OE2 3.29Å; K286-E291 WeakPolarHBondContact CD-OE2 3.33Å; K286-E291 WeakPolarHBondContact CE-OE2 3.37Å; K286-E291 HydrophobicContact CG-CB 4.28Å; K286-E291 HydrophobicContact CG-CG 4.24Å; K286-E291 IonicContact NZ-OE2 3.42Å; K286-E291 PolarHBondContact NZ-OE2 2.9Å
292	K	92.3	Very high	89.4	Confident	80 Å²	80	42.5 Å²	42.5	35%	0.348	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	136.9	172	177.8	66.7	175.6	88.4	0	108.7	P208 I210 A285 E294	P208-K292 HydrophobicContact CB-CB 4.32Å; P208-K292 VanDerWaalsContact O-CB 3.29Å; P208-K292 WeakPolarHBondContact O-CB 3.35Å; I210-K292 HydrophobicContact CD1-CG 4.15Å; I210-K292 WeakPolarHBondContact CD1-O 3.24Å; I210-K292 HydrophobicContact CG1-CG 4.26Å; A285-K292 PolarHBondContact N-O 3.27Å; A285-K292 PolarHBondContact O-N 3.05Å; K292-E294 IonicContact NZ-OE2 3.62Å; K292-E294 PolarHBondContact NZ-OE2 2.93Å
293	T	90.2	Very high	89.3	Confident	63 Å²	63	46.5 Å²	46.5	39%	0.387	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	149.6	176.8	61.2	0	0	0	0	111.2	T282 C283 I284	T282-T293 HydrophobicContact CG2-CG2 4.36Å; C283-T293 CarbonylContact O-C 3.47Å; C283-T293 WeakPolarHBondContact O-CA 3.17Å; C283-T293 WeakPolarHBondContact O-CB 2.92Å; I284-T293 HydrophobicContact CB-CG2 4.26Å; I284-T293 HydrophobicContact CG1-CG2 3.9Å; I284-T293 HydrophobicContact CG2-CG2 4.1Å
294	E	88.1	Confident	89.4	Confident	76 Å²	76	47 Å²	47	36%	0.355	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	161.4	170.4	-151.8	75.9	-162.6	0	0	108.4	I210 T282 C283 K292	I210-E294 HydrophobicContact CB-CB 4.22Å; I210-E294 HydrophobicContact CD1-CB 3.81Å; I210-E294 HydrophobicContact CG2-CB 3.83Å; I210-E294 HydrophobicContact CG2-CG 4.27Å; T282-E294 CarbonylContact C-O 3.47Å; T282-E294 WeakPolarHBondContact CA-O 3.5Å; C283-E294 PolarHBondContact N-O 3.04Å; C283-E294 PolarHBondContact O-N 2.97Å; K292-E294 IonicContact NZ-OE2 3.62Å; K292-E294 PolarHBondContact NZ-OE2 2.93Å
295	E	86.3	Confident	89.5	Confident	77 Å²	77	49.4 Å²	49.4	36%	0.36	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	136.6	-165.9	-164.5	168.2	154.5	0	0	111.1	K247 D280	K247-E295 VanDerWaalsContact CE-CD 3.43Å; K247-E295 WeakPolarHBondContact CE-OE1 3.29Å; K247-E295 WeakPolarHBondContact CE-OE2 3.32Å; K247-E295 IonicContact NZ-OE1 2.71Å; K247-E295 PolarHBondContact NZ-OE1 3.1Å; K247-E295 IonicContact NZ-OE2 3.64Å; K247-E295 PolarHBondContact NZ-OE2 3.46Å; D280-E295 HydrophobicContact CB-CG 4.16Å
296	V	87.1	Confident	89.6	Confident	4 Å²	4	49.7 Å²	49.7	2%	0.024	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	118.9	-174.6	-179.4	0	0	0	0	109	S215 E216 V217 L229 W243 Y281	S215-V296 WeakPolarHBondContact OG-CG2 3.5Å; E216-V296 WeakPolarHBondContact O-CG1 3.45Å; V217-V296 WeakPolarHBondContact O-CA 3.44Å; L229-V296 HydrophobicContact CD2-CG1 4.11Å; W243-V296 HydrophobicContact CZ3-CG2 4.39Å; Y281-V296 PolarHBondContact N-O 3.33Å; Y281-V296 PolarHBondContact O-N 2.68Å
297	S	86.8	Confident	89.5	Confident	33 Å²	33	48.1 Å²	48.1	23%	0.231	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	120.3	178.5	-54.3	0	0	0	0	110.4	V217 N218 A219 D280 N299	V217-S297 PolarHBondContact O-N 2.84Å; N218-S297 CarbonylContact C-O 3.55Å; N218-S297 VanDerWaalsContact CA-O 3.31Å; N218-S297 WeakPolarHBondContact CA-O 3.24Å; A219-S297 PolarHBondContact N-O 3.34Å; D280-S297 WeakPolarHBondContact OD1-CB 3.16Å; D280-S297 PolarHBondContact OD1-OG 3.29Å; S297-N299 PolarHBondContact O-ND2 2.84Å
298	L	87.8	Confident	89.3	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.016	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	120	168	176	59	0	0	0	109.2	A219 A221 A227 L229 I270 E278 G279 Y281 V300	A219-L298 HydrophobicContact CB-CD1 3.93Å; A221-L298 HydrophobicContact CB-CD1 4.33Å; A227-L298 HydrophobicContact CB-CD1 3.87Å; A227-L298 HydrophobicContact CB-CD2 3.92Å; L229-L298 HydrophobicContact CD2-CB 4.5Å; I270-L298 HydrophobicContact CD1-CD2 3.69Å; E278-L298 WeakPolarHBondContact CG-O 3.42Å; G279-L298 PolarHBondContact N-O 2.71Å; G279-L298 VanDerWaalsContact N-O 3.17Å; G279-L298 PolarHBondContact O-N 3.35Å; Y281-L298 HydrophobicContact CD2-CB 4.09Å; Y281-L298 HydrophobicContact CE2-CB 4.03Å; Y281-L298 HydrophobicContact CE2-CD2 4.22Å; L298-V300 HydrophobicContact CD2-CG2 4.25Å; L298-V300 HydrophobicContact CG-CG2 4.03Å
299	N	86.8	Confident	89.3	Confident	55 Å²	55	48.5 Å²	48.5	29%	0.294	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	130.9	172.2	-56.8	-102.1	0	0	0	108.4	A219 T220 A221 S297 F301	A219-N299 PolarHBondContact O-N 2.79Å; A219-N299 PolarHBondContact O-ND2 2.86Å; T220-N299 WeakPolarHBondContact CA-O 3.11Å; T220-N299 HydrophobicContact CG2-CB 4.39Å; A221-N299 PolarHBondContact N-O 2.71Å; A221-N299 VanDerWaalsContact N-O 3.16Å; S297-N299 PolarHBondContact O-ND2 2.84Å; N299-F301 HydrophobicContact CB-CZ 4.47Å
300	V	89.3	Confident	89.1	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	116.5	-176.3	179.8	0	0	0	0	110.6	A221 V223 V273 K275 E278 L298	A221-V300 WeakPolarHBondContact O-CA 3.34Å; V223-V300 HydrophobicContact CG2-CG1 3.64Å; V273-V300 HydrophobicContact CG1-CB 4.28Å; V273-V300 HydrophobicContact CG1-CG1 3.68Å; V273-V300 HydrophobicContact CG1-CG2 3.56Å; K275-V300 HydrophobicContact CD-CB 4.07Å; K275-V300 HydrophobicContact CD-CG1 4.32Å; K275-V300 WeakPolarHBondContact CD-O 3.31Å; K275-V300 PolarHBondContact NZ-O 3.02Å; E278-V300 HydrophobicContact CB-CB 4.08Å; E278-V300 HydrophobicContact CB-CG2 3.78Å; E278-V300 PolarHBondContact OE1-N 3.1Å; L298-V300 HydrophobicContact CD2-CG2 4.25Å; L298-V300 HydrophobicContact CG-CG2 4.03Å
301	F	87.8	Confident	88.8	Confident	53 Å²	53	56 Å²	56	23%	0.232	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	155.8	179	-58.2	-53.8	0	0	0	112.3	T220 A221 V223 N299 D330 P331 I397	T220-F301 HydrophobicContact CG2-CE2 3.67Å; T220-F301 HydrophobicContact CG2-CZ 4.18Å; A221-F301 PolarHBondContact O-N 3.29Å; V223-F301 PolarHBondContact N-O 3.14Å; N299-F301 HydrophobicContact CB-CZ 4.47Å; F301-D330 CarbonylContact C-O 3.49Å; F301-D330 WeakPolarHBondContact CA-O 3.42Å; F301-D330 WeakPolarHBondContact CB-O 3.45Å; F301-P331 HydrophobicContact CD1-CG 4.48Å; F301-I397 HydrophobicContact CB-CD1 3.83Å; F301-I397 HydrophobicContact CB-CG1 3.82Å; F301-I397 HydrophobicContact CD2-CD1 3.69Å; F301-I397 HydrophobicContact CE2-CD1 4.41Å; F301-I397 HydrophobicContact CG-CD1 3.83Å; F301-I397 HydrophobicContact CG-CG1 4.3Å
302	V	87.1	Confident	88.6	Confident	43 Å²	43	55 Å²	55	26%	0.261	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	122.6	-178.3	-168.3	0	0	0	0	108.4	V223 D330 N395	V223-V302 HydrophobicContact CG2-CG2 3.89Å; V302-D330 HydrophobicContact CB-CB 4.1Å; V302-D330 HydrophobicContact CG2-CB 4.01Å; V302-D330 PolarHBondContact N-O 3.37Å; V302-D330 PolarHBondContact O-N 2.82Å; V302-N395 PolarHBondContact O-ND2 2.86Å
303	L	87.7	Confident	88.3	Confident	94 Å²	94	54.9 Å²	54.9	49%	0.492	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.9	149.2	172.9	-79.9	166.3	0	0	0	111.4	I397	L303-I397 HydrophobicContact CD2-CB 4.06Å; L303-I397 HydrophobicContact CD2-CG2 3.68Å; L303-I397 HydrophobicContact CG-CG2 4.13Å
304	P	91.8	Very high	88	Confident	11 Å²	11	52 Å²	52	7%	0.071	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	144.5	171.5	-21.4	34.6	0	0	0	111.5	S328 P333 A393 N395 G398 D400	P304-S328 CarbonylContact C-O 3.45Å; P304-S328 WeakPolarHBondContact CA-O 3.27Å; P304-P333 HydrophobicContact CB-CB 4.03Å; P304-P333 HydrophobicContact CB-CG 4.48Å; P304-P333 HydrophobicContact CG-CB 4.16Å; P304-A393 HydrophobicContact CB-CB 4.24Å; P304-A393 WeakPolarHBondContact CB-O 3.47Å; P304-N395 WeakPolarHBondContact CD-OD1 3.03Å; P304-N395 HydrophobicContact CG-CB 4.13Å; P304-G398 WeakPolarHBondContact CG-O 3.43Å; P304-D400 HydrophobicContact CB-CB 4.46Å; P304-D400 WeakPolarHBondContact O-CB 3.38Å
305	N	92.4	Very high	87.7	Confident	82 Å²	82	49.4 Å²	49.4	44%	0.439	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	118.6	175.7	170.2	36.5	0	0	0	108.7	T307 A327 S328	N305-T307 PolarHBondContact O-N 2.65Å; N305-A327 CarbonylContact O-C 3.57Å; N305-A327 VanDerWaalsContact O-CA 3.23Å; N305-A327 WeakPolarHBondContact O-CA 3.26Å; N305-S328 PolarHBondContact N-O 3.12Å; N305-S328 PolarHBondContact O-N 2.75Å; N305-S328 PolarHBondContact O-OG 3.41Å
306	I	93.9	Very high	87.3	Confident	6 Å²	6	47.3 Å²	47.3	3%	0.031	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	105.8	179.8	-66.7	163.2	0	0	0	108.8	F309 C325 E326 A327 C391 A393 D400 Q402	I306-F309 HydrophobicContact CG2-CB 3.65Å; I306-F309 HydrophobicContact CG2-CG 4.38Å; I306-C325 VanDerWaalsContact CG2-SG 3.6Å; I306-E326 CarbonylContact C-O 3.57Å; I306-A327 HydrophobicContact CG1-CB 3.98Å; I306-C391 HydrophobicContact CD1-CB 4.26Å; I306-C391 WeakPolarHBondContact CD1-O 3.26Å; I306-A393 HydrophobicContact CD1-CB 4.09Å; I306-A393 HydrophobicContact CG1-CB 3.69Å; I306-D400 WeakPolarHBondContact CB-OD2 3.5Å; I306-D400 HydrophobicContact CD1-CB 4.46Å; I306-D400 HydrophobicContact CG1-CB 4.43Å; I306-D400 PolarHBondContact N-OD2 3.47Å; I306-Q402 HydrophobicContact CB-CG 4.08Å; I306-Q402 HydrophobicContact CD1-CB 4.12Å; I306-Q402 HydrophobicContact CD1-CG 4.11Å; I306-Q402 HydrophobicContact CG2-CB 4.31Å; I306-Q402 HydrophobicContact CG2-CG 4.26Å; I306-Q402 PolarHBondContact O-NE2 3.44Å
307	T	90.7	Very high	86.7	Confident	79 Å²	79	53.8 Å²	53.8	49%	0.485	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-23.9	-174.5	55.3	0	0	0	0	114.3	N305 E326 S328	N305-T307 PolarHBondContact O-N 2.65Å; T307-E326 PolarHBondContact N-O 2.71Å; T307-E326 PolarHBondContact OG1-O 3.21Å; T307-S328 WeakPolarHBondContact CG2-OG 3.12Å
308	Y	88.4	Confident	86.3	Confident	106 Å²	106	55.3 Å²	55.3	42%	0.416	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	114.8	177.2	-176.9	-84.4	0	0	0	109.9	N310 C325 E326	Y308-N310 WeakPolarHBondContact CE2-ND2 3.48Å; Y308-N310 VanDerWaalsContact CZ-ND2 3.28Å; Y308-N310 PolarHBondContact OH-ND2 3.22Å; Y308-C325 WeakPolarHBondContact O-CA 3.31Å; Y308-E326 PolarHBondContact N-O 3.29Å; Y308-E326 VanDerWaalsContact N-O 3.13Å; Y308-E326 PolarHBondContact O-N 3.16Å
309	F	88.1	Confident	85.8	Confident	20 Å²	20	61.6 Å²	61.6	9%	0.088	32%	0.319	C	S	.	.			trans	-154.8	79.6	172.6	-161.1	-125.7	0	0	0	111.6	I306 C325 W337 C391 Q402 L404	I306-F309 HydrophobicContact CG2-CB 3.65Å; I306-F309 HydrophobicContact CG2-CG 4.38Å; F309-C325 HydrophobicContact CD2-CB 3.65Å; F309-C325 HydrophobicContact CE2-CB 3.91Å; F309-W337 HydrophobicContact CE2-CE3 4.44Å; F309-W337 AromaticContact CE2-CH2 3.62Å; F309-W337 HydrophobicContact CE2-CH2 3.62Å; F309-W337 AromaticContact CE2-CZ3 3.5Å; F309-W337 HydrophobicContact CE2-CZ3 3.5Å; F309-W337 HydrophobicContact CZ-CH2 4.44Å; F309-W337 AromaticContact CZ-CZ3 3.88Å; F309-W337 HydrophobicContact CZ-CZ3 3.88Å; F309-C391 HydrophobicContact CD1-CB 4.28Å; F309-C391 HydrophobicContact CD2-CB 3.82Å; F309-C391 HydrophobicContact CE1-CB 3.86Å; F309-C391 HydrophobicContact CE2-CB 3.39Å; F309-C391 HydrophobicContact CG-CB 4.25Å; F309-C391 HydrophobicContact CZ-CB 3.4Å; F309-C391 VanDerWaalsContact CZ-CB 3.4Å; F309-Q402 HydrophobicContact CD1-CB 3.82Å; F309-Q402 WeakPolarHBondContact CE1-O 3.49Å; F309-L404 HydrophobicContact CD1-CB 3.96Å; F309-L404 HydrophobicContact CD1-CD2 4.29Å; F309-L404 HydrophobicContact CD1-CG 4.3Å; F309-L404 HydrophobicContact CD2-CD2 3.96Å; F309-L404 HydrophobicContact CE1-CB 3.67Å; F309-L404 HydrophobicContact CE1-CD2 3.85Å; F309-L404 HydrophobicContact CE1-CG 3.63Å; F309-L404 HydrophobicContact CE2-CD2 3.47Å; F309-L404 VanDerWaalsContact CE2-CD2 3.47Å; F309-L404 HydrophobicContact CE2-CG 4.13Å; F309-L404 HydrophobicContact CG-CD2 4.34Å; F309-L404 HydrophobicContact CZ-CB 4.11Å; F309-L404 HydrophobicContact CZ-CD2 3.42Å; F309-L404 VanDerWaalsContact CZ-CD2 3.42Å; F309-L404 HydrophobicContact CZ-CG 3.52Å
310	N	84.8	Confident	85.8	Confident	91 Å²	91	63.3 Å²	63.3	49%	0.487	33%	0.325	S	S	.	.			trans	-91.5	144.5	-174.9	-73	-41.4	0	0	0	112.8	Y308 L404	Y308-N310 WeakPolarHBondContact CE2-ND2 3.48Å; Y308-N310 VanDerWaalsContact CZ-ND2 3.28Å; Y308-N310 PolarHBondContact OH-ND2 3.22Å; N310-L404 WeakPolarHBondContact O-CD2 3.39Å
311	N	85.3	Confident	85.8	Confident	108 Å²	108	64 Å²	64	58%	0.578	33%	0.329	S	S	*	.			trans	-54.5	144.3	167.3	-66.3	-27.7	0	0	0	110.9	L404 F405	N311-L404 WeakPolarHBondContact OD1-CA 3.26Å; N311-F405 PolarHBondContact OD1-N 2.82Å
312	Q	87.6	Confident	85.9	Confident	70 Å²	70	63.4 Å²	63.4	33%	0.327	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	152	176.6	-70.5	-78.6	44.1	0	0	110	V321 T322 L323 L406 E407	Q312-V321 HydrophobicContact CB-CG2 4.46Å; Q312-T322 PolarHBondContact NE2-O 2.71Å; Q312-L323 HydrophobicContact CB-CD2 3.8Å; Q312-L323 HydrophobicContact CG-CD2 3.76Å; Q312-L406 HydrophobicContact CB-CD1 4.05Å; Q312-E407 PolarHBondContact O-N 2.95Å
313	T	85.8	Confident	86.1	Confident	78 Å²	78	61.4 Å²	61.4	48%	0.479	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	136.5	171.2	-49.9	0	0	0	0	108.5	E407 R409	T313-E407 CarbonylContact C-O 3.6Å; T313-E407 VanDerWaalsContact CA-O 3.32Å; T313-E407 WeakPolarHBondContact CA-O 3.11Å; T313-E407 HydrophobicContact CG2-CB 4.22Å; T313-E407 HydrophobicContact CG2-CG 4.27Å; T313-E407 WeakPolarHBondContact CG2-O 3.13Å; T313-R409 HydrophobicContact CG2-CG 4.29Å
314	A	84.2	Confident	86.3	Confident	4 Å²	4	59 Å²	59	3%	0.033	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	169	175.7	0	0	0	0	0	110.5	D318 V321 V381 L406 E407 V408 R409	A314-D318 VanDerWaalsContact CA-OD2 3.27Å; A314-D318 WeakPolarHBondContact CA-OD2 3.43Å; A314-V321 HydrophobicContact CB-CB 4.02Å; A314-V321 HydrophobicContact CB-CG1 4.26Å; A314-V321 HydrophobicContact CB-CG2 4.08Å; A314-V381 HydrophobicContact CB-CG1 4.08Å; A314-L406 HydrophobicContact CB-CD1 4.18Å; A314-E407 PolarHBondContact N-O 3.32Å; A314-V408 CarbonylContact O-C 3.53Å; A314-V408 WeakPolarHBondContact O-CA 3.18Å; A314-R409 PolarHBondContact O-N 2.75Å
315	S	83.1	Confident	86.3	Confident	21 Å²	21	58.5 Å²	58.5	15%	0.147	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	154.9	173.8	-166.1	0	0	0	0	110.4	F317 D318 R409	S315-F317 PolarHBondContact O-N 2.87Å; S315-D318 PolarHBondContact N-OD2 2.83Å; S315-D318 PolarHBondContact O-N 2.96Å; S315-R409 CarbonylContact C-O 3.58Å; S315-R409 WeakPolarHBondContact CA-O 3.48Å
316	E	77.3	Confident	86.4	Confident	33 Å²	33	56.8 Å²	56.8	15%	0.154	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	1.2	170.6	74.5	179.9	161.3	0	0	113.7	V381 R409 S411 K413 I491	E316-V381 WeakPolarHBondContact CA-O 3.35Å; E316-R409 PolarHBondContact N-O 2.83Å; E316-S411 WeakPolarHBondContact OE1-CB 3.44Å; E316-S411 PolarHBondContact OE1-N 3.47Å; E316-S411 PolarHBondContact OE1-OG 3.49Å; E316-S411 PolarHBondContact OE2-OG 2.95Å; E316-K413 IonicContact OE1-NZ 2.74Å; E316-K413 IonicContact OE2-NZ 3.47Å; E316-K413 PolarHBondContact OE2-NZ 2.65Å; E316-I491 HydrophobicContact CG-CG2 4.39Å
317	F	75.1	Confident	86.5	Confident	140 Å²	140	56.5 Å²	56.5	61%	0.614	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.2	4.4	176.3	-55.8	-54.6	0	0	0	113.1	S315 I491	S315-F317 PolarHBondContact O-N 2.87Å; F317-I491 HydrophobicContact CD2-CG2 4.22Å; F317-I491 HydrophobicContact CE2-CG2 3.63Å; F317-I491 HydrophobicContact CZ-CG2 4.47Å
318	D	76.8	Confident	86.5	Confident	64 Å²	64	55 Å²	55	34%	0.342	28%	0.284	S	S	.	.			trans	-85.2	117.8	178.6	-65.6	-15.8	0	0	0	110	A314 S315 E320 V381	A314-D318 VanDerWaalsContact CA-OD2 3.27Å; A314-D318 WeakPolarHBondContact CA-OD2 3.43Å; S315-D318 PolarHBondContact N-OD2 2.83Å; S315-D318 PolarHBondContact O-N 2.96Å; D318-E320 PolarHBondContact O-N 3.42Å; D318-V381 WeakPolarHBondContact O-CG2 3.35Å; D318-V381 PolarHBondContact O-N 3.24Å
319	D	77.8	Confident	86.6	Confident	135 Å²	135	50.7 Å²	50.7	72%	0.722	27%	0.273	S	S	*	.	S	Bend	trans	-55.8	-35.8	179.8	-66.9	-30.9	0	0	0	112.3	K379 D380	D319-K379 CarbonylContact O-C 3.54Å; D319-K379 VanDerWaalsContact O-CA 3.25Å; D319-K379 WeakPolarHBondContact O-CA 3.33Å; D319-D380 PolarHBondContact O-N 3.35Å
320	E	86.1	Confident	86.6	Confident	92 Å²	92	52.4 Å²	52.4	43%	0.43	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	146.3	168.8	67.1	-178.5	-154.9	0	0	114	D318 T377 L378 K379	D318-E320 PolarHBondContact O-N 3.42Å; E320-T377 HydrophobicContact CB-CG2 3.81Å; E320-T377 HydrophobicContact CG-CG2 4.11Å; E320-L378 CarbonylContact C-O 3.56Å; E320-L378 WeakPolarHBondContact CA-O 3.39Å; E320-L378 WeakPolarHBondContact CB-O 3.37Å; E320-K379 HydrophobicContact CB-CB 4.42Å; E320-K379 HydrophobicContact CB-CG 3.9Å; E320-K379 WeakPolarHBondContact OE2-CE 3.44Å; E320-K379 IonicContact OE2-NZ 2.86Å; E320-K379 PolarHBondContact OE2-NZ 2.85Å
321	V	89.6	Confident	86.8	Confident	13 Å²	13	50.3 Å²	50.3	8%	0.079	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	138.7	167.8	66.3	0	0	0	0	109.8	Q312 A314 T377 L378 V381 L406	Q312-V321 HydrophobicContact CB-CG2 4.46Å; A314-V321 HydrophobicContact CB-CB 4.02Å; A314-V321 HydrophobicContact CB-CG1 4.26Å; A314-V321 HydrophobicContact CB-CG2 4.08Å; V321-T377 CarbonylContact O-C 3.55Å; V321-T377 WeakPolarHBondContact O-CA 3.39Å; V321-L378 HydrophobicContact CG1-CB 4.07Å; V321-L378 HydrophobicContact CG1-CD1 4.19Å; V321-L378 HydrophobicContact CG1-CG 4.4Å; V321-L378 PolarHBondContact N-O 2.76Å; V321-L378 PolarHBondContact O-N 2.98Å; V321-V381 HydrophobicContact CB-CG2 4.15Å; V321-V381 HydrophobicContact CG1-CG1 4.47Å; V321-V381 HydrophobicContact CG1-CG2 3.67Å; V321-L406 HydrophobicContact CG1-CD1 4.46Å; V321-L406 HydrophobicContact CG1-CD2 4.2Å; V321-L406 HydrophobicContact CG2-CD1 4.25Å
322	T	90	Very high	87	Confident	42 Å²	42	49.3 Å²	49.3	26%	0.258	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	119.6	177.2	-61.7	0	0	0	0	111.4	Q312 T377	Q312-T322 PolarHBondContact NE2-O 2.71Å; T322-T377 WeakPolarHBondContact OG1-CG2 3.22Å; T322-T377 PolarHBondContact OG1-OG1 3.37Å
323	L	91.6	Very high	87.2	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	137.2	165.6	-50.8	-177	0	0	0	108.2	Q312 W337 S375 L376 Y389 L404 L406	Q312-L323 HydrophobicContact CB-CD2 3.8Å; Q312-L323 HydrophobicContact CG-CD2 3.76Å; L323-W337 HydrophobicContact CB-CH2 3.52Å; L323-W337 HydrophobicContact CB-CZ3 3.53Å; L323-W337 HydrophobicContact CD1-CZ3 4.04Å; L323-W337 HydrophobicContact CG-CZ3 4.45Å; L323-W337 WeakPolarHBondContact O-CH2 3.2Å; L323-S375 CarbonylContact O-C 3.57Å; L323-S375 VanDerWaalsContact O-CA 3.29Å; L323-S375 WeakPolarHBondContact O-CA 3.45Å; L323-L376 HydrophobicContact CB-CB 4.42Å; L323-L376 HydrophobicContact CD1-CD2 4.3Å; L323-L376 PolarHBondContact N-O 2.98Å; L323-L376 PolarHBondContact O-N 3Å; L323-Y389 HydrophobicContact CD1-CD1 3.62Å; L323-Y389 HydrophobicContact CD1-CD2 3.77Å; L323-Y389 HydrophobicContact CD1-CE1 4.12Å; L323-Y389 HydrophobicContact CD1-CE2 4.27Å; L323-Y389 HydrophobicContact CD1-CG 3.43Å; L323-Y389 VanDerWaalsContact CD1-CG 3.43Å; L323-L404 HydrophobicContact CB-CD2 4.35Å; L323-L404 HydrophobicContact CD1-CD1 4.14Å; L323-L404 HydrophobicContact CD1-CD2 4.42Å; L323-L404 HydrophobicContact CD2-CD1 4.11Å; L323-L404 HydrophobicContact CD2-CD2 4.16Å; L323-L406 HydrophobicContact CD2-CD1 4.31Å
324	T	91.8	Very high	87.4	Confident	44 Å²	44	47.1 Å²	47.1	27%	0.27	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	134.6	-179.3	-56.3	0	0	0	0	110.4	V373	T324-V373 HydrophobicContact CG2-CG1 3.9Å
325	C	93	Very high	87.8	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	129	175.5	-167.8	0	0	0	0	110	I306 Y308 F309 I335 W337 V373 S374 C391	I306-C325 VanDerWaalsContact CG2-SG 3.6Å; Y308-C325 WeakPolarHBondContact O-CA 3.31Å; F309-C325 HydrophobicContact CD2-CB 3.65Å; F309-C325 HydrophobicContact CE2-CB 3.91Å; C325-I335 HydrophobicContact CB-CG2 4.25Å; C325-W337 HydrophobicContact CB-CH2 4.02Å; C325-W337 HydrophobicContact CB-CZ2 3.8Å; C325-V373 WeakPolarHBondContact O-CA 3.37Å; C325-S374 PolarHBondContact N-O 2.79Å; C325-S374 PolarHBondContact O-N 2.88Å; C325-C391 HydrophobicContact CB-CB 3.75Å; C325-C391 WeakPolarHBondContact CB-SG 3.41Å; C325-C391 WeakPolarHBondContact SG-CB 3.38Å; C325-C391 CovalentContact SG-SG 2.03Å; C325-C391 PolarHBondContact SG-SG 3.01Å
326	E	94.3	Very high	88.1	Confident	47 Å²	47	49.2 Å²	49.2	22%	0.22	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	131	172.2	-176.3	172.6	-170.5	0	0	109.6	I306 T307 Y308 R372 V373	I306-E326 CarbonylContact C-O 3.57Å; T307-E326 PolarHBondContact N-O 2.71Å; T307-E326 PolarHBondContact OG1-O 3.21Å; Y308-E326 PolarHBondContact N-O 3.29Å; Y308-E326 VanDerWaalsContact N-O 3.13Å; Y308-E326 PolarHBondContact O-N 3.16Å; E326-R372 WeakPolarHBondContact CA-O 3.29Å; E326-R372 HydrophobicContact CG-CG 4.27Å; E326-R372 IonicContact OE1-CZ 2.58Å; E326-R372 IonicContact OE1-NE 2.64Å; E326-R372 PolarHBondContact OE1-NE 2.87Å; E326-R372 IonicContact OE1-NH2 3.18Å; E326-R372 PolarHBondContact OE1-NH2 3.42Å; E326-V373 HydrophobicContact CB-CG2 4.09Å; E326-V373 HydrophobicContact CG-CG2 3.77Å
327	A	94.2	Very high	88.8	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	127.9	-177	0	0	0	0	0	112.9	N305 I306 P333 I335 R372 A393	N305-A327 CarbonylContact O-C 3.57Å; N305-A327 VanDerWaalsContact O-CA 3.23Å; N305-A327 WeakPolarHBondContact O-CA 3.26Å; I306-A327 HydrophobicContact CG1-CB 3.98Å; A327-P333 HydrophobicContact CB-CG 3.99Å; A327-P333 WeakPolarHBondContact O-CG 3.48Å; A327-I335 HydrophobicContact CB-CD1 4.07Å; A327-I335 HydrophobicContact CB-CG1 4.31Å; A327-R372 PolarHBondContact N-O 3.41Å; A327-R372 WeakPolarHBondContact O-CB 3.43Å; A327-A393 HydrophobicContact CB-CB 3.45Å; A327-A393 VanDerWaalsContact CB-CB 3.45Å
328	S	92.1	Very high	89.4	Confident	46 Å²	46	46.4 Å²	46.4	32%	0.322	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	150.2	170.7	57.7	0	0	0	0	111.1	P304 N305 T307	P304-S328 CarbonylContact C-O 3.45Å; P304-S328 WeakPolarHBondContact CA-O 3.27Å; N305-S328 PolarHBondContact N-O 3.12Å; N305-S328 PolarHBondContact O-N 2.75Å; N305-S328 PolarHBondContact O-OG 3.41Å; T307-S328 WeakPolarHBondContact CG2-OG 3.12Å
329	G	90	Very high	89.9	Confident	17 Å²	17	46 Å²	46	18%	0.175	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.3	161.5	172.8	0	0	0	0	0	110.5	P331 T332	G329-P331 CarbonylContact C-O 3.29Å; G329-T332 WeakPolarHBondContact O-CA 3.42Å
330	D	87.8	Confident	90.2	Very high	55 Å²	55	42.2 Å²	42.2	29%	0.294	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	112.5	176.3	-160.4	-3.8	0	0	0	110.1	K275 F301 V302	K275-D330 WeakPolarHBondContact CE-OD2 3.32Å; K275-D330 IonicContact NZ-OD2 3.88Å; K275-D330 PolarHBondContact NZ-OD2 2.78Å; F301-D330 CarbonylContact C-O 3.49Å; F301-D330 WeakPolarHBondContact CA-O 3.42Å; F301-D330 WeakPolarHBondContact CB-O 3.45Å; V302-D330 HydrophobicContact CB-CB 4.1Å; V302-D330 HydrophobicContact CG2-CB 4.01Å; V302-D330 PolarHBondContact N-O 3.37Å; V302-D330 PolarHBondContact O-N 2.82Å
331	P	89.1	Confident	90	Very high	47 Å²	47	46 Å²	46	31%	0.305	27%	0.272	S	S	.	.	S	Bend	cis	-58.3	149.8	3.6	-26.1	37.5	0	0	0	113.7	F301 G329 N395	F301-P331 HydrophobicContact CD1-CG 4.48Å; G329-P331 CarbonylContact C-O 3.29Å; P331-N395 VanDerWaalsContact O-CB 3.29Å; P331-N395 WeakPolarHBondContact O-CB 3.46Å; P331-N395 PolarHBondContact O-ND2 2.9Å
332	T	89.6	Confident	89.6	Confident	87 Å²	87	49.4 Å²	49.4	53%	0.534	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-53.6	123.1	-178.6	-57.9	0	0	0	0	110.4	G329 R372	G329-T332 WeakPolarHBondContact O-CA 3.42Å; T332-R372 HydrophobicContact CG2-CB 4.2Å
333	P	91.4	Very high	89.3	Confident	3 Å²	3	51.5 Å²	51.5	2%	0.019	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-73	144.3	-169.7	28.2	-34.8	0	0	0	112.2	P304 A327 A393 S394 N395	P304-P333 HydrophobicContact CB-CB 4.03Å; P304-P333 HydrophobicContact CB-CG 4.48Å; P304-P333 HydrophobicContact CG-CB 4.16Å; A327-P333 HydrophobicContact CB-CG 3.99Å; A327-P333 WeakPolarHBondContact O-CG 3.48Å; P333-A393 HydrophobicContact CB-CB 4.3Å; P333-S394 CarbonylContact C-O 3.56Å; P333-S394 WeakPolarHBondContact CA-O 3.3Å; P333-S394 WeakPolarHBondContact CB-O 3.48Å; P333-N395 HydrophobicContact CB-CB 4.47Å
334	T	91.1	Very high	88.9	Confident	99 Å²	99	52 Å²	52	61%	0.607	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	141.1	165.2	61.4	0	0	0	0	109	A393 S394	T334-A393 CarbonylContact O-C 3.48Å; T334-A393 WeakPolarHBondContact O-CA 3.38Å; T334-S394 PolarHBondContact N-O 3.45Å; T334-S394 PolarHBondContact O-N 3.43Å
335	I	91.3	Very high	87.9	Confident	20 Å²	20	53.6 Å²	53.6	10%	0.103	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	133.9	179.9	-66.3	165.8	0	0	0	109.3	C325 A327 R372 C391 T392 A393	C325-I335 HydrophobicContact CB-CG2 4.25Å; A327-I335 HydrophobicContact CB-CD1 4.07Å; A327-I335 HydrophobicContact CB-CG1 4.31Å; I335-R372 WeakPolarHBondContact CD1-O 3.43Å; I335-C391 WeakPolarHBondContact CG2-SG 3.39Å; I335-T392 CarbonylContact C-O 3.41Å; I335-T392 WeakPolarHBondContact CA-O 3.42Å; I335-A393 HydrophobicContact CG1-CB 4.09Å
336	S	90.6	Very high	86.6	Confident	50 Å²	50	59 Å²	59	35%	0.35	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	160.4	175.6	65.2	0	0	0	0	111.5	T392	S336-T392 PolarHBondContact N-O 3.19Å; S336-T392 PolarHBondContact O-N 3.36Å
337	W	90.6	Very high	84.7	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.008	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	140.5	-169	-67.1	87.5	0	0	0	111.5	F309 L323 C325 V343 F344 S374 L376 L390	F309-W337 HydrophobicContact CE2-CE3 4.44Å; F309-W337 AromaticContact CE2-CH2 3.62Å; F309-W337 HydrophobicContact CE2-CH2 3.62Å; F309-W337 AromaticContact CE2-CZ3 3.5Å; F309-W337 HydrophobicContact CE2-CZ3 3.5Å; F309-W337 HydrophobicContact CZ-CH2 4.44Å; F309-W337 AromaticContact CZ-CZ3 3.88Å; F309-W337 HydrophobicContact CZ-CZ3 3.88Å; L323-W337 HydrophobicContact CB-CH2 3.52Å; L323-W337 HydrophobicContact CB-CZ3 3.53Å; L323-W337 HydrophobicContact CD1-CZ3 4.04Å; L323-W337 HydrophobicContact CG-CZ3 4.45Å; L323-W337 WeakPolarHBondContact O-CH2 3.2Å; C325-W337 HydrophobicContact CB-CH2 4.02Å; C325-W337 HydrophobicContact CB-CZ2 3.8Å; W337-V343 WeakPolarHBondContact O-CA 3.49Å; W337-F344 HydrophobicContact CB-CB 4.18Å; W337-F344 HydrophobicContact CB-CD2 3.87Å; W337-F344 HydrophobicContact CB-CG 4.47Å; W337-F344 PolarHBondContact O-N 3.25Å; W337-S374 PolarHBondContact NE1-OG 2.88Å; W337-L376 HydrophobicContact CB-CD2 4.1Å; W337-L376 HydrophobicContact CD2-CB 3.65Å; W337-L376 HydrophobicContact CD2-CD2 3.89Å; W337-L376 HydrophobicContact CD2-CG 4.4Å; W337-L376 HydrophobicContact CE3-CB 3.82Å; W337-L376 HydrophobicContact CE3-CD2 3.59Å; W337-L376 HydrophobicContact CE3-CG 4.36Å; W337-L376 HydrophobicContact CG-CB 4.16Å; W337-L376 HydrophobicContact CG-CD2 4.14Å; W337-L376 HydrophobicContact CH2-CB 4.07Å; W337-L376 HydrophobicContact CZ2-CB 3.92Å; W337-L376 HydrophobicContact CZ3-CB 4.02Å; W337-L376 HydrophobicContact CZ3-CD2 4.22Å; W337-L390 WeakPolarHBondContact CA-O 3.42Å
338	R	88.6	Confident	82.5	Confident	112 Å²	112	66 Å²	66	42%	0.423	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	151.4	169	69.4	175.5	-156.2	-129.6	5.3	114.5	R342 V343 L390	R338-R342 CarbonylContact C-O 3.54Å; R338-R342 WeakPolarHBondContact CA-O 2.85Å; R338-R342 VanDerWaalsContact CB-O 3.26Å; R338-R342 WeakPolarHBondContact CB-O 3.39Å; R338-V343 HydrophobicContact CB-CG2 4.41Å; R338-L390 HydrophobicContact CG-CB 3.81Å; R338-L390 HydrophobicContact CG-CD2 3.96Å; R338-L390 HydrophobicContact CG-CG 4.5Å; R338-L390 PolarHBondContact N-O 3.34Å; R338-L390 VanDerWaalsContact NH1-CD2 3.31Å; R338-L390 PolarHBondContact O-N 3.18Å
339	F	87.3	Confident	80.2	Confident	55 Å²	55	72.7 Å²	72.7	24%	0.241	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	113	173.8	-179.9	-102	0	0	0	109.2	N341 R342 F344 Y389	F339-N341 PolarHBondContact O-N 3.13Å; F339-R342 PolarHBondContact N-O 2.85Å; F339-R342 WeakPolarHBondContact O-CB 3.46Å; F339-R342 PolarHBondContact O-N 2.86Å; F339-F344 HydrophobicContact CB-CE2 3.69Å; F339-F344 HydrophobicContact CB-CZ 3.88Å; F339-Y389 HydrophobicContact CB-CD1 3.91Å; F339-Y389 HydrophobicContact CB-CE1 3.76Å; F339-Y389 AromaticContact CD2-CD1 3.94Å; F339-Y389 HydrophobicContact CD2-CD1 3.94Å; F339-Y389 AromaticContact CD2-CD2 3.68Å; F339-Y389 HydrophobicContact CD2-CD2 3.68Å; F339-Y389 AromaticContact CD2-CE1 3.67Å; F339-Y389 HydrophobicContact CD2-CE1 3.67Å; F339-Y389 AromaticContact CD2-CE2 3.36Å; F339-Y389 HydrophobicContact CD2-CE2 3.36Å; F339-Y389 AromaticContact CD2-CG 3.93Å; F339-Y389 HydrophobicContact CD2-CG 3.93Å; F339-Y389 AromaticContact CD2-CZ 3.35Å; F339-Y389 HydrophobicContact CE2-CD2 4.04Å; F339-Y389 HydrophobicContact CE2-CE1 4.45Å; F339-Y389 AromaticContact CE2-CE2 3.46Å; F339-Y389 HydrophobicContact CE2-CE2 3.46Å; F339-Y389 VanDerWaalsContact CE2-CE2 3.46Å; F339-Y389 AromaticContact CE2-CZ 3.69Å; F339-Y389 HydrophobicContact CG-CD1 4.31Å; F339-Y389 AromaticContact CG-CE1 3.9Å; F339-Y389 HydrophobicContact CG-CE1 3.9Å; F339-Y389 HydrophobicContact CG-CE2 4.35Å; F339-Y389 AromaticContact CG-CZ 3.9Å
340	G	84.8	Confident	77.6	Confident	56 Å²	56	75.5 Å²	75.5	58%	0.577	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	-120.8	-167.8	0	0	0	0	0	111.4
341	N	81.1	Confident	74.8	Confident	172 Å²	172	78.3 Å²	78.3	92%	0.92	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-6.6	175.3	-68.2	-6.9	0	0	0	113.8	F339	F339-N341 PolarHBondContact O-N 3.13Å
342	R	80.5	Confident	72.2	Confident	83 Å²	83	86.4 Å²	86.4	31%	0.313	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	129.4	-179.1	-179.3	177.9	174.8	-169.3	-3.6	110.2	R338 F339 F344 D362	R338-R342 CarbonylContact C-O 3.54Å; R338-R342 WeakPolarHBondContact CA-O 2.85Å; R338-R342 VanDerWaalsContact CB-O 3.26Å; R338-R342 WeakPolarHBondContact CB-O 3.39Å; F339-R342 PolarHBondContact N-O 2.85Å; F339-R342 WeakPolarHBondContact O-CB 3.46Å; F339-R342 PolarHBondContact O-N 2.86Å; R342-F344 HydrophobicContact CG-CE1 4.45Å; R342-F344 HydrophobicContact CG-CZ 4.44Å; R342-D362 IonicContact CZ-OD1 2.72Å; R342-D362 IonicContact CZ-OD2 3.86Å; R342-D362 IonicContact NH1-OD1 3.02Å; R342-D362 PolarHBondContact NH1-OD1 2.83Å; R342-D362 IonicContact NH1-OD2 3.96Å; R342-D362 PolarHBondContact NH1-OD2 3.28Å; R342-D362 IonicContact NH2-OD1 3.29Å; R342-D362 PolarHBondContact NH2-OD1 3.48Å; R342-D362 IonicContact NH2-OD2 2.93Å; R342-D362 PolarHBondContact NH2-OD2 3.05Å
343	V	84.1	Confident	69.4	Low	86 Å²	86	88.7 Å²	88.7	52%	0.521	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	143.2	169.1	-178.9	0	0	0	0	108.2	W337 R338 T345	W337-V343 WeakPolarHBondContact O-CA 3.49Å; R338-V343 HydrophobicContact CB-CG2 4.41Å; V343-T345 HydrophobicContact CG1-CG2 4.48Å
344	F	82.8	Confident	66.5	Low	10 Å²	10	99.3 Å²	99.3	4%	0.044	54%	0.535	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	134.5	173.7	-51	-94.1	0	0	0	109.4	W337 F339 R342 V365 V367 L376 Y389	W337-F344 HydrophobicContact CB-CB 4.18Å; W337-F344 HydrophobicContact CB-CD2 3.87Å; W337-F344 HydrophobicContact CB-CG 4.47Å; W337-F344 PolarHBondContact O-N 3.25Å; F339-F344 HydrophobicContact CB-CE2 3.69Å; F339-F344 HydrophobicContact CB-CZ 3.88Å; R342-F344 HydrophobicContact CG-CE1 4.45Å; R342-F344 HydrophobicContact CG-CZ 4.44Å; F344-V365 HydrophobicContact CD1-CG1 3.67Å; F344-V365 HydrophobicContact CE1-CG1 3.97Å; F344-V365 HydrophobicContact CE1-CG2 4.46Å; F344-V367 HydrophobicContact CB-CG2 3.74Å; F344-L376 HydrophobicContact CB-CD1 4.21Å; F344-L376 HydrophobicContact CD1-CD1 3.96Å; F344-L376 HydrophobicContact CD2-CD1 4.4Å; F344-L376 HydrophobicContact CD2-CD2 3.85Å; F344-L376 HydrophobicContact CE1-CD1 4.36Å; F344-L376 HydrophobicContact CE2-CD2 3.88Å; F344-L376 HydrophobicContact CG-CD1 3.96Å; F344-L376 HydrophobicContact CG-CD2 4.25Å; F344-L376 HydrophobicContact CZ-CD2 4.28Å; F344-Y389 HydrophobicContact CE2-CD1 4.21Å; F344-Y389 HydrophobicContact CE2-CE1 4.06Å; F344-Y389 AromaticContact CZ-CE1 3.95Å; F344-Y389 HydrophobicContact CZ-CE1 3.95Å
345	T	71.4	Confident	64.3	Low	79 Å²	79	99.5 Å²	99.5	49%	0.485	54%	0.537	S	S	.	.			trans	-120	154.5	-178	61.9	0	0	0	0	111.8	V343 G347	V343-T345 HydrophobicContact CG1-CG2 4.48Å; T345-G347 PolarHBondContact O-N 2.96Å
346	E	65.2	Low	61.7	Low	113 Å²	113	105.7 Å²	105.7	53%	0.528	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.5	121.9	-179.5	-173.4	151.4	-151.3	0	0	110.9	V367 R368 S369	E346-V367 HydrophobicContact CB-CG1 4.27Å; E346-R368 WeakPolarHBondContact OE1-CA 3.39Å; E346-S369 PolarHBondContact OE1-N 3.05Å; E346-S369 WeakPolarHBondContact OE2-CB 3.02Å; E346-S369 PolarHBondContact OE2-OG 3.14Å
347	G	55.2	Low	59.1	Low	72 Å²	72	113.3 Å²	113.3	74%	0.742	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	95.8	13.3	177.9	0	0	0	0	0	116.7	T345 Q349	T345-G347 PolarHBondContact O-N 2.96Å; G347-Q349 VanDerWaalsContact C-N 3.25Å; G347-Q349 PolarHBondContact O-N 3.07Å
348	E	47	Very low	56.4	Low	123 Å²	123	123.8 Å²	123.8	58%	0.575	64%	0.639	S	S	*	*			trans	-71.6	67.8	-179.2	-164.5	168.8	-141.3	0	0	114.1	A350	E348-A350 VanDerWaalsContact C-N 3.34Å; E348-A350 PolarHBondContact O-N 3.3Å; E348-A350 VanDerWaalsContact O-N 3.1Å
349	Q	44.1	Very low	53.8	Low	186 Å²	186	127.3 Å²	127.3	87%	0.869	66%	0.66	S	S	*	*			trans	-71.9	92.9	154.5	-79.4	-165.7	-21.1	0	0	108.6	G347 S351	G347-Q349 VanDerWaalsContact C-N 3.25Å; G347-Q349 PolarHBondContact O-N 3.07Å; Q349-S351 PolarHBondContact O-N 3.17Å
350	A	36.3	Very low	51.4	Low	75 Å²	75	129.8 Å²	129.8	62%	0.62	68%	0.684	S	S	*	*			trans	-53.1	104.4	-177.6	0	0	0	0	0	112.3	E348	E348-A350 VanDerWaalsContact C-N 3.34Å; E348-A350 PolarHBondContact O-N 3.3Å; E348-A350 VanDerWaalsContact O-N 3.1Å
351	S	28.1	Very low	49.5	Very low	115 Å²	115	134.3 Å²	134.3	80%	0.804	69%	0.694	S	S	*	*			trans	-82.4	129.8	-178.6	63.8	0	0	0	0	111.3	Q349 T353	Q349-S351 PolarHBondContact O-N 3.17Å; S351-T353 PolarHBondContact O-N 2.89Å
352	W	35.3	Very low	47.9	Very low	217 Å²	217	129.1 Å²	129.1	82%	0.822	67%	0.666	S	S	*	*			trans	-69.8	126.6	-170.2	-89.2	71.5	0	0	0	114
353	T	30.8	Very low	46.6	Very low	134 Å²	134	135.9 Å²	135.9	82%	0.822	69%	0.692	S	S	*	*			trans	-147.4	109	145	18	0	0	0	0	114	S351	S351-T353 PolarHBondContact O-N 2.89Å
354	R	29.9	Very low	45.8	Very low	227 Å²	227	134 Å²	134	86%	0.857	68%	0.679	S	S	*	*			trans	69.7	141.6	162.9	-71	-174.7	170.4	159.4	-0.3	119.7
355	P	44.9	Very low	45.3	Very low	102 Å²	102	135.4 Å²	135.4	66%	0.662	69%	0.688	S	S	*	*			trans	-88.5	147.1	172.2	37.5	-34.3	0	0	0	112
356	D	36.3	Very low	45.8	Very low	150 Å²	150	133.9 Å²	133.9	80%	0.802	68%	0.679	S	S	*	*	S	Bend		165.5	129.7	122.9	-83.4	-13.7	0	0	0	109.4
357	K	36.9	Very low	46.8	Very low	211 Å²	211	129.3 Å²	129.3	92%	0.917	66%	0.658	S	S	*	*	S	Bend	trans	62.5	44.6	175.7	-73.7	-170.1	169.2	-174.2	0	118.6
358	Y	33.7	Very low	48.1	Very low	221 Å²	221	131.9 Å²	131.9	87%	0.867	65%	0.646	S	S	*	*			trans	-153.4	135	133.3	-141.4	-102	0	0	0	109.2	S360	Y358-S360 PolarHBondContact O-N 3.29Å
359	E	34.1	Very low	49.9	Very low	186 Å²	186	128 Å²	128	87%	0.869	63%	0.633	S	S	*	*			trans	-85.1	95	174.5	-70.6	-173.6	142.8	0	0	108.8	L361	E359-L361 PolarHBondContact O-N 3.16Å
360	S	36.3	Very low	51.5	Low	107 Å²	107	126.7 Å²	126.7	75%	0.748	63%	0.626	S	S	*	*			trans	-72.9	109	172.6	57.1	0	0	0	0	109.6	Y358 D362	Y358-S360 PolarHBondContact O-N 3.29Å; S360-D362 PolarHBondContact O-N 2.89Å
361	L	45.7	Very low	53.6	Low	151 Å²	151	126.8 Å²	126.8	79%	0.791	63%	0.627	S	S	*	*			trans	-69.3	-14.5	-174.2	-90.2	160.4	0	0	0	114.9	E359 R363	E359-L361 PolarHBondContact O-N 3.16Å; L361-R363 PolarHBondContact O-N 2.86Å
362	D	48.5	Very low	56.5	Low	63 Å²	63	128 Å²	128	34%	0.337	61%	0.614	S	S	.	*			trans	-91.8	110.1	-160.3	-68.2	-83.1	0	0	0	115.6	R342 S360 V365	R342-D362 IonicContact CZ-OD1 2.72Å; R342-D362 IonicContact CZ-OD2 3.86Å; R342-D362 IonicContact NH1-OD1 3.02Å; R342-D362 PolarHBondContact NH1-OD1 2.83Å; R342-D362 IonicContact NH1-OD2 3.96Å; R342-D362 PolarHBondContact NH1-OD2 3.28Å; R342-D362 IonicContact NH2-OD1 3.29Å; R342-D362 PolarHBondContact NH2-OD1 3.48Å; R342-D362 IonicContact NH2-OD2 2.93Å; R342-D362 PolarHBondContact NH2-OD2 3.05Å; S360-D362 PolarHBondContact O-N 2.89Å; D362-V365 WeakPolarHBondContact OD1-CG2 3.03Å
363	R	52.4	Low	59.1	Low	226 Å²	226	119.9 Å²	119.9	85%	0.853	59%	0.588	S	S	*	*	S	Bend	trans	-115.1	-2	155	-66.6	-172.8	176.7	-170.6	0.6	113.3	L361	L361-R363 PolarHBondContact O-N 2.86Å
364	N	66.1	Low	62	Low	46 Å²	46	113.5 Å²	113.5	25%	0.246	55%	0.549	C	S	.	.			trans	-135.3	12.4	-143.9	-89.1	9.6	0	0	0	115.1	K379 D380	N364-K379 HydrophobicContact CB-CB 3.8Å; N364-K379 WeakPolarHBondContact CB-O 3.41Å; N364-K379 PolarHBondContact ND2-O 2.85Å; N364-K379 VanDerWaalsContact ND2-O 3.14Å; N364-K379 WeakPolarHBondContact O-CB 3.39Å; N364-K379 WeakPolarHBondContact O-CG 3.26Å; N364-K379 PolarHBondContact O-N 2.85Å; N364-D380 WeakPolarHBondContact ND2-CB 3.25Å; N364-D380 PolarHBondContact ND2-OD2 3.22Å
365	V	73.9	Confident	64.8	Low	39 Å²	39	103.9 Å²	103.9	24%	0.236	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.2	179.6	-178.4	0	0	0	0	110.7	F344 D362 L376 T377 L378	F344-V365 HydrophobicContact CD1-CG1 3.67Å; F344-V365 HydrophobicContact CE1-CG1 3.97Å; F344-V365 HydrophobicContact CE1-CG2 4.46Å; D362-V365 WeakPolarHBondContact OD1-CG2 3.03Å; V365-L376 HydrophobicContact CG1-CD1 3.39Å; V365-T377 WeakPolarHBondContact CA-O 3.28Å; V365-L378 HydrophobicContact CG1-CD2 4Å; V365-L378 HydrophobicContact CG2-CD2 3.8Å
366	V	81.4	Confident	67	Low	48 Å²	48	99 Å²	99	29%	0.291	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	112.2	-179.7	-172.5	0	0	0	0	109.9	R368 T377	V366-R368 HydrophobicContact CG1-CG 3.99Å; V366-T377 PolarHBondContact N-O 2.74Å; V366-T377 PolarHBondContact O-N 2.92Å
367	V	85	Confident	69.5	Low	16 Å²	16	91.9 Å²	91.9	10%	0.097	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	136.7	164.3	179.2	0	0	0	0	108.9	F344 E346 S375 L376	F344-V367 HydrophobicContact CB-CG2 3.74Å; E346-V367 HydrophobicContact CB-CG1 4.27Å; V367-S375 CarbonylContact C-O 3.54Å; V367-S375 WeakPolarHBondContact CA-O 3.41Å; V367-L376 HydrophobicContact CG2-CD1 3.86Å
368	R	84.2	Confident	71.9	Confident	127 Å²	127	82.1 Å²	82.1	48%	0.479	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	123.4	167.1	-53.8	-176.5	-175.2	93.1	-7	109.8	E346 V366 S374 S375	E346-R368 WeakPolarHBondContact OE1-CA 3.39Å; V366-R368 HydrophobicContact CG1-CG 3.99Å; R368-S374 CarbonylContact O-C 3.59Å; R368-S374 WeakPolarHBondContact O-CA 3.41Å; R368-S375 PolarHBondContact N-O 2.86Å; R368-S375 PolarHBondContact O-N 3.24Å; R368-S375 PolarHBondContact O-OG 2.91Å
369	S	83.6	Confident	74.2	Confident	42 Å²	42	75 Å²	75	29%	0.294	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	138.2	176.9	-40.8	0	0	0	0	110.7	E346 V373 S374	E346-S369 PolarHBondContact OE1-N 3.05Å; E346-S369 WeakPolarHBondContact OE2-CB 3.02Å; E346-S369 PolarHBondContact OE2-OG 3.14Å; S369-V373 WeakPolarHBondContact CA-O 3.49Å; S369-S374 PolarHBondContact OG-OG 3.01Å; S369-S374 VanDerWaalsContact OG-OG 3.05Å
370	H	78.3	Confident	76.5	Confident	157 Å²	157	70.6 Å²	70.6	73%	0.727	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.1	111.2	175.7	-170.4	71.9	0	0	0	110.7	R372 V373	H370-R372 PolarHBondContact O-N 2.93Å; H370-V373 PolarHBondContact N-O 2.8Å; H370-V373 PolarHBondContact O-N 2.99Å; H370-V373 VanDerWaalsContact O-N 3.1Å
371	A	80.9	Confident	78.7	Confident	77 Å²	77	65.6 Å²	65.6	64%	0.636	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	-110.1	-171.8	0	0	0	0	0	111.3
372	R	88.3	Confident	80.4	Confident	141 Å²	141	62.6 Å²	62.6	53%	0.532	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	4.4	-174.2	72.3	176.9	-162.7	-121.3	-5.5	115.4	E326 A327 T332 I335 H370	E326-R372 WeakPolarHBondContact CA-O 3.29Å; E326-R372 HydrophobicContact CG-CG 4.27Å; E326-R372 IonicContact OE1-CZ 2.58Å; E326-R372 IonicContact OE1-NE 2.64Å; E326-R372 PolarHBondContact OE1-NE 2.87Å; E326-R372 IonicContact OE1-NH2 3.18Å; E326-R372 PolarHBondContact OE1-NH2 3.42Å; A327-R372 PolarHBondContact N-O 3.41Å; A327-R372 WeakPolarHBondContact O-CB 3.43Å; T332-R372 HydrophobicContact CG2-CB 4.2Å; I335-R372 WeakPolarHBondContact CD1-O 3.43Å; H370-R372 PolarHBondContact O-N 2.93Å
373	V	89.9	Confident	81.8	Confident	47 Å²	47	63.8 Å²	63.8	29%	0.285	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	136.4	179.1	-176.3	0	0	0	0	109.3	T324 C325 E326 S369 H370	T324-V373 HydrophobicContact CG2-CG1 3.9Å; C325-V373 WeakPolarHBondContact O-CA 3.37Å; E326-V373 HydrophobicContact CB-CG2 4.09Å; E326-V373 HydrophobicContact CG-CG2 3.77Å; S369-V373 WeakPolarHBondContact CA-O 3.49Å; H370-V373 PolarHBondContact N-O 2.8Å; H370-V373 PolarHBondContact O-N 2.99Å; H370-V373 VanDerWaalsContact O-N 3.1Å
374	S	91.3	Very high	83.2	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	152.2	164.4	-170.9	0	0	0	0	110.7	C325 W337 R368 S369	C325-S374 PolarHBondContact N-O 2.79Å; C325-S374 PolarHBondContact O-N 2.88Å; W337-S374 PolarHBondContact NE1-OG 2.88Å; R368-S374 CarbonylContact O-C 3.59Å; R368-S374 WeakPolarHBondContact O-CA 3.41Å; S369-S374 PolarHBondContact OG-OG 3.01Å; S369-S374 VanDerWaalsContact OG-OG 3.05Å
375	S	90.1	Very high	84.1	Confident	24 Å²	24	56.3 Å²	56.3	17%	0.168	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	133.8	-178.4	52.8	0	0	0	0	110.2	L323 V367 R368	L323-S375 CarbonylContact O-C 3.57Å; L323-S375 VanDerWaalsContact O-CA 3.29Å; L323-S375 WeakPolarHBondContact O-CA 3.45Å; V367-S375 CarbonylContact C-O 3.54Å; V367-S375 WeakPolarHBondContact CA-O 3.41Å; R368-S375 PolarHBondContact N-O 2.86Å; R368-S375 PolarHBondContact O-N 3.24Å; R368-S375 PolarHBondContact O-OG 2.91Å
376	L	89.6	Confident	84.6	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	103.1	176.4	170.5	62.8	0	0	0	107.8	L323 W337 F344 V365 V367 L378 Y389	L323-L376 HydrophobicContact CB-CB 4.42Å; L323-L376 HydrophobicContact CD1-CD2 4.3Å; L323-L376 PolarHBondContact N-O 2.98Å; L323-L376 PolarHBondContact O-N 3Å; W337-L376 HydrophobicContact CB-CD2 4.1Å; W337-L376 HydrophobicContact CD2-CB 3.65Å; W337-L376 HydrophobicContact CD2-CD2 3.89Å; W337-L376 HydrophobicContact CD2-CG 4.4Å; W337-L376 HydrophobicContact CE3-CB 3.82Å; W337-L376 HydrophobicContact CE3-CD2 3.59Å; W337-L376 HydrophobicContact CE3-CG 4.36Å; W337-L376 HydrophobicContact CG-CB 4.16Å; W337-L376 HydrophobicContact CG-CD2 4.14Å; W337-L376 HydrophobicContact CH2-CB 4.07Å; W337-L376 HydrophobicContact CZ2-CB 3.92Å; W337-L376 HydrophobicContact CZ3-CB 4.02Å; W337-L376 HydrophobicContact CZ3-CD2 4.22Å; F344-L376 HydrophobicContact CB-CD1 4.21Å; F344-L376 HydrophobicContact CD1-CD1 3.96Å; F344-L376 HydrophobicContact CD2-CD1 4.4Å; F344-L376 HydrophobicContact CD2-CD2 3.85Å; F344-L376 HydrophobicContact CE1-CD1 4.36Å; F344-L376 HydrophobicContact CE2-CD2 3.88Å; F344-L376 HydrophobicContact CG-CD1 3.96Å; F344-L376 HydrophobicContact CG-CD2 4.25Å; F344-L376 HydrophobicContact CZ-CD2 4.28Å; V365-L376 HydrophobicContact CG1-CD1 3.39Å; V367-L376 HydrophobicContact CG2-CD1 3.86Å; L376-L378 HydrophobicContact CD1-CD2 4.17Å; L376-L378 HydrophobicContact CG-CD2 4.2Å; L376-Y389 HydrophobicContact CD2-CD1 3.81Å; L376-Y389 HydrophobicContact CD2-CE1 4.03Å
377	T	88.4	Confident	85	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	127	173.7	-54.1	0	0	0	0	110	E320 V321 T322 V365 V366 K379	E320-T377 HydrophobicContact CB-CG2 3.81Å; E320-T377 HydrophobicContact CG-CG2 4.11Å; V321-T377 CarbonylContact O-C 3.55Å; V321-T377 WeakPolarHBondContact O-CA 3.39Å; T322-T377 WeakPolarHBondContact OG1-CG2 3.22Å; T322-T377 PolarHBondContact OG1-OG1 3.37Å; V365-T377 WeakPolarHBondContact CA-O 3.28Å; V366-T377 PolarHBondContact N-O 2.74Å; V366-T377 PolarHBondContact O-N 2.92Å; T377-K379 HydrophobicContact CG2-CG 4.41Å
378	L	87.6	Confident	85.3	Confident	6 Å²	6	60.6 Å²	60.6	3%	0.031	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	139.1	169.1	-46.9	173.5	0	0	0	108.3	E320 V321 V365 L376 D385 Y389 L406	E320-L378 CarbonylContact C-O 3.56Å; E320-L378 WeakPolarHBondContact CA-O 3.39Å; E320-L378 WeakPolarHBondContact CB-O 3.37Å; V321-L378 HydrophobicContact CG1-CB 4.07Å; V321-L378 HydrophobicContact CG1-CD1 4.19Å; V321-L378 HydrophobicContact CG1-CG 4.4Å; V321-L378 PolarHBondContact N-O 2.76Å; V321-L378 PolarHBondContact O-N 2.98Å; V365-L378 HydrophobicContact CG1-CD2 4Å; V365-L378 HydrophobicContact CG2-CD2 3.8Å; L376-L378 HydrophobicContact CD1-CD2 4.17Å; L376-L378 HydrophobicContact CG-CD2 4.2Å; L378-D385 HydrophobicContact CD1-CB 4.35Å; L378-Y389 HydrophobicContact CD1-CE1 4.24Å; L378-Y389 VanDerWaalsContact CD1-OH 3.31Å; L378-Y389 WeakPolarHBondContact CD1-OH 3.47Å; L378-L406 HydrophobicContact CD1-CD2 3.73Å
379	K	82.8	Confident	85.7	Confident	72 Å²	72	54.7 Å²	54.7	31%	0.313	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	152.9	-179.3	-57.1	169.6	161.8	-73.2	0	112.5	D319 E320 N364 T377	D319-K379 CarbonylContact O-C 3.54Å; D319-K379 VanDerWaalsContact O-CA 3.25Å; D319-K379 WeakPolarHBondContact O-CA 3.33Å; E320-K379 HydrophobicContact CB-CB 4.42Å; E320-K379 HydrophobicContact CB-CG 3.9Å; E320-K379 WeakPolarHBondContact OE2-CE 3.44Å; E320-K379 IonicContact OE2-NZ 2.86Å; E320-K379 PolarHBondContact OE2-NZ 2.85Å; N364-K379 HydrophobicContact CB-CB 3.8Å; N364-K379 WeakPolarHBondContact CB-O 3.41Å; N364-K379 PolarHBondContact ND2-O 2.85Å; N364-K379 VanDerWaalsContact ND2-O 3.14Å; N364-K379 WeakPolarHBondContact O-CB 3.39Å; N364-K379 WeakPolarHBondContact O-CG 3.26Å; N364-K379 PolarHBondContact O-N 2.85Å; T377-K379 HydrophobicContact CG2-CG 4.41Å
380	D	81.7	Confident	86.2	Confident	93 Å²	93	53.1 Å²	53.1	50%	0.497	27%	0.271	S	S	.	.	S	Bend	trans	51.9	56.8	-172.9	-53.1	-26.6	0	0	0	111.1	D319 N364 Q382	D319-D380 PolarHBondContact O-N 3.35Å; N364-D380 WeakPolarHBondContact ND2-CB 3.25Å; N364-D380 PolarHBondContact ND2-OD2 3.22Å; D380-Q382 PolarHBondContact O-N 2.65Å; D380-Q382 PolarHBondContact O-NE2 2.7Å
381	V	83	Confident	86.9	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.006	24%	0.236	C	C	.	.			trans	-58.1	127.5	-163.4	-178.1	0	0	0	0	112.8	A314 E316 D318 V321 V408	A314-V381 HydrophobicContact CB-CG1 4.08Å; E316-V381 WeakPolarHBondContact CA-O 3.35Å; D318-V381 WeakPolarHBondContact O-CG2 3.35Å; D318-V381 PolarHBondContact O-N 3.24Å; V321-V381 HydrophobicContact CB-CG2 4.15Å; V321-V381 HydrophobicContact CG1-CG1 4.47Å; V321-V381 HydrophobicContact CG1-CG2 3.67Å; V381-V408 HydrophobicContact CG1-CG1 3.91Å; V381-V408 HydrophobicContact CG1-CG2 3.81Å
382	Q	81.4	Confident	87.5	Confident	89 Å²	89	42.5 Å²	42.5	42%	0.416	21%	0.21	S	C	.	.			trans	-106.3	155.9	-178.6	-61.9	-54.8	-59.8	0	0	112.5	D380 T384 D385	D380-Q382 PolarHBondContact O-N 2.65Å; D380-Q382 PolarHBondContact O-NE2 2.7Å; Q382-T384 WeakPolarHBondContact CB-OG1 3.49Å; Q382-T384 PolarHBondContact O-N 3.4Å; Q382-T384 VanDerWaalsContact O-N 3.08Å; Q382-D385 PolarHBondContact N-OD2 3.24Å; Q382-D385 WeakPolarHBondContact O-CB 3.32Å; Q382-D385 PolarHBondContact O-N 3.29Å
383	F	78.3	Confident	87.8	Confident	87 Å²	87	35.8 Å²	35.8	38%	0.382	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-59.6	-21.9	174.8	75.4	-87.6	0	0	0	113.5	D385 A386 Y410	F383-D385 VanDerWaalsContact C-N 3.29Å; F383-A386 WeakPolarHBondContact O-CB 3.47Å; F383-A386 PolarHBondContact O-N 2.92Å; F383-Y410 HydrophobicContact CB-CD1 3.49Å; F383-Y410 VanDerWaalsContact CB-CD1 3.49Å; F383-Y410 HydrophobicContact CB-CD2 3.79Å; F383-Y410 HydrophobicContact CB-CE1 3.87Å; F383-Y410 HydrophobicContact CB-CE2 4.14Å; F383-Y410 HydrophobicContact CB-CG 3.46Å; F383-Y410 VanDerWaalsContact CB-CG 3.46Å; F383-Y410 HydrophobicContact CD2-CE2 4.44Å; F383-Y410 HydrophobicContact CG-CD2 4.33Å; F383-Y410 HydrophobicContact CG-CE2 4.48Å; F383-Y410 HydrophobicContact CG-CG 4.45Å
384	T	81.5	Confident	87.9	Confident	76 Å²	76	35 Å²	35	47%	0.466	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-72.5	-18	174.8	48	0	0	0	0	114	Q382 A386	Q382-T384 WeakPolarHBondContact CB-OG1 3.49Å; Q382-T384 PolarHBondContact O-N 3.4Å; Q382-T384 VanDerWaalsContact O-N 3.08Å; T384-A386 PolarHBondContact O-N 2.78Å
385	D	84.1	Confident	87.9	Confident	39 Å²	39	36.5 Å²	36.5	21%	0.209	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-81.8	-8.1	178.8	-52.4	-30.8	0	0	0	111.5	L378 Q382 F383 G387 Y389 V408	L378-D385 HydrophobicContact CD1-CB 4.35Å; Q382-D385 PolarHBondContact N-OD2 3.24Å; Q382-D385 WeakPolarHBondContact O-CB 3.32Å; Q382-D385 PolarHBondContact O-N 3.29Å; F383-D385 VanDerWaalsContact C-N 3.29Å; D385-G387 PolarHBondContact O-N 3.3Å; D385-Y389 WeakPolarHBondContact O-CE2 3.46Å; D385-Y389 PolarHBondContact O-OH 2.59Å; D385-V408 HydrophobicContact CB-CG2 4.33Å
386	A	85.9	Confident	87.8	Confident	34 Å²	34	39.8 Å²	39.8	28%	0.281	21%	0.212	S	C	.	.			trans	-65.9	125	173.7	0	0	0	0	0	111.3	F383 T384 L406 V408	F383-A386 WeakPolarHBondContact O-CB 3.47Å; F383-A386 PolarHBondContact O-N 2.92Å; T384-A386 PolarHBondContact O-N 2.78Å; A386-L406 WeakPolarHBondContact CA-O 3.44Å; A386-V408 HydrophobicContact CB-CB 4.01Å; A386-V408 HydrophobicContact CB-CG2 4.03Å
387	G	88.9	Confident	87.7	Confident	12 Å²	12	42.4 Å²	42.4	12%	0.124	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.2	-162.5	178.6	0	0	0	0	0	114.6	D385 F405 L406	D385-G387 PolarHBondContact O-N 3.3Å; G387-F405 WeakPolarHBondContact O-CA 3.5Å; G387-L406 PolarHBondContact N-O 3.05Å; G387-L406 PolarHBondContact O-N 2.88Å
388	R	91.9	Very high	87.7	Confident	147 Å²	147	43.5 Å²	43.5	56%	0.555	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-95.7	114.6	-177.1	-67.2	-175.5	-177.3	-79.5	-5.4	111.6	L404 F405	R388-L404 VanDerWaalsContact CA-O 3.31Å; R388-L404 WeakPolarHBondContact CA-O 3.16Å; R388-F405 HydrophobicContact CG-CD2 3.92Å
389	Y	91.5	Very high	88	Confident	3 Å²	3	48.5 Å²	48.5	1%	0.012	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	133.4	169.2	-68.7	-102	0	0	0	108.5	L323 F339 F344 L376 L378 D385 Q403 L404 L406	L323-Y389 HydrophobicContact CD1-CD1 3.62Å; L323-Y389 HydrophobicContact CD1-CD2 3.77Å; L323-Y389 HydrophobicContact CD1-CE1 4.12Å; L323-Y389 HydrophobicContact CD1-CE2 4.27Å; L323-Y389 HydrophobicContact CD1-CG 3.43Å; L323-Y389 VanDerWaalsContact CD1-CG 3.43Å; F339-Y389 HydrophobicContact CB-CD1 3.91Å; F339-Y389 HydrophobicContact CB-CE1 3.76Å; F339-Y389 AromaticContact CD2-CD1 3.94Å; F339-Y389 HydrophobicContact CD2-CD1 3.94Å; F339-Y389 AromaticContact CD2-CD2 3.68Å; F339-Y389 HydrophobicContact CD2-CD2 3.68Å; F339-Y389 AromaticContact CD2-CE1 3.67Å; F339-Y389 HydrophobicContact CD2-CE1 3.67Å; F339-Y389 AromaticContact CD2-CE2 3.36Å; F339-Y389 HydrophobicContact CD2-CE2 3.36Å; F339-Y389 AromaticContact CD2-CG 3.93Å; F339-Y389 HydrophobicContact CD2-CG 3.93Å; F339-Y389 AromaticContact CD2-CZ 3.35Å; F339-Y389 HydrophobicContact CE2-CD2 4.04Å; F339-Y389 HydrophobicContact CE2-CE1 4.45Å; F339-Y389 AromaticContact CE2-CE2 3.46Å; F339-Y389 HydrophobicContact CE2-CE2 3.46Å; F339-Y389 VanDerWaalsContact CE2-CE2 3.46Å; F339-Y389 AromaticContact CE2-CZ 3.69Å; F339-Y389 HydrophobicContact CG-CD1 4.31Å; F339-Y389 AromaticContact CG-CE1 3.9Å; F339-Y389 HydrophobicContact CG-CE1 3.9Å; F339-Y389 HydrophobicContact CG-CE2 4.35Å; F339-Y389 AromaticContact CG-CZ 3.9Å; F344-Y389 HydrophobicContact CE2-CD1 4.21Å; F344-Y389 HydrophobicContact CE2-CE1 4.06Å; F344-Y389 AromaticContact CZ-CE1 3.95Å; F344-Y389 HydrophobicContact CZ-CE1 3.95Å; L376-Y389 HydrophobicContact CD2-CD1 3.81Å; L376-Y389 HydrophobicContact CD2-CE1 4.03Å; L378-Y389 HydrophobicContact CD1-CE1 4.24Å; L378-Y389 VanDerWaalsContact CD1-OH 3.31Å; L378-Y389 WeakPolarHBondContact CD1-OH 3.47Å; D385-Y389 WeakPolarHBondContact O-CE2 3.46Å; D385-Y389 PolarHBondContact O-OH 2.59Å; Y389-Q403 WeakPolarHBondContact O-CA 3.35Å; Y389-L404 HydrophobicContact CD2-CD1 4.27Å; Y389-L404 PolarHBondContact N-O 2.79Å; Y389-L404 VanDerWaalsContact N-O 3.15Å; Y389-L404 PolarHBondContact O-N 2.61Å; Y389-L406 HydrophobicContact CD2-CB 3.96Å; Y389-L406 HydrophobicContact CE2-CB 3.8Å; Y389-L406 HydrophobicContact CE2-CD2 3.81Å; Y389-L406 HydrophobicContact CE2-CG 4.44Å
390	L	94	Very high	88.6	Confident	9 Å²	9	47 Å²	47	5%	0.047	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	131.2	170.2	-177.9	86.5	0	0	0	109	W337 R338 T392 N401 Q402 Q403	W337-L390 WeakPolarHBondContact CA-O 3.42Å; R338-L390 HydrophobicContact CG-CB 3.81Å; R338-L390 HydrophobicContact CG-CD2 3.96Å; R338-L390 HydrophobicContact CG-CG 4.5Å; R338-L390 PolarHBondContact N-O 3.34Å; R338-L390 VanDerWaalsContact NH1-CD2 3.31Å; R338-L390 PolarHBondContact O-N 3.18Å; L390-T392 VanDerWaalsContact CD2-OG1 3.29Å; L390-T392 WeakPolarHBondContact CD2-OG1 3.35Å; L390-N401 HydrophobicContact CD1-CB 4.15Å; L390-N401 WeakPolarHBondContact CD2-OD1 3.27Å; L390-Q402 WeakPolarHBondContact CA-O 3.45Å; L390-Q402 VanDerWaalsContact CD1-O 3.31Å; L390-Q402 WeakPolarHBondContact CD1-O 3.18Å; L390-Q403 HydrophobicContact CB-CG 4.18Å; L390-Q403 HydrophobicContact CD1-CG 3.43Å; L390-Q403 VanDerWaalsContact CD1-CG 3.43Å; L390-Q403 HydrophobicContact CG-CG 4.42Å
391	C	93.6	Very high	89.2	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	132.2	156.9	173.8	0	0	0	0	108.9	I306 F309 C325 I335 Q402	I306-C391 HydrophobicContact CD1-CB 4.26Å; I306-C391 WeakPolarHBondContact CD1-O 3.26Å; F309-C391 HydrophobicContact CD1-CB 4.28Å; F309-C391 HydrophobicContact CD2-CB 3.82Å; F309-C391 HydrophobicContact CE1-CB 3.86Å; F309-C391 HydrophobicContact CE2-CB 3.39Å; F309-C391 HydrophobicContact CG-CB 4.25Å; F309-C391 HydrophobicContact CZ-CB 3.4Å; F309-C391 VanDerWaalsContact CZ-CB 3.4Å; C325-C391 HydrophobicContact CB-CB 3.75Å; C325-C391 WeakPolarHBondContact CB-SG 3.41Å; C325-C391 WeakPolarHBondContact SG-CB 3.38Å; C325-C391 CovalentContact SG-SG 2.03Å; C325-C391 PolarHBondContact SG-SG 3.01Å; I335-C391 WeakPolarHBondContact CG2-SG 3.39Å; C391-Q402 PolarHBondContact N-O 3.47Å; C391-Q402 PolarHBondContact O-N 2.83Å
392	T	93.9	Very high	89.8	Confident	12 Å²	12	48.8 Å²	48.8	7%	0.074	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	124.6	174.3	-62.9	0	0	0	0	108	I335 S336 L390 E399 D400 N401	I335-T392 CarbonylContact C-O 3.41Å; I335-T392 WeakPolarHBondContact CA-O 3.42Å; S336-T392 PolarHBondContact N-O 3.19Å; S336-T392 PolarHBondContact O-N 3.36Å; L390-T392 VanDerWaalsContact CD2-OG1 3.29Å; L390-T392 WeakPolarHBondContact CD2-OG1 3.35Å; T392-E399 VanDerWaalsContact CG2-CD 3.42Å; T392-E399 HydrophobicContact CG2-CG 3.56Å; T392-E399 WeakPolarHBondContact CG2-OE1 3.45Å; T392-D400 WeakPolarHBondContact CA-O 3.37Å; T392-N401 WeakPolarHBondContact CB-OD1 3.42Å; T392-N401 WeakPolarHBondContact CG2-OD1 3.4Å; T392-N401 PolarHBondContact OG1-OD1 2.79Å
393	A	94.2	Very high	90.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	119.9	176.2	0	0	0	0	0	109.8	P304 I306 A327 P333 T334 I335 E399 D400	P304-A393 HydrophobicContact CB-CB 4.24Å; P304-A393 WeakPolarHBondContact CB-O 3.47Å; I306-A393 HydrophobicContact CD1-CB 4.09Å; I306-A393 HydrophobicContact CG1-CB 3.69Å; A327-A393 HydrophobicContact CB-CB 3.45Å; A327-A393 VanDerWaalsContact CB-CB 3.45Å; P333-A393 HydrophobicContact CB-CB 4.3Å; T334-A393 CarbonylContact O-C 3.48Å; T334-A393 WeakPolarHBondContact O-CA 3.38Å; I335-A393 HydrophobicContact CG1-CB 4.09Å; A393-E399 CarbonylContact O-C 3.6Å; A393-E399 VanDerWaalsContact O-CA 3.31Å; A393-E399 WeakPolarHBondContact O-CA 3.42Å; A393-D400 PolarHBondContact N-O 2.86Å; A393-D400 PolarHBondContact O-N 2.85Å
394	S	92.9	Very high	90.9	Very high	31 Å²	31	45.5 Å²	45.5	22%	0.217	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	149.1	-174.8	57.2	0	0	0	0	113.6	P333 T334 G398	P333-S394 CarbonylContact C-O 3.56Å; P333-S394 WeakPolarHBondContact CA-O 3.3Å; P333-S394 WeakPolarHBondContact CB-O 3.48Å; T334-S394 PolarHBondContact N-O 3.45Å; T334-S394 PolarHBondContact O-N 3.43Å; S394-G398 WeakPolarHBondContact CA-O 3.17Å
395	N	90.6	Very high	91.3	Very high	30 Å²	30	46 Å²	46	16%	0.16	24%	0.244	C	C	.	.			trans	-137.8	-165.7	169.5	73.1	8	0	0	0	110.4	V302 P304 P331 P333 I397 G398	V302-N395 PolarHBondContact O-ND2 2.86Å; P304-N395 WeakPolarHBondContact CD-OD1 3.03Å; P304-N395 HydrophobicContact CG-CB 4.13Å; P331-N395 VanDerWaalsContact O-CB 3.29Å; P331-N395 WeakPolarHBondContact O-CB 3.46Å; P331-N395 PolarHBondContact O-ND2 2.9Å; P333-N395 HydrophobicContact CB-CB 4.47Å; N395-I397 PolarHBondContact O-N 2.86Å; N395-I397 WeakPolarHBondContact OD1-CB 3.35Å; N395-I397 PolarHBondContact OD1-N 2.71Å; N395-G398 PolarHBondContact N-O 2.9Å; N395-G398 PolarHBondContact OD1-N 3.45Å
396	S	87.3	Confident	91.5	Very high	94 Å²	94	44.1 Å²	44.1	66%	0.657	23%	0.234	S	C	*	.	S	Bend	trans	-69.6	-11.2	-179.5	51.4	0	0	0	0	115
397	I	87.4	Confident	91.7	Very high	54 Å²	54	45 Å²	45	28%	0.277	23%	0.233	S	C	.	.	S	Bend	trans	-103.5	-38.7	-175.4	-43.8	-57.7	0	0	0	111.1	D222 F301 L303 N395	D222-I397 VanDerWaalsContact OD1-CG2 3.28Å; D222-I397 WeakPolarHBondContact OD1-CG2 3.17Å; F301-I397 HydrophobicContact CB-CD1 3.83Å; F301-I397 HydrophobicContact CB-CG1 3.82Å; F301-I397 HydrophobicContact CD2-CD1 3.69Å; F301-I397 HydrophobicContact CE2-CD1 4.41Å; F301-I397 HydrophobicContact CG-CD1 3.83Å; F301-I397 HydrophobicContact CG-CG1 4.3Å; L303-I397 HydrophobicContact CD2-CB 4.06Å; L303-I397 HydrophobicContact CD2-CG2 3.68Å; L303-I397 HydrophobicContact CG-CG2 4.13Å; N395-I397 PolarHBondContact O-N 2.86Å; N395-I397 WeakPolarHBondContact OD1-CB 3.35Å; N395-I397 PolarHBondContact OD1-N 2.71Å
398	G	89.1	Confident	91.7	Very high	24 Å²	24	44.4 Å²	44.4	25%	0.247	23%	0.227	C	C	.	.			trans	-175.3	-158.5	-177.9	0	0	0	0	0	114.8	P304 S394 N395	P304-G398 WeakPolarHBondContact CG-O 3.43Å; S394-G398 WeakPolarHBondContact CA-O 3.17Å; N395-G398 PolarHBondContact N-O 2.9Å; N395-G398 PolarHBondContact OD1-N 3.45Å
399	E	93.7	Very high	91.6	Very high	112 Å²	112	41.9 Å²	41.9	52%	0.523	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	133.7	-170.7	-175.7	179.4	126.6	0	0	111.1	T392 A393 N401	T392-E399 VanDerWaalsContact CG2-CD 3.42Å; T392-E399 HydrophobicContact CG2-CG 3.56Å; T392-E399 WeakPolarHBondContact CG2-OE1 3.45Å; A393-E399 CarbonylContact O-C 3.6Å; A393-E399 VanDerWaalsContact O-CA 3.31Å; A393-E399 WeakPolarHBondContact O-CA 3.42Å; E399-N401 PolarHBondContact OE1-ND2 2.53Å
400	D	95.6	Very high	91.5	Very high	40 Å²	40	43.4 Å²	43.4	21%	0.214	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	151	166.7	-177.5	34.2	0	0	0	110.9	P304 I306 T392 A393 Q402	P304-D400 HydrophobicContact CB-CB 4.46Å; P304-D400 WeakPolarHBondContact O-CB 3.38Å; I306-D400 WeakPolarHBondContact CB-OD2 3.5Å; I306-D400 HydrophobicContact CD1-CB 4.46Å; I306-D400 HydrophobicContact CG1-CB 4.43Å; I306-D400 PolarHBondContact N-OD2 3.47Å; T392-D400 WeakPolarHBondContact CA-O 3.37Å; A393-D400 PolarHBondContact N-O 2.86Å; A393-D400 PolarHBondContact O-N 2.85Å; D400-Q402 PolarHBondContact OD2-NE2 2.86Å
401	N	95.3	Very high	91.3	Very high	65 Å²	65	43.8 Å²	43.8	35%	0.348	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	108.2	-165.4	-84.9	-63.7	0	0	0	111.5	L390 T392 E399	L390-N401 HydrophobicContact CD1-CB 4.15Å; L390-N401 WeakPolarHBondContact CD2-OD1 3.27Å; T392-N401 WeakPolarHBondContact CB-OD1 3.42Å; T392-N401 WeakPolarHBondContact CG2-OD1 3.4Å; T392-N401 PolarHBondContact OG1-OD1 2.79Å; E399-N401 PolarHBondContact OE1-ND2 2.53Å
402	Q	93.6	Very high	91.3	Very high	67 Å²	67	43.8 Å²	43.8	31%	0.313	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	141.9	179.6	-64.5	-171.3	24.5	0	0	112.2	I306 F309 L390 C391 D400	I306-Q402 HydrophobicContact CB-CG 4.08Å; I306-Q402 HydrophobicContact CD1-CB 4.12Å; I306-Q402 HydrophobicContact CD1-CG 4.11Å; I306-Q402 HydrophobicContact CG2-CB 4.31Å; I306-Q402 HydrophobicContact CG2-CG 4.26Å; I306-Q402 PolarHBondContact O-NE2 3.44Å; F309-Q402 HydrophobicContact CD1-CB 3.82Å; F309-Q402 WeakPolarHBondContact CE1-O 3.49Å; L390-Q402 WeakPolarHBondContact CA-O 3.45Å; L390-Q402 VanDerWaalsContact CD1-O 3.31Å; L390-Q402 WeakPolarHBondContact CD1-O 3.18Å; C391-Q402 PolarHBondContact N-O 3.47Å; C391-Q402 PolarHBondContact O-N 2.83Å; D400-Q402 PolarHBondContact OD2-NE2 2.86Å
403	Q	93.1	Very high	91.1	Very high	105 Å²	105	45.7 Å²	45.7	49%	0.491	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	124.6	179.5	-70.9	-166.8	-19.5	0	0	111.8	Y389 L390	Y389-Q403 WeakPolarHBondContact O-CA 3.35Å; L390-Q403 HydrophobicContact CB-CG 4.18Å; L390-Q403 HydrophobicContact CD1-CG 3.43Å; L390-Q403 VanDerWaalsContact CD1-CG 3.43Å; L390-Q403 HydrophobicContact CG-CG 4.42Å
404	L	90.9	Very high	90.9	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	163.5	166.6	71.1	73.2	0	0	0	110	F309 N310 N311 L323 R388 Y389 L406	F309-L404 HydrophobicContact CD1-CB 3.96Å; F309-L404 HydrophobicContact CD1-CD2 4.29Å; F309-L404 HydrophobicContact CD1-CG 4.3Å; F309-L404 HydrophobicContact CD2-CD2 3.96Å; F309-L404 HydrophobicContact CE1-CB 3.67Å; F309-L404 HydrophobicContact CE1-CD2 3.85Å; F309-L404 HydrophobicContact CE1-CG 3.63Å; F309-L404 HydrophobicContact CE2-CD2 3.47Å; F309-L404 VanDerWaalsContact CE2-CD2 3.47Å; F309-L404 HydrophobicContact CE2-CG 4.13Å; F309-L404 HydrophobicContact CG-CD2 4.34Å; F309-L404 HydrophobicContact CZ-CB 4.11Å; F309-L404 HydrophobicContact CZ-CD2 3.42Å; F309-L404 VanDerWaalsContact CZ-CD2 3.42Å; F309-L404 HydrophobicContact CZ-CG 3.52Å; N310-L404 WeakPolarHBondContact O-CD2 3.39Å; N311-L404 WeakPolarHBondContact OD1-CA 3.26Å; L323-L404 HydrophobicContact CB-CD2 4.35Å; L323-L404 HydrophobicContact CD1-CD1 4.14Å; L323-L404 HydrophobicContact CD1-CD2 4.42Å; L323-L404 HydrophobicContact CD2-CD1 4.11Å; L323-L404 HydrophobicContact CD2-CD2 4.16Å; R388-L404 VanDerWaalsContact CA-O 3.31Å; R388-L404 WeakPolarHBondContact CA-O 3.16Å; Y389-L404 HydrophobicContact CD2-CD1 4.27Å; Y389-L404 PolarHBondContact N-O 2.79Å; Y389-L404 VanDerWaalsContact N-O 3.15Å; Y389-L404 PolarHBondContact O-N 2.61Å; L404-L406 HydrophobicContact CD1-CB 4.39Å
405	F	88.9	Confident	90.5	Very high	86 Å²	86	49.8 Å²	49.8	38%	0.377	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	127.1	165	-167.4	-93.6	0	0	0	109.6	N311 G387 R388 E407	N311-F405 PolarHBondContact OD1-N 2.82Å; G387-F405 WeakPolarHBondContact O-CA 3.5Å; R388-F405 HydrophobicContact CG-CD2 3.92Å; F405-E407 HydrophobicContact CD1-CB 4.33Å; F405-E407 HydrophobicContact CE1-CB 4.33Å
406	L	89.8	Confident	89.4	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	110.9	167.2	175.2	56.1	0	0	0	108.1	Q312 A314 V321 L323 L378 A386 G387 Y389 L404 V408	Q312-L406 HydrophobicContact CB-CD1 4.05Å; A314-L406 HydrophobicContact CB-CD1 4.18Å; V321-L406 HydrophobicContact CG1-CD1 4.46Å; V321-L406 HydrophobicContact CG1-CD2 4.2Å; V321-L406 HydrophobicContact CG2-CD1 4.25Å; L323-L406 HydrophobicContact CD2-CD1 4.31Å; L378-L406 HydrophobicContact CD1-CD2 3.73Å; A386-L406 WeakPolarHBondContact CA-O 3.44Å; G387-L406 PolarHBondContact N-O 3.05Å; G387-L406 PolarHBondContact O-N 2.88Å; Y389-L406 HydrophobicContact CD2-CB 3.96Å; Y389-L406 HydrophobicContact CE2-CB 3.8Å; Y389-L406 HydrophobicContact CE2-CD2 3.81Å; Y389-L406 HydrophobicContact CE2-CG 4.44Å; L404-L406 HydrophobicContact CD1-CB 4.39Å; L406-V408 HydrophobicContact CD2-CG2 4.27Å; L406-V408 HydrophobicContact CG-CG2 4.04Å; L406-V408 PolarHBondContact O-N 3.18Å
407	E	89.3	Confident	88.5	Confident	53 Å²	53	53 Å²	53	25%	0.248	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	98.6	172	-177	-167.8	147.7	0	0	109.2	Q312 T313 A314 F405 R409 N437	Q312-E407 PolarHBondContact O-N 2.95Å; T313-E407 CarbonylContact C-O 3.6Å; T313-E407 VanDerWaalsContact CA-O 3.32Å; T313-E407 WeakPolarHBondContact CA-O 3.11Å; T313-E407 HydrophobicContact CG2-CB 4.22Å; T313-E407 HydrophobicContact CG2-CG 4.27Å; T313-E407 WeakPolarHBondContact CG2-O 3.13Å; A314-E407 PolarHBondContact N-O 3.32Å; F405-E407 HydrophobicContact CD1-CB 4.33Å; F405-E407 HydrophobicContact CE1-CB 4.33Å; E407-R409 IonicContact OE1-CZ 3.63Å; E407-R409 IonicContact OE1-NE 3.81Å; E407-R409 PolarHBondContact OE1-NE 2.72Å; E407-R409 IonicContact OE1-NH2 2.62Å; E407-R409 PolarHBondContact OE1-NH2 3.02Å; E407-N437 VanDerWaalsContact CG-ND2 3.31Å; E407-N437 WeakPolarHBondContact CG-ND2 3.41Å
408	V	89.1	Confident	88.2	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	131.8	165.9	-171.3	0	0	0	0	109.5	A314 V381 D385 A386 L406 Y410 N437	A314-V408 CarbonylContact O-C 3.53Å; A314-V408 WeakPolarHBondContact O-CA 3.18Å; V381-V408 HydrophobicContact CG1-CG1 3.91Å; V381-V408 HydrophobicContact CG1-CG2 3.81Å; D385-V408 HydrophobicContact CB-CG2 4.33Å; A386-V408 HydrophobicContact CB-CB 4.01Å; A386-V408 HydrophobicContact CB-CG2 4.03Å; L406-V408 HydrophobicContact CD2-CG2 4.27Å; L406-V408 HydrophobicContact CG-CG2 4.04Å; L406-V408 PolarHBondContact O-N 3.18Å; V408-Y410 WeakPolarHBondContact O-CD1 3.48Å; V408-N437 PolarHBondContact O-ND2 2.85Å
409	R	90.2	Very high	88.1	Confident	93 Å²	93	55.1 Å²	55.1	35%	0.351	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	132.8	173.7	-66.8	-177	166.7	-163.5	-4.3	110.3	T313 A314 S315 E316 E407 N437 I491	T313-R409 HydrophobicContact CG2-CG 4.29Å; A314-R409 PolarHBondContact O-N 2.75Å; S315-R409 CarbonylContact C-O 3.58Å; S315-R409 WeakPolarHBondContact CA-O 3.48Å; E316-R409 PolarHBondContact N-O 2.83Å; E407-R409 IonicContact OE1-CZ 3.63Å; E407-R409 IonicContact OE1-NE 3.81Å; E407-R409 PolarHBondContact OE1-NE 2.72Å; E407-R409 IonicContact OE1-NH2 2.62Å; E407-R409 PolarHBondContact OE1-NH2 3.02Å; R409-N437 CarbonylContact C-O 3.54Å; R409-N437 WeakPolarHBondContact CA-O 3.34Å; R409-I491 HydrophobicContact CB-CD1 3.93Å; R409-I491 HydrophobicContact CB-CG1 4.08Å
410	Y	88.9	Confident	87.9	Confident	35 Å²	35	50.4 Å²	50.4	14%	0.137	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	148.7	-171.7	57.1	-84.8	0	0	0	111.1	F383 V408 A435 N437 N489	F383-Y410 HydrophobicContact CB-CD1 3.49Å; F383-Y410 VanDerWaalsContact CB-CD1 3.49Å; F383-Y410 HydrophobicContact CB-CD2 3.79Å; F383-Y410 HydrophobicContact CB-CE1 3.87Å; F383-Y410 HydrophobicContact CB-CE2 4.14Å; F383-Y410 HydrophobicContact CB-CG 3.46Å; F383-Y410 VanDerWaalsContact CB-CG 3.46Å; F383-Y410 HydrophobicContact CD2-CE2 4.44Å; F383-Y410 HydrophobicContact CG-CD2 4.33Å; F383-Y410 HydrophobicContact CG-CE2 4.48Å; F383-Y410 HydrophobicContact CG-CG 4.45Å; V408-Y410 WeakPolarHBondContact O-CD1 3.48Å; Y410-A435 HydrophobicContact CE2-CB 4.4Å; Y410-N437 HydrophobicContact CD1-CB 3.84Å; Y410-N437 HydrophobicContact CE1-CB 3.46Å; Y410-N437 VanDerWaalsContact CE1-CB 3.46Å; Y410-N437 PolarHBondContact N-O 2.93Å; Y410-N437 PolarHBondContact O-N 3.34Å; Y410-N437 VanDerWaalsContact O-O 3.08Å; Y410-N489 PolarHBondContact O-ND2 3.12Å
411	S	90.8	Very high	87.7	Confident	17 Å²	17	51.8 Å²	51.8	12%	0.119	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	151.3	172.7	54.7	0	0	0	0	111.2	E316 K413	E316-S411 WeakPolarHBondContact OE1-CB 3.44Å; E316-S411 PolarHBondContact OE1-N 3.47Å; E316-S411 PolarHBondContact OE1-OG 3.49Å; E316-S411 PolarHBondContact OE2-OG 2.95Å; S411-K413 WeakPolarHBondContact O-CE 3.05Å; S411-K413 PolarHBondContact O-NZ 2.89Å; S411-K413 PolarHBondContact OG-NZ 3.28Å
412	P	92.3	Very high	87.6	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	139.1	-173.5	-22	37	0	0	0	111.8	V434 A435 A436 A440 A487 N489 G492 E494	P412-V434 HydrophobicContact CB-CG1 3.86Å; P412-A435 CarbonylContact C-O 3.58Å; P412-A435 WeakPolarHBondContact CA-O 3.34Å; P412-A436 HydrophobicContact CB-CB 3.84Å; P412-A436 HydrophobicContact CG-CB 3.97Å; P412-A440 HydrophobicContact CB-CB 4.04Å; P412-A440 HydrophobicContact CG-CB 3.7Å; P412-A487 HydrophobicContact CB-CB 3.64Å; P412-A487 HydrophobicContact CG-CB 4.24Å; P412-A487 WeakPolarHBondContact CG-O 3.42Å; P412-N489 HydrophobicContact CG-CB 4.15Å; P412-G492 VanDerWaalsContact CD-O 3.32Å; P412-G492 WeakPolarHBondContact CD-O 3.14Å; P412-E494 WeakPolarHBondContact O-CB 3.24Å
413	K	89.4	Confident	87.6	Confident	53 Å²	53	48.1 Å²	48.1	23%	0.23	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	132.8	172.7	-43.8	-56.6	179.1	-160.2	0	109.7	E316 S411 V434 A435 E494	E316-K413 IonicContact OE1-NZ 2.74Å; E316-K413 IonicContact OE2-NZ 3.47Å; E316-K413 PolarHBondContact OE2-NZ 2.65Å; S411-K413 WeakPolarHBondContact O-CE 3.05Å; S411-K413 PolarHBondContact O-NZ 2.89Å; S411-K413 PolarHBondContact OG-NZ 3.28Å; K413-V434 WeakPolarHBondContact O-CA 3.29Å; K413-A435 PolarHBondContact N-O 2.81Å; K413-A435 PolarHBondContact O-N 2.8Å; K413-E494 WeakPolarHBondContact CA-OE1 3.17Å
414	I	91.1	Very high	87.5	Confident	12 Å²	12	48.7 Å²	48.7	6%	0.062	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	111.3	-171.8	-52.7	-177.4	0	0	0	111.6	C432 E433 V434 A487 E494 K496 F498	I414-C432 VanDerWaalsContact CG2-SG 3.5Å; I414-E433 CarbonylContact C-O 3.56Å; I414-E433 VanDerWaalsContact CA-O 3.31Å; I414-E433 WeakPolarHBondContact CA-O 3.36Å; I414-V434 HydrophobicContact CG1-CG2 4.4Å; I414-A487 HydrophobicContact CD1-CB 4.03Å; I414-A487 HydrophobicContact CG1-CB 4.23Å; I414-E494 WeakPolarHBondContact CD1-O 3.4Å; I414-E494 HydrophobicContact CG1-CB 4.47Å; I414-E494 HydrophobicContact CG1-CG 4.43Å; I414-E494 PolarHBondContact N-OE1 3.15Å; I414-K496 HydrophobicContact CB-CB 4.01Å; I414-K496 HydrophobicContact CB-CD 3.82Å; I414-K496 HydrophobicContact CD1-CB 4.02Å; I414-K496 HydrophobicContact CG2-CB 3.94Å; I414-K496 HydrophobicContact CG2-CD 3.53Å; I414-K496 HydrophobicContact CG2-CG 4.4Å; I414-K496 WeakPolarHBondContact O-CD 3.41Å; I414-K496 PolarHBondContact O-NZ 3.45Å; I414-F498 HydrophobicContact CG2-CE2 4.34Å; I414-F498 HydrophobicContact CG2-CZ 4.14Å
415	M	83.3	Confident	87.5	Confident	105 Å²	105	51 Å²	51	52%	0.517	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-163.5	-179.7	-58.6	-173	-63.8	0	0	111.3	E433 A435 K496	M415-E433 HydrophobicContact CB-CB 4.07Å; M415-E433 PolarHBondContact N-O 3.05Å; M415-A435 HydrophobicContact CE-CB 4.23Å; M415-K496 VanDerWaalsContact C-NZ 3.29Å; M415-K496 PolarHBondContact O-NZ 3.4Å
416	G	68.3	Low	87.6	Confident	30 Å²	30	49.8 Å²	49.8	31%	0.309	27%	0.267	S	S	.	.	S	Bend	trans	81.9	163.7	176.4	0	0	0	0	0	116.6	K496	G416-K496 PolarHBondContact O-NZ 3.49Å; G416-K496 VanDerWaalsContact O-NZ 3.15Å
417	L	68.4	Low	87.7	Confident	161 Å²	161	53.6 Å²	53.6	84%	0.843	29%	0.291	S	S	*	.			trans	-75.3	136	175.8	-81.5	160	0	0	0	111.3	F498	L417-F498 WeakPolarHBondContact O-CE1 3.45Å
418	V	81.1	Confident	87.8	Confident	53 Å²	53	51.5 Å²	51.5	32%	0.321	28%	0.283	S	S	.	.			trans	-95.4	5.5	-170.3	-62	0	0	0	0	115.4	K496 E497 F498 I499	V418-K496 HydrophobicContact CG1-CD 4.33Å; V418-K496 VanDerWaalsContact CG1-CE 3.44Å; V418-K496 HydrophobicContact CG1-CG 4.49Å; V418-E497 WeakPolarHBondContact CG1-O 3.48Å; V418-F498 HydrophobicContact CB-CD1 4.35Å; V418-F498 HydrophobicContact CG1-CD1 4.39Å; V418-F498 HydrophobicContact CG1-CE1 4.36Å; V418-F498 CarbonylContact O-C 3.54Å; V418-F498 VanDerWaalsContact O-CA 3.29Å; V418-F498 WeakPolarHBondContact O-CA 3.17Å; V418-I499 PolarHBondContact O-N 2.74Å
419	V	86.8	Confident	88	Confident	69 Å²	69	56.2 Å²	56.2	42%	0.418	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	133	-175.6	-174.6	0	0	0	0	110.7	I499 I501	V419-I499 WeakPolarHBondContact CA-O 3.12Å; V419-I501 HydrophobicContact CG1-CD1 3.56Å; V419-I501 HydrophobicContact CG1-CG1 4.04Å
420	A	90.3	Very high	88	Confident	14 Å²	14	52 Å²	52	12%	0.116	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	147.1	171.6	0	0	0	0	0	110.4	I430 I499 L500 I501	A420-I430 HydrophobicContact CB-CG1 3.98Å; A420-I499 PolarHBondContact N-O 3.39Å; A420-L500 HydrophobicContact CB-CD1 3.89Å; A420-I501 PolarHBondContact O-N 3.18Å
421	H	91.4	Very high	88.1	Confident	69 Å²	69	52.1 Å²	52.1	32%	0.319	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	132.1	-179.9	-66.5	-90.5	0	0	0	111.3	I501 A503 G533 V534	H421-I501 WeakPolarHBondContact CA-O 3.49Å; H421-A503 HydrophobicContact CB-CB 4.39Å; H421-G533 WeakPolarHBondContact CB-O 3.47Å; H421-V534 HydrophobicContact CB-CG1 3.93Å
422	T	93	Very high	88.2	Confident	4 Å²	4	51.3 Å²	51.3	3%	0.025	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	-177.9	169.4	-167.5	0	0	0	0	111.2	N426 A428 P474 F480 L500 I501 Q502 A503	T422-N426 PolarHBondContact OG1-O 3.03Å; T422-A428 HydrophobicContact CG2-CB 3.67Å; T422-P474 HydrophobicContact CG2-CG 3.73Å; T422-F480 HydrophobicContact CG2-CE1 4.25Å; T422-F480 WeakPolarHBondContact O-CE1 3.48Å; T422-L500 HydrophobicContact CG2-CD1 4.1Å; T422-L500 HydrophobicContact CG2-CD2 4.4Å; T422-I501 PolarHBondContact N-O 3.28Å; T422-Q502 CarbonylContact O-C 3.59Å; T422-Q502 WeakPolarHBondContact O-CA 3.29Å; T422-A503 PolarHBondContact O-N 2.84Å
423	W	93	Very high	88.2	Confident	50 Å²	50	54.5 Å²	54.5	19%	0.189	31%	0.308	C	S	.	.			trans	-131.7	171.5	175.1	62.4	94.8	0	0	0	111.8	G425 N426 A503 V534 G586 K587	W423-G425 PolarHBondContact O-N 3.45Å; W423-N426 HydrophobicContact CD2-CB 4.12Å; W423-N426 VanDerWaalsContact CE2-CG 3.43Å; W423-N426 HydrophobicContact CG-CB 4.42Å; W423-N426 HydrophobicContact CZ2-CB 3.99Å; W423-N426 WeakPolarHBondContact CZ2-OD1 3.31Å; W423-N426 VanDerWaalsContact NE1-CG 3.29Å; W423-N426 PolarHBondContact NE1-ND2 2.91Å; W423-N426 PolarHBondContact O-N 2.67Å; W423-A503 HydrophobicContact CE3-CB 3.89Å; W423-V534 HydrophobicContact CZ3-CG1 4.25Å; W423-V534 HydrophobicContact CZ3-CG2 4.18Å; W423-G586 VanDerWaalsContact CH2-C 3.4Å; W423-G586 VanDerWaalsContact CZ2-C 3.49Å; W423-G586 WeakPolarHBondContact CZ2-O 3.44Å; W423-K587 HydrophobicContact CB-CD 3.68Å; W423-K587 HydrophobicContact CD2-CB 4.25Å; W423-K587 HydrophobicContact CD2-CD 4.05Å; W423-K587 HydrophobicContact CE3-CB 4.17Å; W423-K587 HydrophobicContact CG-CD 3.6Å
424	E	91.9	Very high	88.3	Confident	117 Å²	117	52.4 Å²	52.4	55%	0.547	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.6	134.3	-179.4	-160.7	179.3	140.4	0	0	112.4	N426 P474	E424-N426 PolarHBondContact O-N 2.64Å; E424-N426 PolarHBondContact O-ND2 3.23Å; E424-P474 WeakPolarHBondContact CA-O 3.49Å
425	G	90.4	Very high	88.3	Confident	51 Å²	51	53 Å²	53	53%	0.526	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.3	6.1	-177.4	0	0	0	0	0	116	W423 T473 P474	W423-G425 PolarHBondContact O-N 3.45Å; G425-T473 VanDerWaalsContact C-CG2 3.45Å; G425-P474 PolarHBondContact N-O 2.94Å
426	N	91.5	Very high	88.5	Confident	60 Å²	60	49 Å²	49	32%	0.321	29%	0.29	S	S	.	.			trans	-123.8	129.6	-175.4	-73.8	-102.6	0	0	0	112.1	T422 W423 E424 P474	T422-N426 PolarHBondContact OG1-O 3.03Å; W423-N426 HydrophobicContact CD2-CB 4.12Å; W423-N426 VanDerWaalsContact CE2-CG 3.43Å; W423-N426 HydrophobicContact CG-CB 4.42Å; W423-N426 HydrophobicContact CZ2-CB 3.99Å; W423-N426 WeakPolarHBondContact CZ2-OD1 3.31Å; W423-N426 VanDerWaalsContact NE1-CG 3.29Å; W423-N426 PolarHBondContact NE1-ND2 2.91Å; W423-N426 PolarHBondContact O-N 2.67Å; E424-N426 PolarHBondContact O-N 2.64Å; E424-N426 PolarHBondContact O-ND2 3.23Å; N426-P474 WeakPolarHBondContact O-CD 3.44Å
427	P	92	Very high	89.5	Confident	80 Å²	80	49.7 Å²	49.7	52%	0.519	29%	0.286	S	S	.	.			trans	-73.5	137.1	-173.4	28	-34.4	0	0	0	113.2	E471 I472 T473	P427-E471 HydrophobicContact CB-CG 4.33Å; P427-I472 CarbonylContact C-O 3.56Å; P427-I472 WeakPolarHBondContact CA-O 3.44Å; P427-T473 WeakPolarHBondContact CB-OG1 3.17Å
428	A	91.3	Very high	90.6	Very high	9 Å²	9	43.6 Å²	43.6	7%	0.074	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	151.7	162.6	0	0	0	0	0	110.6	T422 E471 I472 L500	T422-A428 HydrophobicContact CG2-CB 3.67Å; A428-E471 CarbonylContact O-C 3.56Å; A428-E471 WeakPolarHBondContact O-CA 3.25Å; A428-I472 HydrophobicContact CB-CG2 4.42Å; A428-I472 PolarHBondContact N-O 2.97Å; A428-I472 PolarHBondContact O-N 3.4Å; A428-L500 HydrophobicContact CB-CD1 3.64Å
429	N	91.8	Very high	91	Very high	98 Å²	98	48.7 Å²	48.7	52%	0.524	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	122.8	171.3	-73.1	-24.6	0	0	0	109.9	I469 L470 E471	N429-I469 HydrophobicContact CB-CG2 3.79Å; N429-L470 WeakPolarHBondContact CA-O 3.33Å; N429-E471 WeakPolarHBondContact OD1-CA 3.31Å; N429-E471 VanDerWaalsContact OD1-CB 3.26Å; N429-E471 WeakPolarHBondContact OD1-CB 3.49Å; N429-E471 WeakPolarHBondContact OD1-CG 3.4Å
430	I	91.4	Very high	91.2	Very high	4 Å²	4	46 Å²	46	2%	0.021	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	118.2	173.1	-45.9	-173.1	0	0	0	108.2	A420 W444 I469 L470 Y483 F498 L500	A420-I430 HydrophobicContact CB-CG1 3.98Å; I430-W444 HydrophobicContact CB-CH2 4.04Å; I430-W444 HydrophobicContact CG2-CH2 3.68Å; I430-W444 HydrophobicContact CG2-CZ3 4.12Å; I430-I469 WeakPolarHBondContact O-CA 2.98Å; I430-L470 HydrophobicContact CB-CB 4.3Å; I430-L470 HydrophobicContact CD1-CD2 4.26Å; I430-L470 PolarHBondContact N-O 3.17Å; I430-L470 PolarHBondContact O-N 3.45Å; I430-Y483 HydrophobicContact CD1-CD2 4.3Å; I430-Y483 HydrophobicContact CD1-CG 4.45Å; I430-F498 HydrophobicContact CG2-CB 3.56Å; I430-F498 HydrophobicContact CG2-CD1 3.38Å; I430-F498 HydrophobicContact CG2-CE1 4.26Å; I430-F498 HydrophobicContact CG2-CG 3.63Å; I430-L500 HydrophobicContact CD1-CB 4.31Å; I430-L500 HydrophobicContact CD1-CD1 4.3Å
431	S	91.4	Very high	91.3	Very high	38 Å²	38	49.1 Å²	49.1	27%	0.266	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	115.7	-177	-173.2	0	0	0	0	111.2	E433 I467 F498	S431-E433 PolarHBondContact OG-OE1 2.91Å; S431-I467 WeakPolarHBondContact OG-CG2 3.29Å; S431-F498 WeakPolarHBondContact O-CE1 3.25Å
432	C	91.6	Very high	91.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	101.6	169.3	178.7	0	0	0	0	109.5	I414 W444 I467 S468 C485 F498	I414-C432 VanDerWaalsContact CG2-SG 3.5Å; C432-W444 HydrophobicContact CB-CH2 3.74Å; C432-W444 HydrophobicContact CB-CZ2 3.34Å; C432-I467 WeakPolarHBondContact O-CA 3.07Å; C432-S468 PolarHBondContact N-O 2.78Å; C432-S468 PolarHBondContact O-N 2.03Å; C432-C485 HydrophobicContact CB-CB 3.65Å; C432-C485 WeakPolarHBondContact CB-SG 3.29Å; C432-C485 WeakPolarHBondContact SG-CB 3.09Å; C432-C485 CovalentContact SG-SG 2.03Å; C432-C485 PolarHBondContact SG-SG 2.97Å; C432-F498 HydrophobicContact CB-CE2 4.24Å; C432-F498 HydrophobicContact CB-CZ 4.04Å
433	E	92.8	Very high	91.4	Very high	67 Å²	67	49 Å²	49	31%	0.313	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	130.1	179.7	-70.8	161.7	-149	0	0	109.8	I414 M415 S431 I467	I414-E433 CarbonylContact C-O 3.56Å; I414-E433 VanDerWaalsContact CA-O 3.31Å; I414-E433 WeakPolarHBondContact CA-O 3.36Å; M415-E433 HydrophobicContact CB-CB 4.07Å; M415-E433 PolarHBondContact N-O 3.05Å; S431-E433 PolarHBondContact OG-OE1 2.91Å; E433-I467 HydrophobicContact CG-CD1 4.27Å; E433-I467 HydrophobicContact CG-CG1 4.09Å; E433-I467 HydrophobicContact CG-CG2 4.06Å
434	V	91.6	Very high	91.4	Very high	9 Å²	9	46.8 Å²	46.8	6%	0.055	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	117.9	-168.2	-175.6	0	0	0	0	110.8	P412 K413 I414 A436 A440 V442 T466 A487	P412-V434 HydrophobicContact CB-CG1 3.86Å; K413-V434 WeakPolarHBondContact O-CA 3.29Å; I414-V434 HydrophobicContact CG1-CG2 4.4Å; V434-A436 HydrophobicContact CG1-CB 4.21Å; V434-A440 HydrophobicContact CG1-CB 4.05Å; V434-V442 HydrophobicContact CG2-CG2 3.92Å; V434-T466 PolarHBondContact N-O 2.92Å; V434-A487 HydrophobicContact CG1-CB 3.68Å; V434-A487 HydrophobicContact CG2-CB 3.97Å
435	A	90.3	Very high	91.4	Very high	25 Å²	25	43.9 Å²	43.9	21%	0.207	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	121	166.2	0	0	0	0	0	108.9	Y410 P412 K413 M415	Y410-A435 HydrophobicContact CE2-CB 4.4Å; P412-A435 CarbonylContact C-O 3.58Å; P412-A435 WeakPolarHBondContact CA-O 3.34Å; K413-A435 PolarHBondContact N-O 2.81Å; K413-A435 PolarHBondContact O-N 2.8Å; M415-A435 HydrophobicContact CE-CB 4.23Å
436	A	89.2	Confident	91.4	Very high	21 Å²	21	43.5 Å²	43.5	17%	0.174	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	140.3	-178.3	0	0	0	0	0	111.6	P412 V434 P438 A440	P412-A436 HydrophobicContact CB-CB 3.84Å; P412-A436 HydrophobicContact CG-CB 3.97Å; V434-A436 HydrophobicContact CG1-CB 4.21Å; A436-P438 CarbonylContact C-O 3.49Å; A436-A440 HydrophobicContact CB-CB 3.83Å
437	N	89.3	Confident	91.1	Very high	44 Å²	44	47.3 Å²	47.3	24%	0.235	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	119.3	167.7	-173.5	36.7	0	0	0	111.7	E407 V408 R409 Y410	E407-N437 VanDerWaalsContact CG-ND2 3.31Å; E407-N437 WeakPolarHBondContact CG-ND2 3.41Å; V408-N437 PolarHBondContact O-ND2 2.85Å; R409-N437 CarbonylContact C-O 3.54Å; R409-N437 WeakPolarHBondContact CA-O 3.34Å; Y410-N437 HydrophobicContact CD1-CB 3.84Å; Y410-N437 HydrophobicContact CE1-CB 3.46Å; Y410-N437 VanDerWaalsContact CE1-CB 3.46Å; Y410-N437 PolarHBondContact N-O 2.93Å; Y410-N437 PolarHBondContact O-N 3.34Å; Y410-N437 VanDerWaalsContact O-O 3.08Å
438	P	89.8	Confident	90.7	Very high	33 Å²	33	46.8 Å²	46.8	21%	0.214	27%	0.27	C	S	.	.	S	Bend	cis	-61.1	164.7	-4.5	-25.4	37.6	0	0	0	113.9	A436 A440 N489 V490	A436-P438 CarbonylContact C-O 3.49Å; P438-A440 PolarHBondContact O-N 3.45Å; P438-N489 WeakPolarHBondContact O-CB 3.32Å; P438-N489 PolarHBondContact O-ND2 2.91Å; P438-V490 HydrophobicContact CG-CG2 3.81Å
439	R	89.6	Confident	90.5	Very high	160 Å²	160	52.2 Å²	52.2	60%	0.604	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-50.1	131.3	178.9	-179.8	-175.6	176	-165.2	1.2	111.5	T464	R439-T464 PolarHBondContact NH2-O 2.99Å
440	A	92.2	Very high	90.5	Very high	14 Å²	14	53.2 Å²	53.2	12%	0.116	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-79	149.2	176.8	0	0	0	0	0	113.3	P412 V434 A436 P438 A487 T488 N489	P412-A440 HydrophobicContact CB-CB 4.04Å; P412-A440 HydrophobicContact CG-CB 3.7Å; V434-A440 HydrophobicContact CG1-CB 4.05Å; A436-A440 HydrophobicContact CB-CB 3.83Å; P438-A440 PolarHBondContact O-N 3.45Å; A440-A487 HydrophobicContact CB-CB 4.15Å; A440-T488 CarbonylContact C-O 3.5Å; A440-T488 VanDerWaalsContact CA-O 3.22Å; A440-T488 WeakPolarHBondContact CA-O 3.24Å; A440-T488 WeakPolarHBondContact CB-O 3.48Å; A440-N489 HydrophobicContact CB-CB 4.43Å
441	S	92.3	Very high	90.4	Very high	78 Å²	78	53.8 Å²	53.8	55%	0.545	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	137.4	155.3	54.8	0	0	0	0	109.4	A487 T488	S441-A487 WeakPolarHBondContact O-CA 3.06Å; S441-T488 PolarHBondContact N-O 2.9Å; S441-T488 PolarHBondContact O-N 2.69Å; S441-T488 PolarHBondContact OG-O 3.35Å
442	V	93.2	Very high	89.7	Confident	28 Å²	28	55.8 Å²	55.8	17%	0.17	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	132.2	-178.9	-174.7	0	0	0	0	110.5	V434 C485 T486 A487	V434-V442 HydrophobicContact CG2-CG2 3.92Å; V442-C485 WeakPolarHBondContact CG1-SG 3.33Å; V442-T486 WeakPolarHBondContact CA-O 3Å; V442-A487 HydrophobicContact CG2-CB 4.18Å
443	V	92.1	Very high	88.4	Confident	43 Å²	43	60.6 Å²	60.6	26%	0.261	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	138.5	-179.2	-177.6	0	0	0	0	108.9	F445 E450 T486	V443-F445 HydrophobicContact CB-CE2 3.82Å; V443-F445 HydrophobicContact CB-CZ 4.35Å; V443-F445 HydrophobicContact CG1-CD2 4.19Å; V443-F445 HydrophobicContact CG1-CE2 3.49Å; V443-F445 VanDerWaalsContact CG1-CE2 3.49Å; V443-F445 HydrophobicContact CG1-CZ 3.69Å; V443-E450 HydrophobicContact CG1-CG 3.6Å; V443-E450 WeakPolarHBondContact CG1-OE1 3.35Å; V443-T486 PolarHBondContact N-O 2.81Å; V443-T486 PolarHBondContact O-N 3.08Å
444	W	93.3	Very high	87	Confident	3 Å²	3	61.4 Å²	61.4	1%	0.011	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	137.5	178.5	-72.3	85	0	0	0	111.5	I430 C432 L451 I461 S468 L470 N484 C485 F498	I430-W444 HydrophobicContact CB-CH2 4.04Å; I430-W444 HydrophobicContact CG2-CH2 3.68Å; I430-W444 HydrophobicContact CG2-CZ3 4.12Å; C432-W444 HydrophobicContact CB-CH2 3.74Å; C432-W444 HydrophobicContact CB-CZ2 3.34Å; W444-L451 HydrophobicContact CB-CD1 3.86Å; W444-L451 HydrophobicContact CB-CG 4.34Å; W444-L451 PolarHBondContact O-N 3Å; W444-I461 HydrophobicContact CB-CD1 3.95Å; W444-I461 HydrophobicContact CG-CD1 4.12Å; W444-S468 PolarHBondContact NE1-OG 2.95Å; W444-L470 HydrophobicContact CD2-CB 3.87Å; W444-L470 HydrophobicContact CD2-CD2 3.91Å; W444-L470 HydrophobicContact CD2-CG 4.44Å; W444-L470 HydrophobicContact CE3-CB 4.19Å; W444-L470 HydrophobicContact CE3-CD2 3.58Å; W444-L470 HydrophobicContact CG-CB 4.41Å; W444-L470 HydrophobicContact CG-CD2 4.45Å; W444-L470 HydrophobicContact CH2-CB 4.07Å; W444-L470 HydrophobicContact CZ2-CB 3.73Å; W444-L470 HydrophobicContact CZ3-CB 4.29Å; W444-L470 HydrophobicContact CZ3-CD2 3.92Å; W444-N484 WeakPolarHBondContact CA-O 3.48Å; W444-C485 HydrophobicContact CD2-CB 4.13Å; W444-C485 HydrophobicContact CE3-CB 3.94Å; W444-C485 HydrophobicContact CH2-CB 3.95Å; W444-C485 HydrophobicContact CZ2-CB 4.13Å; W444-C485 HydrophobicContact CZ3-CB 3.84Å; W444-F498 HydrophobicContact CH2-CD2 4.04Å; W444-F498 HydrophobicContact CH2-CE2 4.3Å; W444-F498 HydrophobicContact CH2-CG 4.22Å; W444-F498 HydrophobicContact CZ3-CB 4.35Å; W444-F498 AromaticContact CZ3-CD2 3.88Å; W444-F498 HydrophobicContact CZ3-CD2 3.88Å; W444-F498 HydrophobicContact CZ3-CE2 4.48Å; W444-F498 HydrophobicContact CZ3-CG 4.16Å
445	F	92.6	Very high	85.6	Confident	57 Å²	57	68.3 Å²	68.3	25%	0.25	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	153.2	-178.1	-66.1	-94.9	0	0	0	111.5	V443 I449 E450 N484	V443-F445 HydrophobicContact CB-CE2 3.82Å; V443-F445 HydrophobicContact CB-CZ 4.35Å; V443-F445 HydrophobicContact CG1-CD2 4.19Å; V443-F445 HydrophobicContact CG1-CE2 3.49Å; V443-F445 VanDerWaalsContact CG1-CE2 3.49Å; V443-F445 HydrophobicContact CG1-CZ 3.69Å; F445-I449 CarbonylContact C-O 3.54Å; F445-I449 VanDerWaalsContact CA-O 3.24Å; F445-I449 WeakPolarHBondContact CA-O 3.46Å; F445-E450 HydrophobicContact CD1-CB 4.15Å; F445-E450 HydrophobicContact CE1-CB 3.89Å; F445-N484 HydrophobicContact CB-CB 4.29Å; F445-N484 PolarHBondContact N-O 3Å; F445-N484 PolarHBondContact O-N 2.91Å
446	R	90.3	Very high	84.8	Confident	43 Å²	43	68.8 Å²	68.8	16%	0.162	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	129.6	170.9	-172.8	177.6	-158	-146.6	-6	109.6	G448 I449 L451 N478 D479 F480 Y483	R446-G448 PolarHBondContact O-N 2.94Å; R446-I449 PolarHBondContact N-O 3.33Å; R446-I449 WeakPolarHBondContact O-CB 3.26Å; R446-I449 PolarHBondContact O-N 3.12Å; R446-L451 HydrophobicContact CB-CD2 3.82Å; R446-N478 PolarHBondContact NH1-O 2.84Å; R446-N478 PolarHBondContact NH2-O 2.95Å; R446-D479 IonicContact NH1-OD1 3.88Å; R446-F480 PolarHBondContact NH2-O 2.72Å; R446-Y483 HydrophobicContact CB-CD1 4.35Å; R446-Y483 HydrophobicContact CB-CE1 4.3Å; R446-Y483 HydrophobicContact CG-CD1 4.47Å; R446-Y483 HydrophobicContact CG-CE1 4.2Å; R446-Y483 VanDerWaalsContact NE-CZ 3.35Å; R446-Y483 PolarHBondContact NE-OH 2.81Å; R446-Y483 VanDerWaalsContact NE-OH 3.1Å; R446-Y483 PolarHBondContact NH1-OH 3.45Å
447	D	85	Confident	84.2	Confident	139 Å²	139	73.1 Å²	73.1	74%	0.743	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	29.7	-176	-53.8	-46.5	0	0	0	113.8
448	G	83.5	Confident	84.1	Confident	70 Å²	70	72.2 Å²	72.2	72%	0.722	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.9	-0.1	-175.5	0	0	0	0	0	116	R446	R446-G448 PolarHBondContact O-N 2.94Å
449	I	88.1	Confident	84.1	Confident	123 Å²	123	71.3 Å²	71.3	63%	0.631	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	134.8	-178.1	-53.1	177.7	0	0	0	110.1	F445 R446	F445-I449 CarbonylContact C-O 3.54Å; F445-I449 VanDerWaalsContact CA-O 3.24Å; F445-I449 WeakPolarHBondContact CA-O 3.46Å; R446-I449 PolarHBondContact N-O 3.33Å; R446-I449 WeakPolarHBondContact O-CB 3.26Å; R446-I449 PolarHBondContact O-N 3.12Å
450	E	91	Very high	84.1	Confident	119 Å²	119	68.1 Å²	68.1	56%	0.556	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	137.5	176.1	-179.4	173.2	174.3	0	0	112	V443 F445	V443-E450 HydrophobicContact CG1-CG 3.6Å; V443-E450 WeakPolarHBondContact CG1-OE1 3.35Å; F445-E450 HydrophobicContact CD1-CB 4.15Å; F445-E450 HydrophobicContact CE1-CB 3.89Å
451	L	88.9	Confident	84.1	Confident	15 Å²	15	69 Å²	69	8%	0.079	41%	0.405	C	S	.	.			trans	-77.5	125.5	-178.8	-66.9	-176.8	0	0	0	112.5	W444 R446 T453 I459 I461 L470 Y483	W444-L451 HydrophobicContact CB-CD1 3.86Å; W444-L451 HydrophobicContact CB-CG 4.34Å; W444-L451 PolarHBondContact O-N 3Å; R446-L451 HydrophobicContact CB-CD2 3.82Å; L451-T453 PolarHBondContact O-N 3.42Å; L451-I459 HydrophobicContact CD1-CD1 4.37Å; L451-I459 HydrophobicContact CD1-CG2 4.43Å; L451-I459 HydrophobicContact CD2-CD1 4.1Å; L451-I461 HydrophobicContact CB-CD1 4.3Å; L451-L470 HydrophobicContact CD1-CD1 3.84Å; L451-L470 HydrophobicContact CD1-CD2 3.97Å; L451-Y483 HydrophobicContact CD1-CD1 4Å; L451-Y483 HydrophobicContact CD1-CE1 4.11Å
452	P	77	Confident	84	Confident	81 Å²	81	70.2 Å²	70.2	53%	0.526	40%	0.4	S	S	.	.			trans	-77.6	106.4	-174.2	30.2	-35.1	0	0	0	112.8	A454	P452-A454 PolarHBondContact O-N 3.13Å
453	T	64.8	Low	83.7	Confident	100 Å²	100	73.2 Å²	73.2	61%	0.613	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-19	-178.6	42.6	0	0	0	0	115.9	L451 I461	L451-T453 PolarHBondContact O-N 3.42Å; T453-I461 HydrophobicContact CG2-CB 4.02Å; T453-I461 HydrophobicContact CG2-CD1 3.79Å; T453-I461 HydrophobicContact CG2-CG1 4.2Å
454	A	62.4	Low	83.4	Confident	85 Å²	85	74.1 Å²	74.1	70%	0.702	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-25.4	-169.4	0	0	0	0	0	115.5	P452	P452-A454 PolarHBondContact O-N 3.13Å
455	N	62.6	Low	82.8	Confident	154 Å²	154	78.4 Å²	78.4	82%	0.824	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.2	8.2	-165.6	-73.1	-27.7	0	0	0	114.3
456	S	73.8	Confident	82.5	Confident	35 Å²	35	79.7 Å²	79.7	25%	0.245	46%	0.462	C	S	.	.			trans	-86.3	139.2	176.4	171	0	0	0	0	111.6	N458 I459	S456-N458 PolarHBondContact OG-N 3.03Å; S456-N458 PolarHBondContact OG-OD1 3.31Å; S456-I459 WeakPolarHBondContact OG-CB 3.3Å; S456-I459 PolarHBondContact OG-N 3.23Å
457	T	76.8	Confident	82.5	Confident	111 Å²	111	80.4 Å²	80.4	68%	0.681	47%	0.469	S	S	*	.	S	Bend	trans	-83.4	-35.2	169.1	42.3	0	0	0	0	112.4	E475	T457-E475 PolarHBondContact OG1-OE1 3.15Å
458	N	87.1	Confident	82.8	Confident	25 Å²	25	73.8 Å²	73.8	13%	0.134	43%	0.433	C	S	.	.	S	Bend	trans	-94.3	-15.9	-171.6	56.6	-18.6	0	0	0	115.3	S456 I472 T473 E475	S456-N458 PolarHBondContact OG-N 3.03Å; S456-N458 PolarHBondContact OG-OD1 3.31Å; N458-I472 CarbonylContact O-C 3.59Å; N458-I472 WeakPolarHBondContact O-CA 3.48Å; N458-T473 VanDerWaalsContact CB-O 3.3Å; N458-T473 WeakPolarHBondContact CB-O 3.35Å; N458-T473 PolarHBondContact O-N 2.59Å; N458-E475 HydrophobicContact CB-CG 3.89Å; N458-E475 WeakPolarHBondContact CB-OE1 3.39Å
459	I	89.8	Confident	83.3	Confident	15 Å²	15	73 Å²	73	8%	0.077	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	133.1	-173.9	-64.3	172.2	0	0	0	110.7	L451 S456 I461 L470 E471 I472	L451-I459 HydrophobicContact CD1-CD1 4.37Å; L451-I459 HydrophobicContact CD1-CG2 4.43Å; L451-I459 HydrophobicContact CD2-CD1 4.1Å; S456-I459 WeakPolarHBondContact OG-CB 3.3Å; S456-I459 PolarHBondContact OG-N 3.23Å; I459-I461 HydrophobicContact CG2-CG1 4.42Å; I459-L470 HydrophobicContact CG2-CD1 3.47Å; I459-L470 VanDerWaalsContact CG2-CD1 3.47Å; I459-E471 CarbonylContact C-O 3.52Å; I459-E471 WeakPolarHBondContact CA-O 3.4Å; I459-I472 HydrophobicContact CD1-CD1 4.19Å; I459-I472 HydrophobicContact CG1-CB 4.39Å; I459-I472 HydrophobicContact CG1-CD1 4.03Å; I459-I472 HydrophobicContact CG1-CG1 3.97Å
460	K	89.9	Confident	83.5	Confident	93 Å²	93	67.1 Å²	67.1	40%	0.404	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	146.4	168.6	-48.1	-172.6	-162.2	69.1	0	109.5	F462 E471	K460-F462 HydrophobicContact CB-CE2 3.97Å; K460-F462 HydrophobicContact CB-CZ 4.03Å; K460-F462 HydrophobicContact CD-CZ 4.11Å; K460-E471 HydrophobicContact CB-CB 4.31Å; K460-E471 VanDerWaalsContact CD-OE1 3.32Å; K460-E471 WeakPolarHBondContact CD-OE1 3.42Å; K460-E471 WeakPolarHBondContact CE-OE1 3.36Å; K460-E471 PolarHBondContact N-O 3Å; K460-E471 IonicContact NZ-OE1 2.8Å; K460-E471 PolarHBondContact NZ-OE1 3.23Å; K460-E471 PolarHBondContact O-N 3.06Å
461	I	90.8	Very high	83.5	Confident	33 Å²	33	63.3 Å²	63.3	17%	0.169	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	119.2	178.5	-62.1	173.8	0	0	0	109.2	W444 L451 T453 I459 I469 L470	W444-I461 HydrophobicContact CB-CD1 3.95Å; W444-I461 HydrophobicContact CG-CD1 4.12Å; L451-I461 HydrophobicContact CB-CD1 4.3Å; T453-I461 HydrophobicContact CG2-CB 4.02Å; T453-I461 HydrophobicContact CG2-CD1 3.79Å; T453-I461 HydrophobicContact CG2-CG1 4.2Å; I459-I461 HydrophobicContact CG2-CG1 4.42Å; I461-I469 CarbonylContact C-O 3.58Å; I461-I469 WeakPolarHBondContact CA-O 3.45Å; I461-L470 HydrophobicContact CD1-CD1 4.28Å; I461-L470 HydrophobicContact CG1-CD1 3.84Å
462	F	89.9	Confident	83.7	Confident	102 Å²	102	62.6 Å²	62.6	45%	0.447	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	108.5	-179.5	-57.3	-78.4	0	0	0	109.9	K460 I469 E471	K460-F462 HydrophobicContact CB-CE2 3.97Å; K460-F462 HydrophobicContact CB-CZ 4.03Å; K460-F462 HydrophobicContact CD-CZ 4.11Å; F462-I469 HydrophobicContact CB-CB 4.37Å; F462-I469 PolarHBondContact N-O 2.77Å; F462-I469 PolarHBondContact O-N 3.37Å; F462-E471 HydrophobicContact CD2-CB 4.29Å; F462-E471 HydrophobicContact CE2-CB 3.77Å; F462-E471 HydrophobicContact CE2-CG 4.47Å
463	N	87.7	Confident	84.5	Confident	92 Å²	92	60.3 Å²	60.3	49%	0.492	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	127.3	-174.8	-74.2	-34.3	0	0	0	112.3	S468	N463-S468 VanDerWaalsContact OD1-CB 3.25Å; N463-S468 WeakPolarHBondContact OD1-CB 3.22Å; N463-S468 PolarHBondContact OD1-OG 2.79Å
464	T	86.6	Confident	85.8	Confident	62 Å²	62	55.5 Å²	55.5	38%	0.38	32%	0.315	S	S	.	.			trans	-114.5	-171.7	175.2	75.7	0	0	0	0	110.2	R439 I467	R439-T464 PolarHBondContact NH2-O 2.99Å; T464-I467 WeakPolarHBondContact CB-O 3.18Å; T464-I467 PolarHBondContact N-O 2.87Å; T464-I467 WeakPolarHBondContact OG1-CA 3.13Å; T464-I467 WeakPolarHBondContact OG1-CB 3.21Å; T464-I467 PolarHBondContact OG1-N 2.89Å; T464-I467 PolarHBondContact OG1-O 3.14Å
465	P	80.5	Confident	87.1	Confident	92 Å²	92	56.9 Å²	56.9	60%	0.597	31%	0.307	S	S	*	.	S	Bend	trans	-64.4	-33.4	174.1	-27.3	38.3	0	0	0	115.6
466	T	85.9	Confident	88.4	Confident	85 Å²	85	51.5 Å²	51.5	52%	0.521	28%	0.282	S	S	.	.	S	Bend	trans	-134.5	-1	-170.4	50.6	0	0	0	0	114	V434	V434-T466 PolarHBondContact N-O 2.92Å
467	I	90.2	Very high	89.1	Confident	58 Å²	58	54.9 Å²	54.9	30%	0.297	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	133.1	179.9	-45	-177.4	0	0	0	109.5	S431 C432 E433 T464 I469	S431-I467 WeakPolarHBondContact OG-CG2 3.29Å; C432-I467 WeakPolarHBondContact O-CA 3.07Å; E433-I467 HydrophobicContact CG-CD1 4.27Å; E433-I467 HydrophobicContact CG-CG1 4.09Å; E433-I467 HydrophobicContact CG-CG2 4.06Å; T464-I467 WeakPolarHBondContact CB-O 3.18Å; T464-I467 PolarHBondContact N-O 2.87Å; T464-I467 WeakPolarHBondContact OG1-CA 3.13Å; T464-I467 WeakPolarHBondContact OG1-CB 3.21Å; T464-I467 PolarHBondContact OG1-N 2.89Å; T464-I467 PolarHBondContact OG1-O 3.14Å; I467-I469 HydrophobicContact CG2-CG1 4.03Å
468	S	92.4	Very high	89.6	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	125.4	165.8	-175	0	0	0	0	109.2	C432 W444 N463	C432-S468 PolarHBondContact N-O 2.78Å; C432-S468 PolarHBondContact O-N 2.03Å; W444-S468 PolarHBondContact NE1-OG 2.95Å; N463-S468 VanDerWaalsContact OD1-CB 3.25Å; N463-S468 WeakPolarHBondContact OD1-CB 3.22Å; N463-S468 PolarHBondContact OD1-OG 2.79Å
469	I	92.3	Very high	89.7	Confident	53 Å²	53	55.6 Å²	55.6	27%	0.272	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	119.4	177.5	-56.7	175.2	0	0	0	108.9	N429 I430 I461 F462 I467	N429-I469 HydrophobicContact CB-CG2 3.79Å; I430-I469 WeakPolarHBondContact O-CA 2.98Å; I461-I469 CarbonylContact C-O 3.58Å; I461-I469 WeakPolarHBondContact CA-O 3.45Å; F462-I469 HydrophobicContact CB-CB 4.37Å; F462-I469 PolarHBondContact N-O 2.77Å; F462-I469 PolarHBondContact O-N 3.37Å; I467-I469 HydrophobicContact CG2-CG1 4.03Å
470	L	92.1	Very high	89.8	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	104.7	167.6	171.1	62.8	0	0	0	108.6	N429 I430 W444 L451 I459 I461 Y483	N429-L470 WeakPolarHBondContact CA-O 3.33Å; I430-L470 HydrophobicContact CB-CB 4.3Å; I430-L470 HydrophobicContact CD1-CD2 4.26Å; I430-L470 PolarHBondContact N-O 3.17Å; I430-L470 PolarHBondContact O-N 3.45Å; W444-L470 HydrophobicContact CD2-CB 3.87Å; W444-L470 HydrophobicContact CD2-CD2 3.91Å; W444-L470 HydrophobicContact CD2-CG 4.44Å; W444-L470 HydrophobicContact CE3-CB 4.19Å; W444-L470 HydrophobicContact CE3-CD2 3.58Å; W444-L470 HydrophobicContact CG-CB 4.41Å; W444-L470 HydrophobicContact CG-CD2 4.45Å; W444-L470 HydrophobicContact CH2-CB 4.07Å; W444-L470 HydrophobicContact CZ2-CB 3.73Å; W444-L470 HydrophobicContact CZ3-CB 4.29Å; W444-L470 HydrophobicContact CZ3-CD2 3.92Å; L451-L470 HydrophobicContact CD1-CD1 3.84Å; L451-L470 HydrophobicContact CD1-CD2 3.97Å; I459-L470 HydrophobicContact CG2-CD1 3.47Å; I459-L470 VanDerWaalsContact CG2-CD1 3.47Å; I461-L470 HydrophobicContact CD1-CD1 4.28Å; I461-L470 HydrophobicContact CG1-CD1 3.84Å; L470-Y483 HydrophobicContact CD2-CD1 3.59Å; L470-Y483 HydrophobicContact CD2-CE1 4.23Å; L470-Y483 HydrophobicContact CD2-CG 4.02Å
471	E	92.6	Very high	89.9	Confident	39 Å²	39	53 Å²	53	18%	0.182	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	122.6	167.9	-178.8	-175.2	89	0	0	108.3	P427 A428 N429 I459 K460 F462	P427-E471 HydrophobicContact CB-CG 4.33Å; A428-E471 CarbonylContact O-C 3.56Å; A428-E471 WeakPolarHBondContact O-CA 3.25Å; N429-E471 WeakPolarHBondContact OD1-CA 3.31Å; N429-E471 VanDerWaalsContact OD1-CB 3.26Å; N429-E471 WeakPolarHBondContact OD1-CB 3.49Å; N429-E471 WeakPolarHBondContact OD1-CG 3.4Å; I459-E471 CarbonylContact C-O 3.52Å; I459-E471 WeakPolarHBondContact CA-O 3.4Å; K460-E471 HydrophobicContact CB-CB 4.31Å; K460-E471 VanDerWaalsContact CD-OE1 3.32Å; K460-E471 WeakPolarHBondContact CD-OE1 3.42Å; K460-E471 WeakPolarHBondContact CE-OE1 3.36Å; K460-E471 PolarHBondContact N-O 3Å; K460-E471 IonicContact NZ-OE1 2.8Å; K460-E471 PolarHBondContact NZ-OE1 3.23Å; K460-E471 PolarHBondContact O-N 3.06Å; F462-E471 HydrophobicContact CD2-CB 4.29Å; F462-E471 HydrophobicContact CE2-CB 3.77Å; F462-E471 HydrophobicContact CE2-CG 4.47Å
472	I	92.4	Very high	90	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	132.1	179.9	-178.2	166.2	0	0	0	111.6	P427 A428 N458 I459 Y483 L500	P427-I472 CarbonylContact C-O 3.56Å; P427-I472 WeakPolarHBondContact CA-O 3.44Å; A428-I472 HydrophobicContact CB-CG2 4.42Å; A428-I472 PolarHBondContact N-O 2.97Å; A428-I472 PolarHBondContact O-N 3.4Å; N458-I472 CarbonylContact O-C 3.59Å; N458-I472 WeakPolarHBondContact O-CA 3.48Å; I459-I472 HydrophobicContact CD1-CD1 4.19Å; I459-I472 HydrophobicContact CG1-CB 4.39Å; I459-I472 HydrophobicContact CG1-CD1 4.03Å; I459-I472 HydrophobicContact CG1-CG1 3.97Å; I472-Y483 HydrophobicContact CD1-CE1 3.94Å; I472-Y483 HydrophobicContact CD1-CE2 4.3Å; I472-Y483 WeakPolarHBondContact CD1-OH 3.22Å; I472-L500 HydrophobicContact CD1-CD2 4.22Å; I472-L500 HydrophobicContact CG1-CD2 4.46Å; I472-L500 HydrophobicContact CG2-CD1 4.25Å; I472-L500 HydrophobicContact CG2-CD2 3.72Å
473	T	93.6	Very high	90.1	Very high	32 Å²	32	48.1 Å²	48.1	20%	0.196	27%	0.271	C	S	.	.			trans	-115.3	95.2	177.1	-53.8	0	0	0	0	108.7	G425 P427 N458 E475	G425-T473 VanDerWaalsContact C-CG2 3.45Å; P427-T473 WeakPolarHBondContact CB-OG1 3.17Å; N458-T473 VanDerWaalsContact CB-O 3.3Å; N458-T473 WeakPolarHBondContact CB-O 3.35Å; N458-T473 PolarHBondContact O-N 2.59Å; T473-E475 PolarHBondContact O-N 2.92Å
474	P	92.2	Very high	90.4	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.26	C	S	.	.			trans	-53	120.9	-176.2	-33.4	41.1	0	0	0	113.2	T422 E424 G425 N426 D479 F480 L500	T422-P474 HydrophobicContact CG2-CG 3.73Å; E424-P474 WeakPolarHBondContact CA-O 3.49Å; G425-P474 PolarHBondContact N-O 2.94Å; N426-P474 WeakPolarHBondContact O-CD 3.44Å; P474-D479 HydrophobicContact CB-CB 3.84Å; P474-D479 HydrophobicContact CG-CB 4.33Å; P474-F480 HydrophobicContact CB-CE1 4.32Å; P474-F480 HydrophobicContact CB-CE2 4.05Å; P474-F480 HydrophobicContact CB-CZ 3.74Å; P474-F480 HydrophobicContact CG-CE1 3.87Å; P474-F480 HydrophobicContact CG-CE2 4.48Å; P474-F480 HydrophobicContact CG-CZ 3.79Å; P474-L500 HydrophobicContact CG-CD2 3.82Å
475	E	90.7	Very high	90.7	Very high	113 Å²	113	43 Å²	43	53%	0.528	24%	0.242	S	C	.	.	S	Bend	trans	-91.7	-13.5	173.6	-73.6	-179.5	-171.1	0	0	110.9	T457 N458 T473 D479	T457-E475 PolarHBondContact OG1-OE1 3.15Å; N458-E475 HydrophobicContact CB-CG 3.89Å; N458-E475 WeakPolarHBondContact CB-OE1 3.39Å; T473-E475 PolarHBondContact O-N 2.92Å; E475-D479 PolarHBondContact N-OD2 2.56Å
476	S	89.9	Confident	91.4	Very high	42 Å²	42	39.6 Å²	39.6	29%	0.294	22%	0.219	S	C	.	.	S	Bend	trans	-154.5	168.7	179.9	70	0	0	0	0	113	N478 D479	S476-N478 PolarHBondContact O-N 2.79Å; S476-N478 WeakPolarHBondContact OG-CB 3.33Å; S476-N478 PolarHBondContact OG-N 2.96Å; S476-D479 PolarHBondContact N-OD2 2.99Å; S476-D479 WeakPolarHBondContact O-CB 3.44Å; S476-D479 PolarHBondContact O-N 3.34Å; S476-D479 PolarHBondContact OG-OD2 2.89Å; S476-D479 VanDerWaalsContact OG-OD2 3.1Å
477	Q	87.8	Confident	91.8	Very high	106 Å²	106	35.6 Å²	35.6	50%	0.495	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-59.7	-24.2	169.2	-162.7	68.5	16.1	0	0	112.5	D479 F480	Q477-D479 PolarHBondContact O-N 3.45Å; Q477-F480 PolarHBondContact O-N 3.04Å
478	N	87.5	Confident	92	Very high	132 Å²	132	35.4 Å²	35.4	71%	0.706	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-75.3	4.5	176.4	-64.8	-10.4	0	0	0	112.8	R446 S476	R446-N478 PolarHBondContact NH1-O 2.84Å; R446-N478 PolarHBondContact NH2-O 2.95Å; S476-N478 PolarHBondContact O-N 2.79Å; S476-N478 WeakPolarHBondContact OG-CB 3.33Å; S476-N478 PolarHBondContact OG-N 2.96Å
479	D	89.4	Confident	92	Very high	18 Å²	18	36.4 Å²	36.4	10%	0.096	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-100.4	-1.5	174.4	-62.5	-51.1	0	0	0	113.8	R446 P474 E475 S476 Q477 Y483 L500	R446-D479 IonicContact NH1-OD1 3.88Å; P474-D479 HydrophobicContact CB-CB 3.84Å; P474-D479 HydrophobicContact CG-CB 4.33Å; E475-D479 PolarHBondContact N-OD2 2.56Å; S476-D479 PolarHBondContact N-OD2 2.99Å; S476-D479 WeakPolarHBondContact O-CB 3.44Å; S476-D479 PolarHBondContact O-N 3.34Å; S476-D479 PolarHBondContact OG-OD2 2.89Å; S476-D479 VanDerWaalsContact OG-OD2 3.1Å; Q477-D479 PolarHBondContact O-N 3.45Å; D479-Y483 PolarHBondContact O-OH 3.06Å; D479-L500 WeakPolarHBondContact O-CD2 3.5Å
480	F	92.1	Very high	91.9	Very high	25 Å²	25	39.6 Å²	39.6	11%	0.11	22%	0.223	C	C	.	.			trans	-88.1	161.7	169.8	-60.1	-76.2	0	0	0	111.3	T422 R446 P474 Q477 L500 Q502	T422-F480 HydrophobicContact CG2-CE1 4.25Å; T422-F480 WeakPolarHBondContact O-CE1 3.48Å; R446-F480 PolarHBondContact NH2-O 2.72Å; P474-F480 HydrophobicContact CB-CE1 4.32Å; P474-F480 HydrophobicContact CB-CE2 4.05Å; P474-F480 HydrophobicContact CB-CZ 3.74Å; P474-F480 HydrophobicContact CG-CE1 3.87Å; P474-F480 HydrophobicContact CG-CE2 4.48Å; P474-F480 HydrophobicContact CG-CZ 3.79Å; Q477-F480 PolarHBondContact O-N 3.04Å; F480-L500 HydrophobicContact CD1-CD2 4.16Å; F480-L500 HydrophobicContact CD1-CG 4.04Å; F480-L500 HydrophobicContact CE1-CD2 4.41Å; F480-L500 HydrophobicContact CE1-CG 4.44Å; F480-Q502 HydrophobicContact CD1-CB 4.03Å; F480-Q502 HydrophobicContact CD2-CB 4.31Å; F480-Q502 HydrophobicContact CE1-CB 3.96Å; F480-Q502 HydrophobicContact CE1-CG 4.37Å; F480-Q502 HydrophobicContact CE2-CB 4.26Å; F480-Q502 HydrophobicContact CE2-CG 4.25Å; F480-Q502 HydrophobicContact CG-CB 4.22Å; F480-Q502 HydrophobicContact CZ-CB 4.09Å; F480-Q502 HydrophobicContact CZ-CG 4.07Å
481	G	90.8	Very high	91.8	Very high	28 Å²	28	41.5 Å²	41.5	29%	0.289	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	114.5	-149.8	178.9	0	0	0	0	0	114.3	Y483 I499 L500	G481-Y483 WeakPolarHBondContact O-CD2 3.15Å; G481-I499 WeakPolarHBondContact O-CA 3.12Å; G481-L500 PolarHBondContact N-O 3.02Å; G481-L500 PolarHBondContact O-N 2.78Å
482	S	92.5	Very high	91.7	Very high	33 Å²	33	40.8 Å²	40.8	23%	0.231	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	138	-170.5	175.7	0	0	0	0	113.6	N484 E497	S482-N484 PolarHBondContact OG-ND2 2.86Å; S482-E497 VanDerWaalsContact CB-OE1 3.26Å; S482-E497 WeakPolarHBondContact CB-OE1 3.47Å; S482-E497 WeakPolarHBondContact OG-CG 3.31Å; S482-E497 PolarHBondContact OG-OE1 2.73Å
483	Y	92.9	Very high	91.7	Very high	0 Å²	0	44 Å²	44	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	122.5	172.8	-73	-88	0	0	0	108.6	I430 R446 L451 L470 I472 D479 G481 F498 L500	I430-Y483 HydrophobicContact CD1-CD2 4.3Å; I430-Y483 HydrophobicContact CD1-CG 4.45Å; R446-Y483 HydrophobicContact CB-CD1 4.35Å; R446-Y483 HydrophobicContact CB-CE1 4.3Å; R446-Y483 HydrophobicContact CG-CD1 4.47Å; R446-Y483 HydrophobicContact CG-CE1 4.2Å; R446-Y483 VanDerWaalsContact NE-CZ 3.35Å; R446-Y483 PolarHBondContact NE-OH 2.81Å; R446-Y483 VanDerWaalsContact NE-OH 3.1Å; R446-Y483 PolarHBondContact NH1-OH 3.45Å; L451-Y483 HydrophobicContact CD1-CD1 4Å; L451-Y483 HydrophobicContact CD1-CE1 4.11Å; L470-Y483 HydrophobicContact CD2-CD1 3.59Å; L470-Y483 HydrophobicContact CD2-CE1 4.23Å; L470-Y483 HydrophobicContact CD2-CG 4.02Å; I472-Y483 HydrophobicContact CD1-CE1 3.94Å; I472-Y483 HydrophobicContact CD1-CE2 4.3Å; I472-Y483 WeakPolarHBondContact CD1-OH 3.22Å; D479-Y483 PolarHBondContact O-OH 3.06Å; G481-Y483 WeakPolarHBondContact O-CD2 3.15Å; Y483-F498 PolarHBondContact N-O 2.79Å; Y483-F498 PolarHBondContact O-N 2.88Å; Y483-L500 HydrophobicContact CD2-CB 4.14Å; Y483-L500 HydrophobicContact CE2-CB 3.96Å; Y483-L500 HydrophobicContact CE2-CD2 4.44Å
484	N	93.5	Very high	91.7	Very high	48 Å²	48	45.5 Å²	45.5	26%	0.257	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	115.9	-178.1	-83.1	-91.1	0	0	0	110.5	W444 F445 S482 K496	W444-N484 WeakPolarHBondContact CA-O 3.48Å; F445-N484 HydrophobicContact CB-CB 4.29Å; F445-N484 PolarHBondContact N-O 3Å; F445-N484 PolarHBondContact O-N 2.91Å; S482-N484 PolarHBondContact OG-ND2 2.86Å; N484-K496 WeakPolarHBondContact CA-O 3.17Å
485	C	94.1	Very high	91.8	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	127.6	167.2	-176.6	0	0	0	0	108.7	C432 V442 W444 S495 K496 F498	C432-C485 HydrophobicContact CB-CB 3.65Å; C432-C485 WeakPolarHBondContact CB-SG 3.29Å; C432-C485 WeakPolarHBondContact SG-CB 3.09Å; C432-C485 CovalentContact SG-SG 2.03Å; C432-C485 PolarHBondContact SG-SG 2.97Å; V442-C485 WeakPolarHBondContact CG1-SG 3.33Å; W444-C485 HydrophobicContact CD2-CB 4.13Å; W444-C485 HydrophobicContact CE3-CB 3.94Å; W444-C485 HydrophobicContact CH2-CB 3.95Å; W444-C485 HydrophobicContact CZ2-CB 4.13Å; W444-C485 HydrophobicContact CZ3-CB 3.84Å; C485-S495 CarbonylContact O-C 3.55Å; C485-S495 VanDerWaalsContact O-CA 3.3Å; C485-S495 WeakPolarHBondContact O-CA 3.1Å; C485-K496 PolarHBondContact N-O 2.82Å; C485-K496 PolarHBondContact O-N 2.84Å; C485-F498 HydrophobicContact CB-CD2 4.08Å; C485-F498 HydrophobicContact CB-CE2 3.65Å
486	T	94.2	Very high	91.9	Very high	20 Å²	20	46 Å²	46	12%	0.123	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	124.1	173.3	-60.8	0	0	0	0	109.7	V442 V443 S493 E494 S495	V442-T486 WeakPolarHBondContact CA-O 3Å; V443-T486 PolarHBondContact N-O 2.81Å; V443-T486 PolarHBondContact O-N 3.08Å; T486-S493 WeakPolarHBondContact CG2-OG 3.23Å; T486-E494 WeakPolarHBondContact CA-O 3.18Å; T486-S495 WeakPolarHBondContact CG2-OG 3.29Å; T486-S495 PolarHBondContact OG1-OG 3.33Å
487	A	94.8	Very high	92	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	130.2	177	0	0	0	0	0	109.6	P412 I414 V434 A440 S441 V442 S493 E494	P412-A487 HydrophobicContact CB-CB 3.64Å; P412-A487 HydrophobicContact CG-CB 4.24Å; P412-A487 WeakPolarHBondContact CG-O 3.42Å; I414-A487 HydrophobicContact CD1-CB 4.03Å; I414-A487 HydrophobicContact CG1-CB 4.23Å; V434-A487 HydrophobicContact CG1-CB 3.68Å; V434-A487 HydrophobicContact CG2-CB 3.97Å; A440-A487 HydrophobicContact CB-CB 4.15Å; S441-A487 WeakPolarHBondContact O-CA 3.06Å; V442-A487 HydrophobicContact CG2-CB 4.18Å; A487-S493 CarbonylContact O-C 3.58Å; A487-S493 VanDerWaalsContact O-CA 3.26Å; A487-S493 WeakPolarHBondContact O-CA 3.3Å; A487-S493 PolarHBondContact O-OG 3.35Å; A487-E494 PolarHBondContact N-O 2.87Å; A487-E494 PolarHBondContact O-N 3Å
488	T	93.4	Very high	92.2	Very high	55 Å²	55	43.7 Å²	43.7	34%	0.337	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	135.3	-176.1	-56.3	0	0	0	0	111.1	A440 S441 S493	A440-T488 CarbonylContact C-O 3.5Å; A440-T488 VanDerWaalsContact CA-O 3.22Å; A440-T488 WeakPolarHBondContact CA-O 3.24Å; A440-T488 WeakPolarHBondContact CB-O 3.48Å; S441-T488 PolarHBondContact N-O 2.9Å; S441-T488 PolarHBondContact O-N 2.69Å; S441-T488 PolarHBondContact OG-O 3.35Å; T488-S493 WeakPolarHBondContact OG1-CB 3.49Å; T488-S493 PolarHBondContact OG1-OG 2.78Å
489	N	93.2	Very high	92.4	Very high	21 Å²	21	40.5 Å²	40.5	11%	0.112	24%	0.239	C	C	.	.			trans	-130.2	-168.4	167.3	74.6	5.5	0	0	0	110.4	Y410 P412 P438 A440 I491 G492	Y410-N489 PolarHBondContact O-ND2 3.12Å; P412-N489 HydrophobicContact CG-CB 4.15Å; P438-N489 WeakPolarHBondContact O-CB 3.32Å; P438-N489 PolarHBondContact O-ND2 2.91Å; A440-N489 HydrophobicContact CB-CB 4.43Å; N489-I491 VanDerWaalsContact C-N 3.25Å; N489-I491 PolarHBondContact O-N 3.17Å; N489-I491 WeakPolarHBondContact OD1-CA 3.29Å; N489-I491 WeakPolarHBondContact OD1-CB 3.47Å; N489-I491 PolarHBondContact OD1-N 2.84Å; N489-G492 PolarHBondContact N-O 3.41Å; N489-G492 PolarHBondContact OD1-N 2.74Å; N489-G492 PolarHBondContact OD1-O 3.14Å
490	V	90.3	Very high	92.6	Very high	119 Å²	119	39.7 Å²	39.7	72%	0.721	24%	0.235	S	C	*	.	S	Bend	trans	-75.5	-8.3	-179.1	-61.1	0	0	0	0	114.6	P438	P438-V490 HydrophobicContact CG-CG2 3.81Å
491	I	89.7	Confident	92.6	Very high	40 Å²	40	41.7 Å²	41.7	21%	0.205	25%	0.246	C	C	.	.	S	Bend	trans	-98	-38.8	179.7	-50.6	-59.3	0	0	0	110.4	E316 F317 R409 N489	E316-I491 HydrophobicContact CG-CG2 4.39Å; F317-I491 HydrophobicContact CD2-CG2 4.22Å; F317-I491 HydrophobicContact CE2-CG2 3.63Å; F317-I491 HydrophobicContact CZ-CG2 4.47Å; R409-I491 HydrophobicContact CB-CD1 3.93Å; R409-I491 HydrophobicContact CB-CG1 4.08Å; N489-I491 VanDerWaalsContact C-N 3.25Å; N489-I491 PolarHBondContact O-N 3.17Å; N489-I491 WeakPolarHBondContact OD1-CA 3.29Å; N489-I491 WeakPolarHBondContact OD1-CB 3.47Å; N489-I491 PolarHBondContact OD1-N 2.84Å
492	G	90.3	Very high	92.7	Very high	25 Å²	25	43.5 Å²	43.5	26%	0.258	25%	0.247	S	C	.	.			trans	-177.2	-164.9	177.5	0	0	0	0	0	113.9	P412 N489	P412-G492 VanDerWaalsContact CD-O 3.32Å; P412-G492 WeakPolarHBondContact CD-O 3.14Å; N489-G492 PolarHBondContact N-O 3.41Å; N489-G492 PolarHBondContact OD1-N 2.74Å; N489-G492 PolarHBondContact OD1-O 3.14Å
493	S	92.3	Very high	92.7	Very high	66 Å²	66	42 Å²	42	46%	0.462	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	143.8	-179.6	-172	0	0	0	0	109.9	T486 A487 T488	T486-S493 WeakPolarHBondContact CG2-OG 3.23Å; A487-S493 CarbonylContact O-C 3.58Å; A487-S493 VanDerWaalsContact O-CA 3.26Å; A487-S493 WeakPolarHBondContact O-CA 3.3Å; A487-S493 PolarHBondContact O-OG 3.35Å; T488-S493 WeakPolarHBondContact OG1-CB 3.49Å; T488-S493 PolarHBondContact OG1-OG 2.78Å
494	E	94	Very high	92.7	Very high	64 Å²	64	48.1 Å²	48.1	30%	0.299	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	142	171.5	-171.2	177.2	108.6	0	0	109.3	P412 K413 I414 T486 A487	P412-E494 WeakPolarHBondContact O-CB 3.24Å; K413-E494 WeakPolarHBondContact CA-OE1 3.17Å; I414-E494 WeakPolarHBondContact CD1-O 3.4Å; I414-E494 HydrophobicContact CG1-CB 4.47Å; I414-E494 HydrophobicContact CG1-CG 4.43Å; I414-E494 PolarHBondContact N-OE1 3.15Å; T486-E494 WeakPolarHBondContact CA-O 3.18Å; A487-E494 PolarHBondContact N-O 2.87Å; A487-E494 PolarHBondContact O-N 3Å
495	S	93.6	Very high	92.8	Very high	72 Å²	72	48.8 Å²	48.8	50%	0.503	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	137.5	177.3	-60.4	0	0	0	0	109.7	C485 T486	C485-S495 CarbonylContact O-C 3.55Å; C485-S495 VanDerWaalsContact O-CA 3.3Å; C485-S495 WeakPolarHBondContact O-CA 3.1Å; T486-S495 WeakPolarHBondContact CG2-OG 3.29Å; T486-S495 PolarHBondContact OG1-OG 3.33Å
496	K	93.1	Very high	92.8	Very high	52 Å²	52	48.9 Å²	48.9	23%	0.226	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	134.8	179.6	-169.2	-178.9	-176	-175.3	0	110.9	I414 M415 G416 V418 N484 C485 F498	I414-K496 HydrophobicContact CB-CB 4.01Å; I414-K496 HydrophobicContact CB-CD 3.82Å; I414-K496 HydrophobicContact CD1-CB 4.02Å; I414-K496 HydrophobicContact CG2-CB 3.94Å; I414-K496 HydrophobicContact CG2-CD 3.53Å; I414-K496 HydrophobicContact CG2-CG 4.4Å; I414-K496 WeakPolarHBondContact O-CD 3.41Å; I414-K496 PolarHBondContact O-NZ 3.45Å; M415-K496 VanDerWaalsContact C-NZ 3.29Å; M415-K496 PolarHBondContact O-NZ 3.4Å; G416-K496 PolarHBondContact O-NZ 3.49Å; G416-K496 VanDerWaalsContact O-NZ 3.15Å; V418-K496 HydrophobicContact CG1-CD 4.33Å; V418-K496 VanDerWaalsContact CG1-CE 3.44Å; V418-K496 HydrophobicContact CG1-CG 4.49Å; N484-K496 WeakPolarHBondContact CA-O 3.17Å; C485-K496 PolarHBondContact N-O 2.82Å; C485-K496 PolarHBondContact O-N 2.84Å; K496-F498 HydrophobicContact CB-CE2 4.07Å; K496-F498 HydrophobicContact CD-CE2 4.2Å; K496-F498 HydrophobicContact CD-CZ 4.13Å; K496-F498 HydrophobicContact CG-CE2 4.15Å; K496-F498 WeakPolarHBondContact O-CD2 3.33Å
497	E	92.8	Very high	92.9	Very high	100 Å²	100	49.8 Å²	49.8	47%	0.467	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	138.3	176.7	-179.3	166.2	-106.5	0	0	111.6	V418 S482 I499	V418-E497 WeakPolarHBondContact CG1-O 3.48Å; S482-E497 VanDerWaalsContact CB-OE1 3.26Å; S482-E497 WeakPolarHBondContact CB-OE1 3.47Å; S482-E497 WeakPolarHBondContact OG-CG 3.31Å; S482-E497 PolarHBondContact OG-OE1 2.73Å; E497-I499 HydrophobicContact CG-CG1 4.4Å
498	F	92.4	Very high	92.9	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	145.1	171.2	-64.4	-103.4	0	0	0	108.5	I414 L417 V418 I430 S431 C432 W444 Y483 C485 K496	I414-F498 HydrophobicContact CG2-CE2 4.34Å; I414-F498 HydrophobicContact CG2-CZ 4.14Å; L417-F498 WeakPolarHBondContact O-CE1 3.45Å; V418-F498 HydrophobicContact CB-CD1 4.35Å; V418-F498 HydrophobicContact CG1-CD1 4.39Å; V418-F498 HydrophobicContact CG1-CE1 4.36Å; V418-F498 CarbonylContact O-C 3.54Å; V418-F498 VanDerWaalsContact O-CA 3.29Å; V418-F498 WeakPolarHBondContact O-CA 3.17Å; I430-F498 HydrophobicContact CG2-CB 3.56Å; I430-F498 HydrophobicContact CG2-CD1 3.38Å; I430-F498 HydrophobicContact CG2-CE1 4.26Å; I430-F498 HydrophobicContact CG2-CG 3.63Å; S431-F498 WeakPolarHBondContact O-CE1 3.25Å; C432-F498 HydrophobicContact CB-CE2 4.24Å; C432-F498 HydrophobicContact CB-CZ 4.04Å; W444-F498 HydrophobicContact CH2-CD2 4.04Å; W444-F498 HydrophobicContact CH2-CE2 4.3Å; W444-F498 HydrophobicContact CH2-CG 4.22Å; W444-F498 HydrophobicContact CZ3-CB 4.35Å; W444-F498 AromaticContact CZ3-CD2 3.88Å; W444-F498 HydrophobicContact CZ3-CD2 3.88Å; W444-F498 HydrophobicContact CZ3-CE2 4.48Å; W444-F498 HydrophobicContact CZ3-CG 4.16Å; Y483-F498 PolarHBondContact N-O 2.79Å; Y483-F498 PolarHBondContact O-N 2.88Å; C485-F498 HydrophobicContact CB-CD2 4.08Å; C485-F498 HydrophobicContact CB-CE2 3.65Å; K496-F498 HydrophobicContact CB-CE2 4.07Å; K496-F498 HydrophobicContact CD-CE2 4.2Å; K496-F498 HydrophobicContact CD-CZ 4.13Å; K496-F498 HydrophobicContact CG-CE2 4.15Å; K496-F498 WeakPolarHBondContact O-CD2 3.33Å
499	I	91.8	Very high	92.9	Very high	64 Å²	64	49.4 Å²	49.4	33%	0.328	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	118.7	-172.9	-50.4	179.3	0	0	0	109.5	V418 V419 A420 G481 E497 I501	V418-I499 PolarHBondContact O-N 2.74Å; V419-I499 WeakPolarHBondContact CA-O 3.12Å; A420-I499 PolarHBondContact N-O 3.39Å; G481-I499 WeakPolarHBondContact O-CA 3.12Å; E497-I499 HydrophobicContact CG-CG1 4.4Å; I499-I501 HydrophobicContact CG2-CD1 4.24Å; I499-I501 HydrophobicContact CG2-CG1 3.71Å
500	L	92.6	Very high	93	Very high	1 Å²	1	53 Å²	53	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	113.4	169.2	-168.5	71	0	0	0	109.4	A420 T422 A428 I430 I472 P474 D479 F480 G481 Y483	A420-L500 HydrophobicContact CB-CD1 3.89Å; T422-L500 HydrophobicContact CG2-CD1 4.1Å; T422-L500 HydrophobicContact CG2-CD2 4.4Å; A428-L500 HydrophobicContact CB-CD1 3.64Å; I430-L500 HydrophobicContact CD1-CB 4.31Å; I430-L500 HydrophobicContact CD1-CD1 4.3Å; I472-L500 HydrophobicContact CD1-CD2 4.22Å; I472-L500 HydrophobicContact CG1-CD2 4.46Å; I472-L500 HydrophobicContact CG2-CD1 4.25Å; I472-L500 HydrophobicContact CG2-CD2 3.72Å; P474-L500 HydrophobicContact CG-CD2 3.82Å; D479-L500 WeakPolarHBondContact O-CD2 3.5Å; F480-L500 HydrophobicContact CD1-CD2 4.16Å; F480-L500 HydrophobicContact CD1-CG 4.04Å; F480-L500 HydrophobicContact CE1-CD2 4.41Å; F480-L500 HydrophobicContact CE1-CG 4.44Å; G481-L500 PolarHBondContact N-O 3.02Å; G481-L500 PolarHBondContact O-N 2.78Å; Y483-L500 HydrophobicContact CD2-CB 4.14Å; Y483-L500 HydrophobicContact CE2-CB 3.96Å; Y483-L500 HydrophobicContact CE2-CD2 4.44Å
501	I	91.9	Very high	93.3	Very high	68 Å²	68	48.6 Å²	48.6	35%	0.349	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	143.3	-177.5	-58	-176.1	0	0	0	109.7	V419 A420 H421 T422 I499 A503	V419-I501 HydrophobicContact CG1-CD1 3.56Å; V419-I501 HydrophobicContact CG1-CG1 4.04Å; A420-I501 PolarHBondContact O-N 3.18Å; H421-I501 WeakPolarHBondContact CA-O 3.49Å; T422-I501 PolarHBondContact N-O 3.28Å; I499-I501 HydrophobicContact CG2-CD1 4.24Å; I499-I501 HydrophobicContact CG2-CG1 3.71Å; I501-A503 PolarHBondContact O-N 2.9Å
502	Q	93.6	Very high	93.6	Very high	65 Å²	65	51.3 Å²	51.3	30%	0.304	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	125.5	173.5	-173.2	165.5	54	0	0	110.4	T422 F480	T422-Q502 CarbonylContact O-C 3.59Å; T422-Q502 WeakPolarHBondContact O-CA 3.29Å; F480-Q502 HydrophobicContact CD1-CB 4.03Å; F480-Q502 HydrophobicContact CD2-CB 4.31Å; F480-Q502 HydrophobicContact CE1-CB 3.96Å; F480-Q502 HydrophobicContact CE1-CG 4.37Å; F480-Q502 HydrophobicContact CE2-CB 4.26Å; F480-Q502 HydrophobicContact CE2-CG 4.25Å; F480-Q502 HydrophobicContact CG-CB 4.22Å; F480-Q502 HydrophobicContact CZ-CB 4.09Å; F480-Q502 HydrophobicContact CZ-CG 4.07Å
503	A	93	Very high	93.8	Very high	2 Å²	2	55.1 Å²	55.1	2%	0.017	29%	0.288	C	S	.	.			trans	-70.9	134.6	175.5	0	0	0	0	0	111	H421 T422 W423 I501 G532 V534	H421-A503 HydrophobicContact CB-CB 4.39Å; T422-A503 PolarHBondContact O-N 2.84Å; W423-A503 HydrophobicContact CE3-CB 3.89Å; I501-A503 PolarHBondContact O-N 2.9Å; A503-G532 WeakPolarHBondContact CA-O 3.48Å; A503-V534 HydrophobicContact CB-CG1 3.92Å; A503-V534 HydrophobicContact CB-CG2 4.11Å
504	E	92.9	Very high	93.9	Very high	129 Å²	129	52.6 Å²	52.6	60%	0.603	27%	0.27	S	S	*	.			trans	-98.3	174	176.4	-59	-175.1	149.8	0	0	110.4	G532 N585	E504-G532 PolarHBondContact N-O 3.16Å; E504-N585 PolarHBondContact O-ND2 2.59Å
505	V	94.4	Very high	93.9	Very high	61 Å²	61	52.3 Å²	52.3	37%	0.37	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-79.2	160.2	163.8	-64	0	0	0	0	109.9	K587	V505-K587 HydrophobicContact CG1-CG 4.09Å
506	P	95.2	Very high	93.8	Very high	3 Å²	3	51 Å²	51	2%	0.019	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-65.1	156.5	-179.9	-21.4	35.4	0	0	0	112.7	P528 S530 I536 A583 N585 G590	P506-P528 HydrophobicContact CB-CB 4.11Å; P506-P528 HydrophobicContact CB-CG 4.05Å; P506-S530 WeakPolarHBondContact CA-O 3.46Å; P506-I536 HydrophobicContact CB-CD1 3.75Å; P506-I536 HydrophobicContact CG-CD1 3.45Å; P506-I536 VanDerWaalsContact CG-CD1 3.45Å; P506-A583 HydrophobicContact CB-CB 3.88Å; P506-A583 HydrophobicContact CG-CB 4.11Å; P506-N585 HydrophobicContact CG-CB 3.8Å; P506-G590 WeakPolarHBondContact O-CA 3.42Å
507	S	95.1	Very high	93.6	Very high	38 Å²	38	52.3 Å²	52.3	27%	0.266	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-66.4	164.3	164.3	66.8	0	0	0	0	111	P528 N529 S530	S507-P528 WeakPolarHBondContact O-CB 3.48Å; S507-P528 WeakPolarHBondContact O-CG 3.26Å; S507-P528 WeakPolarHBondContact OG-CA 3.45Å; S507-P528 WeakPolarHBondContact OG-CB 3.43Å; S507-N529 PolarHBondContact OG-N 2.8Å; S507-N529 VanDerWaalsContact OG-N 3.15Å; S507-S530 PolarHBondContact N-O 2.99Å; S507-S530 PolarHBondContact OG-N 2.84Å; S507-S530 VanDerWaalsContact OG-N 3.09Å; S507-S530 PolarHBondContact OG-O 2.84Å
508	S	94.7	Very high	93.2	Very high	44 Å²	44	47.8 Å²	47.8	31%	0.308	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-63.5	135.7	175.1	37.9	0	0	0	0	112.1	E591 S592	S508-E591 WeakPolarHBondContact CA-O 3.27Å; S508-E591 WeakPolarHBondContact CB-O 3.44Å; S508-S592 WeakPolarHBondContact CB-O 3.48Å
509	P	94.9	Very high	92.9	Very high	3 Å²	3	49.6 Å²	49.6	2%	0.019	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-65.4	157.7	166.7	-17.7	30.5	0	0	0	111.6	F525 P528 Y539 M581 A583 S593	P509-F525 HydrophobicContact CB-CD2 4.38Å; P509-P528 HydrophobicContact CG-CG 4.17Å; P509-Y539 HydrophobicContact CG-CD1 4.16Å; P509-Y539 HydrophobicContact CG-CE1 4.07Å; P509-M581 HydrophobicContact CB-CE 4.09Å; P509-M581 HydrophobicContact CB-CG 4.12Å; P509-M581 HydrophobicContact CB-SD 4.34Å; P509-M581 HydrophobicContact CG-CE 4.25Å; P509-M581 HydrophobicContact CG-CG 4.31Å; P509-A583 HydrophobicContact CG-CB 4.01Å; P509-S593 WeakPolarHBondContact O-CB 3.25Å
510	K	94.8	Very high	92.8	Very high	96 Å²	96	48.3 Å²	48.3	42%	0.417	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	116.4	178.1	-170.6	175.1	137	-82.7	0	109.2	E512 F525 E526	K510-E512 WeakPolarHBondContact CE-OE1 3.36Å; K510-E512 VanDerWaalsContact CG-OE1 3.3Å; K510-E512 WeakPolarHBondContact CG-OE1 3.41Å; K510-E512 IonicContact NZ-OE1 3.04Å; K510-E512 PolarHBondContact NZ-OE1 3.41Å; K510-E512 IonicContact NZ-OE2 2.69Å; K510-E512 PolarHBondContact NZ-OE2 2.98Å; K510-F525 CarbonylContact O-C 3.54Å; K510-F525 WeakPolarHBondContact O-CA 3.44Å; K510-F525 VanDerWaalsContact O-CB 3.25Å; K510-F525 WeakPolarHBondContact O-CB 3.46Å; K510-E526 HydrophobicContact CB-CB 4.26Å; K510-E526 WeakPolarHBondContact CD-OE2 3.23Å; K510-E526 PolarHBondContact N-O 3.33Å; K510-E526 VanDerWaalsContact N-O 3.15Å; K510-E526 IonicContact NZ-OE1 2.59Å; K510-E526 PolarHBondContact NZ-OE1 3.47Å; K510-E526 IonicContact NZ-OE2 2.79Å; K510-E526 PolarHBondContact NZ-OE2 2.77Å; K510-E526 PolarHBondContact O-N 2.87Å
511	I	96.2	Very high	92.8	Very high	27 Å²	27	48.3 Å²	48.3	14%	0.138	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	121.6	174.2	-62.8	174.3	0	0	0	107.8	V514 V523 M581 S593	I511-V514 HydrophobicContact CG2-CG2 3.75Å; I511-V523 HydrophobicContact CD1-CG1 4.09Å; I511-V523 HydrophobicContact CG1-CG1 3.95Å; I511-V523 HydrophobicContact CG2-CG1 3.89Å; I511-M581 HydrophobicContact CD1-CG 4.09Å; I511-M581 HydrophobicContact CD1-SD 4.35Å; I511-M581 HydrophobicContact CG1-CG 3.94Å; I511-M581 HydrophobicContact CG1-SD 3.81Å; I511-S593 WeakPolarHBondContact CD1-OG 3.35Å
512	E	95.4	Very high	92.9	Very high	98 Å²	98	46 Å²	46	46%	0.458	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-55	175.1	-59.9	-42.2	105.3	0	0	110.7	K510 E524 E526	K510-E512 WeakPolarHBondContact CE-OE1 3.36Å; K510-E512 VanDerWaalsContact CG-OE1 3.3Å; K510-E512 WeakPolarHBondContact CG-OE1 3.41Å; K510-E512 IonicContact NZ-OE1 3.04Å; K510-E512 PolarHBondContact NZ-OE1 3.41Å; K510-E512 IonicContact NZ-OE2 2.69Å; K510-E512 PolarHBondContact NZ-OE2 2.98Å; E512-E524 PolarHBondContact N-O 3.43Å; E512-E526 HydrophobicContact CG-CG 4.22Å
513	E	94.6	Very high	93	Very high	104 Å²	104	43 Å²	43	49%	0.486	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	152	-175	-168.8	173	-137	0	0	110.7	Q515 E524	E513-Q515 HydrophobicContact CG-CG 4.03Å; E513-Q515 VanDerWaalsContact OE2-CG 3.26Å; E513-Q515 WeakPolarHBondContact OE2-CG 3.32Å; E513-Q515 PolarHBondContact OE2-NE2 2.83Å; E513-E524 PolarHBondContact N-O 3.1Å; E513-E524 PolarHBondContact O-N 2.76Å
514	V	96	Very high	93.1	Very high	13 Å²	13	44.9 Å²	44.9	8%	0.079	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	97	166.3	-173.2	0	0	0	0	107.8	I511 P516 A521 V522 V523 V579 F598	I511-V514 HydrophobicContact CG2-CG2 3.75Å; V514-P516 VanDerWaalsContact O-CD 3.24Å; V514-P516 WeakPolarHBondContact O-CD 3.47Å; V514-A521 HydrophobicContact CG1-CB 4.04Å; V514-V522 CarbonylContact C-O 3.52Å; V514-V522 WeakPolarHBondContact CA-O 3.37Å; V514-V523 HydrophobicContact CG1-CG2 4.27Å; V514-V523 HydrophobicContact CG2-CG1 4.46Å; V514-V523 HydrophobicContact CG2-CG2 4.44Å; V514-V579 HydrophobicContact CG1-CG1 4.35Å; V514-V579 HydrophobicContact CG2-CG1 3.77Å; V514-F598 HydrophobicContact CB-CB 4.32Å; V514-F598 HydrophobicContact CB-CD1 4.3Å; V514-F598 HydrophobicContact CB-CG 4.38Å; V514-F598 HydrophobicContact CG1-CB 4.18Å; V514-F598 HydrophobicContact CG1-CD1 3.59Å; V514-F598 HydrophobicContact CG1-CD2 4.19Å; V514-F598 HydrophobicContact CG1-CE1 3.92Å; V514-F598 HydrophobicContact CG1-CE2 4.48Å; V514-F598 HydrophobicContact CG1-CG 3.72Å; V514-F598 HydrophobicContact CG1-CZ 4.35Å
515	Q	93.3	Very high	93.2	Very high	58 Å²	58	39 Å²	39	27%	0.271	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	110.6	178.8	-68.5	166.8	12.7	0	0	108.5	E513 F517 A521 V522 E524	E513-Q515 HydrophobicContact CG-CG 4.03Å; E513-Q515 VanDerWaalsContact OE2-CG 3.26Å; E513-Q515 WeakPolarHBondContact OE2-CG 3.32Å; E513-Q515 PolarHBondContact OE2-NE2 2.83Å; Q515-F517 HydrophobicContact CB-CE2 4.36Å; Q515-A521 WeakPolarHBondContact O-CA 3.37Å; Q515-V522 HydrophobicContact CB-CB 4.39Å; Q515-V522 PolarHBondContact N-O 2.76Å; Q515-V522 PolarHBondContact O-N 3.03Å; Q515-E524 PolarHBondContact NE2-OE1 2.89Å
516	P	91.9	Very high	93.2	Very high	46 Å²	46	40.3 Å²	40.3	30%	0.299	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	142.3	-176.7	33.9	-32	0	0	0	110.3	V514 F598 K599 E601	V514-P516 VanDerWaalsContact O-CD 3.24Å; V514-P516 WeakPolarHBondContact O-CD 3.47Å; P516-F598 HydrophobicContact CB-CD2 4.15Å; P516-K599 WeakPolarHBondContact CB-O 3.33Å; P516-E601 HydrophobicContact CG-CG 4.46Å
517	F	87.6	Confident	93	Very high	78 Å²	78	42.6 Å²	42.6	34%	0.342	22%	0.22	S	C	.	.			trans	-123.4	-178.5	161.1	-58.6	-87	0	0	0	108.1	Q515 T520 V522 T600 E601	Q515-F517 HydrophobicContact CB-CE2 4.36Å; F517-T520 CarbonylContact C-O 3.55Å; F517-T520 WeakPolarHBondContact CA-O 3.5Å; F517-T520 WeakPolarHBondContact CB-O 3.07Å; F517-T520 WeakPolarHBondContact CB-OG1 3.41Å; F517-T520 PolarHBondContact N-O 2.88Å; F517-V522 HydrophobicContact CE2-CB 4.45Å; F517-V522 HydrophobicContact CE2-CG2 3.9Å; F517-T600 WeakPolarHBondContact O-CA 3.41Å; F517-T600 WeakPolarHBondContact O-CB 3.46Å; F517-T600 VanDerWaalsContact O-CG2 3.32Å; F517-T600 WeakPolarHBondContact O-CG2 3.32Å; F517-E601 PolarHBondContact O-N 3.04Å; F517-E601 VanDerWaalsContact O-N 3.16Å
518	S	85.5	Confident	92.9	Very high	6 Å²	6	41.1 Å²	41.1	4%	0.042	21%	0.21	C	C	.	.	S	Bend	trans	-79	-19.5	-173.8	26.9	0	0	0	0	114.6	K572 P573 E601 P602 G632 G633	S518-K572 CarbonylContact O-C 3.51Å; S518-P573 WeakPolarHBondContact O-CA 3.47Å; S518-P573 WeakPolarHBondContact O-CD 3.37Å; S518-P573 VanDerWaalsContact O-CG 3.26Å; S518-P573 WeakPolarHBondContact O-CG 3.49Å; S518-P573 VanDerWaalsContact O-N 3.11Å; S518-E601 WeakPolarHBondContact CA-O 3.38Å; S518-E601 WeakPolarHBondContact CB-O 3.29Å; S518-P602 WeakPolarHBondContact CB-O 3.18Å; S518-G632 PolarHBondContact OG-O 2.83Å; S518-G633 VanDerWaalsContact OG-CA 3.3Å; S518-G633 WeakPolarHBondContact OG-CA 3.28Å
519	S	85.8	Confident	92.7	Very high	37 Å²	37	46.6 Å²	46.6	26%	0.259	24%	0.235	S	C	.	.	S	Bend	trans	-137.1	1.8	172.1	69.4	0	0	0	0	115	G570 L571	S519-G570 PolarHBondContact O-N 2.73Å; S519-G570 VanDerWaalsContact O-N 3.09Å; S519-L571 PolarHBondContact O-N 3.32Å
520	T	89.2	Confident	92.5	Very high	38 Å²	38	48.9 Å²	48.9	23%	0.233	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	170.3	179.7	60.7	0	0	0	0	109.9	F517 I568 V569	F517-T520 CarbonylContact C-O 3.55Å; F517-T520 WeakPolarHBondContact CA-O 3.5Å; F517-T520 WeakPolarHBondContact CB-O 3.07Å; F517-T520 WeakPolarHBondContact CB-OG1 3.41Å; F517-T520 PolarHBondContact N-O 2.88Å; T520-I568 CarbonylContact C-O 3.52Å; T520-I568 WeakPolarHBondContact CA-O 3.37Å; T520-I568 VanDerWaalsContact CB-O 3.24Å; T520-I568 WeakPolarHBondContact CB-O 3.28Å; T520-V569 HydrophobicContact CG2-CB 4.3Å; T520-V569 HydrophobicContact CG2-CG1 3.93Å
521	A	92.1	Very high	92.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	143.2	166.1	0	0	0	0	0	109.2	V514 Q515 T567 I568 L571 F598	V514-A521 HydrophobicContact CG1-CB 4.04Å; Q515-A521 WeakPolarHBondContact O-CA 3.37Å; A521-T567 CarbonylContact O-C 3.57Å; A521-T567 WeakPolarHBondContact O-CA 3.32Å; A521-I568 PolarHBondContact N-O 2.66Å; A521-I568 PolarHBondContact O-N 3.45Å; A521-L571 HydrophobicContact CB-CD1 3.82Å; A521-F598 HydrophobicContact CB-CD2 4.24Å; A521-F598 HydrophobicContact CB-CE2 3.53Å; A521-F598 HydrophobicContact CB-CZ 3.77Å
522	V	94.3	Very high	91.9	Very high	21 Å²	21	46.8 Å²	46.8	13%	0.127	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	119.8	173.1	176.7	0	0	0	0	108	V514 Q515 F517 E524 R565 T567	V514-V522 CarbonylContact C-O 3.52Å; V514-V522 WeakPolarHBondContact CA-O 3.37Å; Q515-V522 HydrophobicContact CB-CB 4.39Å; Q515-V522 PolarHBondContact N-O 2.76Å; Q515-V522 PolarHBondContact O-N 3.03Å; F517-V522 HydrophobicContact CE2-CB 4.45Å; F517-V522 HydrophobicContact CE2-CG2 3.9Å; V522-E524 HydrophobicContact CG1-CG 4.11Å; V522-R565 HydrophobicContact CG1-CB 4.27Å; V522-T567 HydrophobicContact CG2-CG2 4.18Å
523	V	96.1	Very high	91.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	118.2	172.9	-176.1	0	0	0	0	107.2	I511 V514 R565 I566 I568 V579 M581	I511-V523 HydrophobicContact CD1-CG1 4.09Å; I511-V523 HydrophobicContact CG1-CG1 3.95Å; I511-V523 HydrophobicContact CG2-CG1 3.89Å; V514-V523 HydrophobicContact CG1-CG2 4.27Å; V514-V523 HydrophobicContact CG2-CG1 4.46Å; V514-V523 HydrophobicContact CG2-CG2 4.44Å; V523-R565 CarbonylContact O-C 3.43Å; V523-R565 VanDerWaalsContact O-CA 3.3Å; V523-R565 WeakPolarHBondContact O-CA 3.29Å; V523-I566 PolarHBondContact N-O 2.8Å; V523-I566 PolarHBondContact O-N 2.67Å; V523-I568 HydrophobicContact CG2-CD1 3.75Å; V523-I568 HydrophobicContact CG2-CG1 4.17Å; V523-V579 HydrophobicContact CG2-CG2 4.08Å; V523-M581 HydrophobicContact CG1-SD 4.12Å
524	E	95.8	Very high	91.3	Very high	42 Å²	42	39.9 Å²	39.9	20%	0.196	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	135.1	171.9	-57.6	-160	168.8	0	0	109.5	E512 E513 Q515 V522 T564 R565	E512-E524 PolarHBondContact N-O 3.43Å; E513-E524 PolarHBondContact N-O 3.1Å; E513-E524 PolarHBondContact O-N 2.76Å; Q515-E524 PolarHBondContact NE2-OE1 2.89Å; V522-E524 HydrophobicContact CG1-CG 4.11Å; E524-T564 WeakPolarHBondContact CA-O 3.43Å; E524-R565 HydrophobicContact CG-CB 4.47Å; E524-R565 IonicContact OE1-CZ 3.24Å; E524-R565 IonicContact OE1-NH1 2.67Å; E524-R565 PolarHBondContact OE1-NH1 2.92Å; E524-R565 IonicContact OE1-NH2 2.77Å; E524-R565 PolarHBondContact OE1-NH2 2.93Å; E524-R565 IonicContact OE2-NH2 2.85Å; E524-R565 PolarHBondContact OE2-NH2 2.85Å
525	F	94.9	Very high	91	Very high	7 Å²	7	43.6 Å²	43.6	3%	0.031	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	153.1	-167.5	67.6	-84.7	0	0	0	113.9	P509 K510 Y539 M563 T564 I566 M581	P509-F525 HydrophobicContact CB-CD2 4.38Å; K510-F525 CarbonylContact O-C 3.54Å; K510-F525 WeakPolarHBondContact O-CA 3.44Å; K510-F525 VanDerWaalsContact O-CB 3.25Å; K510-F525 WeakPolarHBondContact O-CB 3.46Å; F525-Y539 HydrophobicContact CE2-CD1 4.11Å; F525-Y539 HydrophobicContact CE2-CD2 4.45Å; F525-Y539 AromaticContact CE2-CE1 3.75Å; F525-Y539 HydrophobicContact CE2-CE1 3.75Å; F525-Y539 HydrophobicContact CE2-CE2 4.13Å; F525-Y539 HydrophobicContact CE2-CG 4.44Å; F525-Y539 AromaticContact CE2-CZ 3.75Å; F525-Y539 HydrophobicContact CZ-CD1 4.47Å; F525-Y539 HydrophobicContact CZ-CD2 4.23Å; F525-Y539 HydrophobicContact CZ-CE1 4.43Å; F525-Y539 HydrophobicContact CZ-CE2 4.2Å; F525-Y539 HydrophobicContact CZ-CG 4.37Å; F525-M563 WeakPolarHBondContact CE2-O 3.4Å; F525-M563 HydrophobicContact CZ-CB 4.19Å; F525-M563 HydrophobicContact CZ-CG 4.04Å; F525-M563 WeakPolarHBondContact CZ-O 3.45Å; F525-M563 HydrophobicContact CZ-SD 4.43Å; F525-T564 PolarHBondContact N-O 3.11Å; F525-I566 HydrophobicContact CE1-CB 4.34Å; F525-I566 HydrophobicContact CE1-CD1 3.72Å; F525-I566 HydrophobicContact CE1-CG1 3.82Å; F525-I566 HydrophobicContact CZ-CD1 3.89Å; F525-I566 HydrophobicContact CZ-CG1 4.32Å; F525-M581 HydrophobicContact CB-CE 4.31Å; F525-M581 HydrophobicContact CB-SD 3.79Å; F525-M581 HydrophobicContact CD1-CE 3.72Å; F525-M581 HydrophobicContact CD1-SD 3.91Å; F525-M581 HydrophobicContact CD2-CE 3.45Å; F525-M581 VanDerWaalsContact CD2-CE 3.45Å; F525-M581 HydrophobicContact CD2-SD 4.09Å; F525-M581 HydrophobicContact CE1-CE 3.79Å; F525-M581 HydrophobicContact CE2-CE 3.52Å; F525-M581 HydrophobicContact CG-CE 3.55Å; F525-M581 HydrophobicContact CG-SD 3.66Å; F525-M581 HydrophobicContact CZ-CE 3.69Å
526	E	93.7	Very high	90.9	Very high	87 Å²	87	42 Å²	42	41%	0.407	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	142.3	164.4	-64	171.1	178.3	0	0	110.7	K510 E512	K510-E526 HydrophobicContact CB-CB 4.26Å; K510-E526 WeakPolarHBondContact CD-OE2 3.23Å; K510-E526 PolarHBondContact N-O 3.33Å; K510-E526 VanDerWaalsContact N-O 3.15Å; K510-E526 IonicContact NZ-OE1 2.59Å; K510-E526 PolarHBondContact NZ-OE1 3.47Å; K510-E526 IonicContact NZ-OE2 2.79Å; K510-E526 PolarHBondContact NZ-OE2 2.77Å; K510-E526 PolarHBondContact O-N 2.87Å; E512-E526 HydrophobicContact CG-CG 4.22Å
527	E	91.3	Very high	90.9	Very high	52 Å²	52	44.3 Å²	44.3	24%	0.243	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-69.6	162.4	178	-59	-158.4	121.2	0	0	112.7	N529 Y539 H562 M563	E527-N529 PolarHBondContact O-N 2.89Å; E527-Y539 VanDerWaalsContact CD-OH 3.28Å; E527-Y539 VanDerWaalsContact CG-OH 3.3Å; E527-Y539 WeakPolarHBondContact CG-OH 3.35Å; E527-Y539 PolarHBondContact OE1-OH 3.03Å; E527-H562 IonicContact OE2-CE1 2.86Å; E527-H562 IonicContact OE2-CG 2.85Å; E527-H562 IonicContact OE2-ND1 3.18Å; E527-H562 PolarHBondContact OE2-ND1 2.87Å; E527-M563 PolarHBondContact OE1-N 3.05Å
528	P	92.4	Very high	91.2	Very high	7 Å²	7	44.1 Å²	44.1	5%	0.045	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-55.1	125.7	176.9	-29.1	37.5	0	0	0	114.3	P506 S507 P509 S530 L531 I536 A583	P506-P528 HydrophobicContact CB-CB 4.11Å; P506-P528 HydrophobicContact CB-CG 4.05Å; S507-P528 WeakPolarHBondContact O-CB 3.48Å; S507-P528 WeakPolarHBondContact O-CG 3.26Å; S507-P528 WeakPolarHBondContact OG-CA 3.45Å; S507-P528 WeakPolarHBondContact OG-CB 3.43Å; P509-P528 HydrophobicContact CG-CG 4.17Å; P528-S530 VanDerWaalsContact CB-O 3.32Å; P528-S530 WeakPolarHBondContact CB-O 3.42Å; P528-S530 PolarHBondContact O-N 2.77Å; P528-L531 HydrophobicContact CB-CD2 4.34Å; P528-I536 HydrophobicContact CG-CD1 4.36Å; P528-A583 HydrophobicContact CG-CB 3.48Å; P528-A583 VanDerWaalsContact CG-CB 3.48Å
529	N	89.9	Confident	91.7	Very high	158 Å²	158	43.8 Å²	43.8	85%	0.845	25%	0.249	S	C	*	.	S	Bend	trans	-58.7	-25	171.9	-73.5	-56.8	0	0	0	113.5	S507 E527	S507-N529 PolarHBondContact OG-N 2.8Å; S507-N529 VanDerWaalsContact OG-N 3.15Å; E527-N529 PolarHBondContact O-N 2.89Å
530	S	91.4	Very high	92.2	Very high	52 Å²	52	44 Å²	44	36%	0.364	24%	0.244	S	C	.	.			trans	-126.3	129.3	165.9	177.9	0	0	0	0	110	P506 S507 P528 G532	P506-S530 WeakPolarHBondContact CA-O 3.46Å; S507-S530 PolarHBondContact N-O 2.99Å; S507-S530 PolarHBondContact OG-N 2.84Å; S507-S530 VanDerWaalsContact OG-N 3.09Å; S507-S530 PolarHBondContact OG-O 2.84Å; P528-S530 VanDerWaalsContact CB-O 3.32Å; P528-S530 WeakPolarHBondContact CB-O 3.42Å; P528-S530 PolarHBondContact O-N 2.77Å; S530-G532 VanDerWaalsContact C-N 3.27Å; S530-G532 PolarHBondContact OG-N 2.93Å
531	L	90.8	Very high	92.6	Very high	74 Å²	74	42.2 Å²	42.2	39%	0.387	23%	0.233	S	C	.	.			trans	-83.6	-3.8	173.6	-44.7	-173.1	0	0	0	112.3	P528 G533 I536 N585	P528-L531 HydrophobicContact CB-CD2 4.34Å; L531-G533 VanDerWaalsContact C-N 3.3Å; L531-I536 HydrophobicContact CB-CD1 4.19Å; L531-I536 HydrophobicContact CD2-CD1 3.98Å; L531-I536 HydrophobicContact CD2-CG1 3.93Å; L531-N585 PolarHBondContact O-ND2 2.88Å
532	G	88.3	Confident	92.8	Very high	5 Å²	5	43.8 Å²	43.8	5%	0.052	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	18.4	-171	0	0	0	0	0	114.2	A503 E504 S530 V534	A503-G532 WeakPolarHBondContact CA-O 3.48Å; E504-G532 PolarHBondContact N-O 3.16Å; S530-G532 VanDerWaalsContact C-N 3.27Å; S530-G532 PolarHBondContact OG-N 2.93Å; G532-V534 VanDerWaalsContact C-N 3.32Å; G532-V534 PolarHBondContact O-N 3.28Å
533	G	86.5	Confident	92.9	Very high	37 Å²	37	44.1 Å²	44.1	38%	0.381	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.2	-9.2	179.4	0	0	0	0	0	115.7	H421 L531	H421-G533 WeakPolarHBondContact CB-O 3.47Å; L531-G533 VanDerWaalsContact C-N 3.3Å
534	V	89.4	Confident	92.9	Very high	19 Å²	19	47.2 Å²	47.2	12%	0.115	25%	0.251	C	S	.	.	S	Bend	trans	-132.2	147.5	178.9	-62.8	0	0	0	0	110.7	H421 W423 A503 G532 N585	H421-V534 HydrophobicContact CB-CG1 3.93Å; W423-V534 HydrophobicContact CZ3-CG1 4.25Å; W423-V534 HydrophobicContact CZ3-CG2 4.18Å; A503-V534 HydrophobicContact CB-CG1 3.92Å; A503-V534 HydrophobicContact CB-CG2 4.11Å; G532-V534 VanDerWaalsContact C-N 3.32Å; G532-V534 PolarHBondContact O-N 3.28Å; V534-N585 HydrophobicContact CG2-CB 4.07Å; V534-N585 WeakPolarHBondContact CG2-ND2 3.37Å
535	P	90.3	Very high	92.7	Very high	92 Å²	92	48.3 Å²	48.3	60%	0.597	26%	0.258	S	S	*	.			trans	-66.6	151.8	-166.6	25.2	-35.1	0	0	0	114.3	N585	P535-N585 WeakPolarHBondContact O-CA 3.48Å; P535-N585 VanDerWaalsContact O-CB 3.29Å; P535-N585 WeakPolarHBondContact O-CB 3.4Å
536	I	91.6	Very high	92.4	Very high	24 Å²	24	51.2 Å²	51.2	12%	0.123	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	132	174.5	-48.8	-54.2	0	0	0	109.5	P506 P528 L531 K538 Y539 A557 A583 N585	P506-I536 HydrophobicContact CB-CD1 3.75Å; P506-I536 HydrophobicContact CG-CD1 3.45Å; P506-I536 VanDerWaalsContact CG-CD1 3.45Å; P528-I536 HydrophobicContact CG-CD1 4.36Å; L531-I536 HydrophobicContact CB-CD1 4.19Å; L531-I536 HydrophobicContact CD2-CD1 3.98Å; L531-I536 HydrophobicContact CD2-CG1 3.93Å; I536-K538 WeakPolarHBondContact CG2-O 3.24Å; I536-Y539 HydrophobicContact CG2-CE1 4.39Å; I536-Y539 HydrophobicContact CG2-CE2 4.08Å; I536-A557 HydrophobicContact CG2-CB 4.5Å; I536-A583 HydrophobicContact CD1-CB 4.24Å; I536-A583 HydrophobicContact CG2-CB 4.25Å; I536-N585 HydrophobicContact CD1-CB 4.37Å
537	L	92.4	Very high	91.8	Very high	94 Å²	94	50.3 Å²	50.3	49%	0.492	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-31.9	178.2	-56.5	179.7	0	0	0	111.8	A557 I584	L537-A557 PolarHBondContact O-N 2.9Å; L537-I584 PolarHBondContact N-O 3.37Å
538	K	94.4	Very high	91.9	Very high	74 Å²	74	54.4 Å²	54.4	32%	0.322	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	161.9	-176.6	-52.5	175.8	-175.3	171.6	0	112.2	I536 E554 Y555 I584	I536-K538 WeakPolarHBondContact CG2-O 3.24Å; K538-E554 HydrophobicContact CD-CB 4.35Å; K538-E554 HydrophobicContact CD-CG 4.48Å; K538-E554 VanDerWaalsContact CD-OE2 3.24Å; K538-E554 WeakPolarHBondContact CD-OE2 3.4Å; K538-E554 WeakPolarHBondContact CE-OE2 3.41Å; K538-E554 IonicContact NZ-OE2 2.7Å; K538-E554 PolarHBondContact NZ-OE2 3.05Å; K538-Y555 CarbonylContact C-O 3.51Å; K538-Y555 WeakPolarHBondContact CA-O 3.26Å; K538-Y555 VanDerWaalsContact CB-O 3.28Å; K538-Y555 WeakPolarHBondContact CB-O 3.37Å; K538-I584 HydrophobicContact CB-CB 4.17Å; K538-I584 HydrophobicContact CB-CD1 4.31Å; K538-I584 HydrophobicContact CB-CG1 4.45Å; K538-I584 HydrophobicContact CD-CD1 4.46Å; K538-I584 PolarHBondContact N-O 3.08Å; K538-I584 VanDerWaalsContact N-O 3.1Å; K538-I584 PolarHBondContact O-N 2.85Å
539	Y	95.3	Very high	92	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	136.3	159.9	-66.3	-83.6	0	0	0	110	P509 F525 E527 I536 E554 Y555 M563 I566 M581 S582 A583	P509-Y539 HydrophobicContact CG-CD1 4.16Å; P509-Y539 HydrophobicContact CG-CE1 4.07Å; F525-Y539 HydrophobicContact CE2-CD1 4.11Å; F525-Y539 HydrophobicContact CE2-CD2 4.45Å; F525-Y539 AromaticContact CE2-CE1 3.75Å; F525-Y539 HydrophobicContact CE2-CE1 3.75Å; F525-Y539 HydrophobicContact CE2-CE2 4.13Å; F525-Y539 HydrophobicContact CE2-CG 4.44Å; F525-Y539 AromaticContact CE2-CZ 3.75Å; F525-Y539 HydrophobicContact CZ-CD1 4.47Å; F525-Y539 HydrophobicContact CZ-CD2 4.23Å; F525-Y539 HydrophobicContact CZ-CE1 4.43Å; F525-Y539 HydrophobicContact CZ-CE2 4.2Å; F525-Y539 HydrophobicContact CZ-CG 4.37Å; E527-Y539 VanDerWaalsContact CD-OH 3.28Å; E527-Y539 VanDerWaalsContact CG-OH 3.3Å; E527-Y539 WeakPolarHBondContact CG-OH 3.35Å; E527-Y539 PolarHBondContact OE1-OH 3.03Å; I536-Y539 HydrophobicContact CG2-CE1 4.39Å; I536-Y539 HydrophobicContact CG2-CE2 4.08Å; Y539-E554 WeakPolarHBondContact O-CA 3.36Å; Y539-Y555 PolarHBondContact N-O 3.14Å; Y539-Y555 PolarHBondContact O-N 3.45Å; Y539-M563 HydrophobicContact CD2-CB 4.4Å; Y539-M563 HydrophobicContact CD2-SD 3.72Å; Y539-M563 HydrophobicContact CE2-CB 3.85Å; Y539-M563 HydrophobicContact CE2-SD 4.15Å; Y539-I566 HydrophobicContact CG-CD1 4.29Å; Y539-M581 HydrophobicContact CD1-CE 3.74Å; Y539-M581 HydrophobicContact CE1-CE 4.39Å; Y539-M581 HydrophobicContact CG-CE 4.19Å; Y539-S582 CarbonylContact C-O 3.59Å; Y539-S582 WeakPolarHBondContact CA-O 3.45Å; Y539-A583 HydrophobicContact CD1-CB 3.83Å; Y539-A583 HydrophobicContact CE1-CB 3.67Å
540	R	96.3	Very high	92.3	Very high	42 Å²	42	58.6 Å²	58.6	16%	0.158	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	124.7	165.5	-176.1	-173.4	-51.6	-61.3	-11.8	108	E542 E554 M581 S582 I584 E589	R540-E542 HydrophobicContact CG-CG 3.97Å; R540-E554 HydrophobicContact CB-CG 4.5Å; R540-E554 IonicContact CZ-OE1 3.03Å; R540-E554 VanDerWaalsContact CZ-OE1 3.24Å; R540-E554 IonicContact NH1-OE1 2.88Å; R540-E554 PolarHBondContact NH1-OE1 2.8Å; R540-E554 IonicContact NH2-OE1 2.74Å; R540-E554 PolarHBondContact NH2-OE1 2.91Å; R540-M581 CarbonylContact O-C 3.38Å; R540-M581 WeakPolarHBondContact O-CA 3.5Å; R540-M581 WeakPolarHBondContact O-CB 3.41Å; R540-S582 PolarHBondContact N-O 2.78Å; R540-S582 PolarHBondContact O-N 3.27Å; R540-I584 HydrophobicContact CB-CD1 4.31Å; R540-E589 VanDerWaalsContact CD-OE1 3.29Å; R540-E589 WeakPolarHBondContact CD-OE1 3.44Å; R540-E589 IonicContact CZ-OE1 3.37Å; R540-E589 IonicContact CZ-OE2 2.76Å; R540-E589 VanDerWaalsContact NE-CD 3.26Å; R540-E589 IonicContact NE-OE1 3.75Å; R540-E589 PolarHBondContact NE-OE1 2.85Å; R540-E589 IonicContact NE-OE2 3.09Å; R540-E589 PolarHBondContact NE-OE2 2.82Å; R540-E589 IonicContact NH2-OE2 2.65Å; R540-E589 PolarHBondContact NH2-OE2 3.19Å
541	V	96.8	Very high	92.4	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	132.7	169.6	-178.6	0	0	0	0	108.6	S552 K553 Y555 I566 I568 V579 M581	V541-S552 CarbonylContact O-C 3.54Å; V541-S552 WeakPolarHBondContact O-CA 3.49Å; V541-K553 PolarHBondContact N-O 3.24Å; V541-K553 PolarHBondContact O-N 2.84Å; V541-Y555 HydrophobicContact CB-CE2 4.13Å; V541-Y555 HydrophobicContact CG2-CD2 4.28Å; V541-Y555 HydrophobicContact CG2-CE2 4.26Å; V541-I566 HydrophobicContact CB-CG2 4.43Å; V541-I566 HydrophobicContact CG2-CB 4.24Å; V541-I566 HydrophobicContact CG2-CD1 3.76Å; V541-I566 HydrophobicContact CG2-CG2 3.69Å; V541-I568 HydrophobicContact CG1-CD1 3.75Å; V541-I568 HydrophobicContact CG1-CG1 3.98Å; V541-V579 HydrophobicContact CG1-CG2 3.83Å; V541-M581 HydrophobicContact CG2-CB 3.97Å
542	E	96.3	Very high	92.6	Very high	32 Å²	32	62 Å²	62	15%	0.15	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	134.9	-177.6	-56.2	-160.4	91.8	0	0	111.2	R540 W550 K551 V579 K580	R540-E542 HydrophobicContact CG-CG 3.97Å; E542-W550 HydrophobicContact CB-CB 4.48Å; E542-W550 HydrophobicContact CB-CD2 4.42Å; E542-W550 HydrophobicContact CB-CE3 3.82Å; E542-W550 HydrophobicContact CB-CZ3 4.48Å; E542-W550 WeakPolarHBondContact O-CZ3 3.4Å; E542-K551 CarbonylContact C-O 3.56Å; E542-K551 WeakPolarHBondContact CA-O 3.41Å; E542-V579 CarbonylContact O-C 3.47Å; E542-V579 VanDerWaalsContact O-CA 3.24Å; E542-V579 WeakPolarHBondContact O-CA 3.13Å; E542-V579 WeakPolarHBondContact O-CG2 3.35Å; E542-K580 HydrophobicContact CB-CG 4.15Å; E542-K580 PolarHBondContact N-O 2.87Å; E542-K580 PolarHBondContact O-N 2.85Å; E542-K580 VanDerWaalsContact O-O 3.13Å; E542-K580 WeakPolarHBondContact OE2-CE 3.24Å; E542-K580 IonicContact OE2-NZ 3.34Å; E542-K580 PolarHBondContact OE2-NZ 2.85Å
543	W	96.9	Very high	93	Very high	28 Å²	28	66.2 Å²	66.2	11%	0.106	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	147.8	179.4	67.6	107.1	0	0	0	112.8	K551 K553 I568 L571 E578 V579	W543-K551 HydrophobicContact CD2-CB 4.23Å; W543-K551 HydrophobicContact CZ2-CB 4.2Å; W543-K551 PolarHBondContact N-O 3.27Å; W543-K551 PolarHBondContact O-N 3.43Å; W543-K553 HydrophobicContact CH2-CB 3.93Å; W543-K553 HydrophobicContact CZ3-CB 3.86Å; W543-I568 HydrophobicContact CB-CD1 4.25Å; W543-I568 HydrophobicContact CD2-CG2 3.63Å; W543-I568 HydrophobicContact CE3-CG2 4.05Å; W543-I568 HydrophobicContact CG-CD1 4.45Å; W543-I568 HydrophobicContact CG-CG2 3.94Å; W543-I568 HydrophobicContact CH2-CG2 4.42Å; W543-I568 HydrophobicContact CZ2-CG2 4Å; W543-I568 HydrophobicContact CZ3-CG2 4.44Å; W543-L571 VanDerWaalsContact CD1-CD2 3.46Å; W543-L571 HydrophobicContact CG-CD2 4.48Å; W543-E578 CarbonylContact C-O 3.44Å; W543-E578 WeakPolarHBondContact CA-O 3.29Å; W543-V579 HydrophobicContact CB-CB 4.4Å
544	R	95.3	Very high	93.5	Very high	66 Å²	66	68.1 Å²	68.1	25%	0.249	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	162.7	179.1	65.8	170.9	177.8	-174.7	-0.3	112.9	K548 E549 W550 Y577 E578	R544-K548 WeakPolarHBondContact CD-O 3.11Å; R544-K548 PolarHBondContact NH1-O 2.77Å; R544-E549 VanDerWaalsContact CB-O 3.27Å; R544-E549 WeakPolarHBondContact CB-O 3.29Å; R544-W550 HydrophobicContact CB-CD2 4.22Å; R544-W550 HydrophobicContact CB-CE3 4.03Å; R544-W550 HydrophobicContact CB-CZ3 4.48Å; R544-W550 HydrophobicContact CG-CD2 3.94Å; R544-W550 HydrophobicContact CG-CE3 3.78Å; R544-W550 HydrophobicContact CG-CH2 4.01Å; R544-W550 HydrophobicContact CG-CZ2 4.16Å; R544-W550 HydrophobicContact CG-CZ3 3.82Å; R544-Y577 CarbonylContact O-C 3.54Å; R544-Y577 VanDerWaalsContact O-CA 3.24Å; R544-Y577 WeakPolarHBondContact O-CA 3.36Å; R544-Y577 WeakPolarHBondContact O-CD1 3.35Å; R544-E578 HydrophobicContact CG-CB 3.94Å; R544-E578 IonicContact CZ-OE2 2.78Å; R544-E578 PolarHBondContact N-O 3.21Å; R544-E578 IonicContact NE-OE1 3.5Å; R544-E578 IonicContact NE-OE2 2.61Å; R544-E578 PolarHBondContact NE-OE2 2.87Å; R544-E578 IonicContact NH2-OE1 3.88Å; R544-E578 IonicContact NH2-OE2 3.24Å; R544-E578 PolarHBondContact NH2-OE2 3.06Å; R544-E578 PolarHBondContact O-N 3.34Å
545	L	92.6	Very high	93.6	Very high	65 Å²	65	68.8 Å²	68.8	34%	0.34	35%	0.348	S	S	.	.			trans	-75.2	146.8	156.7	-59.5	173.8	0	0	0	108.5	G547 K548 T575 Y577	L545-G547 PolarHBondContact O-N 3.42Å; L545-K548 HydrophobicContact CB-CB 4.21Å; L545-K548 HydrophobicContact CB-CG 3.88Å; L545-K548 WeakPolarHBondContact O-CB 3.49Å; L545-K548 PolarHBondContact O-N 2.81Å; L545-T575 HydrophobicContact CD2-CG2 3.32Å; L545-Y577 HydrophobicContact CD2-CD1 3.89Å; L545-Y577 HydrophobicContact CD2-CE1 3.5Å; L545-Y577 VanDerWaalsContact CD2-CE1 3.5Å; L545-Y577 HydrophobicContact CD2-CE2 4.31Å; L545-Y577 HydrophobicContact CD2-CG 4.43Å; L545-Y577 HydrophobicContact CG-CE1 4.13Å
546	P	87.8	Confident	93.7	Very high	68 Å²	68	72.4 Å²	72.4	44%	0.442	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	130.4	174.5	-29.6	35.7	0	0	0	112.7	K548 T576 E578	P546-K548 VanDerWaalsContact C-N 3.3Å; P546-K548 PolarHBondContact O-N 3.05Å; P546-T576 VanDerWaalsContact CD-O 3.28Å; P546-T576 WeakPolarHBondContact CD-O 3.36Å; P546-T576 HydrophobicContact CG-CG2 4.34Å; P546-E578 WeakPolarHBondContact CA-OE1 3.19Å; P546-E578 HydrophobicContact CG-CG 4.49Å
547	G	83	Confident	93.5	Very high	68 Å²	68	72.6 Å²	72.6	70%	0.701	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	20.3	-177.3	0	0	0	0	0	115.7	L545	L545-G547 PolarHBondContact O-N 3.42Å
548	K	92.6	Very high	92.8	Very high	138 Å²	138	74.4 Å²	74.4	60%	0.6	37%	0.366	S	S	*	.	S	Bend	trans	-115.6	175.4	171.1	-60.6	-59.9	176.1	-166.5	0	112.4	R544 L545 P546	R544-K548 WeakPolarHBondContact CD-O 3.11Å; R544-K548 PolarHBondContact NH1-O 2.77Å; L545-K548 HydrophobicContact CB-CB 4.21Å; L545-K548 HydrophobicContact CB-CG 3.88Å; L545-K548 WeakPolarHBondContact O-CB 3.49Å; L545-K548 PolarHBondContact O-N 2.81Å; P546-K548 VanDerWaalsContact C-N 3.3Å; P546-K548 PolarHBondContact O-N 3.05Å
549	E	93.8	Very high	91.3	Very high	179 Å²	179	78.4 Å²	78.4	84%	0.836	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-69	151.5	173.4	-65.1	172.7	165.7	0	0	111.2	R544	R544-E549 VanDerWaalsContact CB-O 3.27Å; R544-E549 WeakPolarHBondContact CB-O 3.29Å
550	W	95.8	Very high	89.6	Confident	73 Å²	73	81.3 Å²	81.3	28%	0.277	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-76.2	132.3	175.3	-65.7	98.9	0	0	0	110.8	E542 R544 E578 K580	E542-W550 HydrophobicContact CB-CB 4.48Å; E542-W550 HydrophobicContact CB-CD2 4.42Å; E542-W550 HydrophobicContact CB-CE3 3.82Å; E542-W550 HydrophobicContact CB-CZ3 4.48Å; E542-W550 WeakPolarHBondContact O-CZ3 3.4Å; R544-W550 HydrophobicContact CB-CD2 4.22Å; R544-W550 HydrophobicContact CB-CE3 4.03Å; R544-W550 HydrophobicContact CB-CZ3 4.48Å; R544-W550 HydrophobicContact CG-CD2 3.94Å; R544-W550 HydrophobicContact CG-CE3 3.78Å; R544-W550 HydrophobicContact CG-CH2 4.01Å; R544-W550 HydrophobicContact CG-CZ2 4.16Å; R544-W550 HydrophobicContact CG-CZ3 3.82Å; W550-E578 HydrophobicContact CH2-CB 3.94Å; W550-E578 HydrophobicContact CZ3-CB 4.32Å; W550-K580 HydrophobicContact CE3-CG 4.41Å; W550-K580 HydrophobicContact CH2-CB 4.42Å; W550-K580 HydrophobicContact CH2-CD 3.97Å; W550-K580 HydrophobicContact CH2-CG 3.97Å; W550-K580 HydrophobicContact CZ2-CD 3.91Å; W550-K580 HydrophobicContact CZ2-CG 4.39Å; W550-K580 HydrophobicContact CZ3-CD 4.38Å; W550-K580 HydrophobicContact CZ3-CG 3.97Å
551	K	94.9	Very high	88	Confident	138 Å²	138	85.2 Å²	85.2	60%	0.6	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.2	143.4	158.9	-63.7	-175	174.9	-168.9	0	107.8	E542 W543	E542-K551 CarbonylContact C-O 3.56Å; E542-K551 WeakPolarHBondContact CA-O 3.41Å; W543-K551 HydrophobicContact CD2-CB 4.23Å; W543-K551 HydrophobicContact CZ2-CB 4.2Å; W543-K551 PolarHBondContact N-O 3.27Å; W543-K551 PolarHBondContact O-N 3.43Å
552	S	95.4	Very high	87	Confident	61 Å²	61	92.6 Å²	92.6	43%	0.427	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	155.7	178.5	65.9	0	0	0	0	112.1	V541	V541-S552 CarbonylContact O-C 3.54Å; V541-S552 WeakPolarHBondContact O-CA 3.49Å
553	K	96.1	Very high	86.4	Confident	92 Å²	92	92.5 Å²	92.5	40%	0.4	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	139.6	168.4	178.8	176.8	165.5	-159.3	0	109.8	V541 W543 Y555	V541-K553 PolarHBondContact N-O 3.24Å; V541-K553 PolarHBondContact O-N 2.84Å; W543-K553 HydrophobicContact CH2-CB 3.93Å; W543-K553 HydrophobicContact CZ3-CB 3.86Å; K553-Y555 HydrophobicContact CB-CE2 3.85Å; K553-Y555 HydrophobicContact CD-CE1 4.35Å; K553-Y555 HydrophobicContact CD-CE2 3.86Å; K553-Y555 HydrophobicContact CG-CD2 4.25Å; K553-Y555 HydrophobicContact CG-CE2 3.69Å
554	E	95.9	Very high	86.1	Confident	78 Å²	78	94.3 Å²	94.3	36%	0.364	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	141.8	172.2	-69.5	173.8	-159.7	0	0	111	K538 Y539 R540	K538-E554 HydrophobicContact CD-CB 4.35Å; K538-E554 HydrophobicContact CD-CG 4.48Å; K538-E554 VanDerWaalsContact CD-OE2 3.24Å; K538-E554 WeakPolarHBondContact CD-OE2 3.4Å; K538-E554 WeakPolarHBondContact CE-OE2 3.41Å; K538-E554 IonicContact NZ-OE2 2.7Å; K538-E554 PolarHBondContact NZ-OE2 3.05Å; Y539-E554 WeakPolarHBondContact O-CA 3.36Å; R540-E554 HydrophobicContact CB-CG 4.5Å; R540-E554 IonicContact CZ-OE1 3.03Å; R540-E554 VanDerWaalsContact CZ-OE1 3.24Å; R540-E554 IonicContact NH1-OE1 2.88Å; R540-E554 PolarHBondContact NH1-OE1 2.8Å; R540-E554 IonicContact NH2-OE1 2.74Å; R540-E554 PolarHBondContact NH2-OE1 2.91Å
555	Y	93.1	Very high	85.9	Confident	32 Å²	32	97.4 Å²	97.4	13%	0.125	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	134.3	175.5	-62.5	-105.3	0	0	0	106.4	K538 Y539 V541 K553 I566 T567	K538-Y555 CarbonylContact C-O 3.51Å; K538-Y555 WeakPolarHBondContact CA-O 3.26Å; K538-Y555 VanDerWaalsContact CB-O 3.28Å; K538-Y555 WeakPolarHBondContact CB-O 3.37Å; Y539-Y555 PolarHBondContact N-O 3.14Å; Y539-Y555 PolarHBondContact O-N 3.45Å; V541-Y555 HydrophobicContact CB-CE2 4.13Å; V541-Y555 HydrophobicContact CG2-CD2 4.28Å; V541-Y555 HydrophobicContact CG2-CE2 4.26Å; K553-Y555 HydrophobicContact CB-CE2 3.85Å; K553-Y555 HydrophobicContact CD-CE1 4.35Å; K553-Y555 HydrophobicContact CD-CE2 3.86Å; K553-Y555 HydrophobicContact CG-CD2 4.25Å; K553-Y555 HydrophobicContact CG-CE2 3.69Å; Y555-I566 HydrophobicContact CD1-CG1 4.37Å; Y555-I566 HydrophobicContact CD1-CG2 3.74Å; Y555-I566 HydrophobicContact CD2-CD1 4.41Å; Y555-I566 HydrophobicContact CD2-CG2 3.8Å; Y555-I566 HydrophobicContact CE1-CG2 3.46Å; Y555-I566 VanDerWaalsContact CE1-CG2 3.46Å; Y555-I566 HydrophobicContact CE2-CG2 3.57Å; Y555-I566 HydrophobicContact CG-CD1 4.24Å; Y555-I566 HydrophobicContact CG-CG1 4.29Å; Y555-I566 HydrophobicContact CG-CG2 3.9Å; Y555-T567 PolarHBondContact OH-O 3.22Å
556	K	92	Very high	86	Confident	168 Å²	168	94.5 Å²	94.5	73%	0.73	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	147.4	174.8	-68	-174.2	175.1	-172.5	0	109.5
557	A	86.1	Confident	86.2	Confident	29 Å²	29	94.2 Å²	94.2	24%	0.24	48%	0.483	C	S	.	.	P	Polyproline II helix	trans	-68.5	153.1	159	0	0	0	0	0	109.4	I536 L537	I536-A557 HydrophobicContact CG2-CB 4.5Å; L537-A557 PolarHBondContact O-N 2.9Å
558	E	78.1	Confident	86.7	Confident	132 Å²	132	91 Å²	91	62%	0.617	45%	0.449	S	S	*	.	B	Isolated β-bridge	trans	-100.9	145.5	179	-63.8	-173.9	155.5	0	0	110.1	G560 E561	E558-G560 PolarHBondContact O-N 3.2Å; E558-E561 PolarHBondContact O-N 3.04Å
559	D	64.2	Low	86.6	Confident	158 Å²	158	88.2 Å²	88.2	85%	0.845	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	102	-157.1	-159.7	-0.2	0	0	0	113.1	K743	D559-K743 PolarHBondContact O-NZ 3.44Å
560	G	57.9	Low	86.3	Confident	60 Å²	60	82.9 Å²	82.9	62%	0.619	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	38.3	-174	0	0	0	0	0	113.3	E558 K743	E558-G560 PolarHBondContact O-N 3.2Å; G560-K743 PolarHBondContact O-NZ 3.29Å
561	E	63.9	Low	86.1	Confident	124 Å²	124	79.9 Å²	79.9	58%	0.579	43%	0.426	S	S	*	.	B	Isolated β-bridge	trans	-135	135	164.7	-68.7	-169.9	-155.1	0	0	110.1	E558 M563	E558-E561 PolarHBondContact O-N 3.04Å; E561-M563 PolarHBondContact O-N 3.37Å
562	H	75.9	Confident	85.8	Confident	156 Å²	156	79.8 Å²	79.8	72%	0.722	43%	0.425	S	S	*	.			trans	-71.4	117.5	-177.3	-69.9	-73.2	0	0	0	111.1	E527 T564	E527-H562 IonicContact OE2-CE1 2.86Å; E527-H562 IonicContact OE2-CG 2.85Å; E527-H562 IonicContact OE2-ND1 3.18Å; E527-H562 PolarHBondContact OE2-ND1 2.87Å; H562-T564 PolarHBondContact O-N 3.43Å
563	M	83.5	Confident	85.4	Confident	29 Å²	29	79.1 Å²	79.1	14%	0.143	42%	0.42	C	S	.	.			trans	-82.8	115.7	-177.8	-161.4	-175.7	-158.1	0	0	109.6	F525 E527 Y539 E561 I566	F525-M563 WeakPolarHBondContact CE2-O 3.4Å; F525-M563 HydrophobicContact CZ-CB 4.19Å; F525-M563 HydrophobicContact CZ-CG 4.04Å; F525-M563 WeakPolarHBondContact CZ-O 3.45Å; F525-M563 HydrophobicContact CZ-SD 4.43Å; E527-M563 PolarHBondContact OE1-N 3.05Å; Y539-M563 HydrophobicContact CD2-CB 4.4Å; Y539-M563 HydrophobicContact CD2-SD 3.72Å; Y539-M563 HydrophobicContact CE2-CB 3.85Å; Y539-M563 HydrophobicContact CE2-SD 4.15Å; E561-M563 PolarHBondContact O-N 3.37Å; M563-I566 HydrophobicContact CE-CD1 4.28Å; M563-I566 HydrophobicContact CE-CG1 3.68Å; M563-I566 HydrophobicContact SD-CD1 4.01Å; M563-I566 HydrophobicContact SD-CG1 4Å
564	T	89.1	Confident	85	Confident	67 Å²	67	80.3 Å²	80.3	41%	0.411	43%	0.427	S	S	.	.			trans	-119.3	-5.4	-174	49.9	0	0	0	0	114.3	E524 F525 H562	E524-T564 WeakPolarHBondContact CA-O 3.43Å; F525-T564 PolarHBondContact N-O 3.11Å; H562-T564 PolarHBondContact O-N 3.43Å
565	R	92.3	Very high	84.9	Confident	131 Å²	131	78.3 Å²	78.3	49%	0.494	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	133.7	-176.2	58	-174.6	61.1	-105.4	-16.5	113.2	V522 V523 E524	V522-R565 HydrophobicContact CG1-CB 4.27Å; V523-R565 CarbonylContact O-C 3.43Å; V523-R565 VanDerWaalsContact O-CA 3.3Å; V523-R565 WeakPolarHBondContact O-CA 3.29Å; E524-R565 HydrophobicContact CG-CB 4.47Å; E524-R565 IonicContact OE1-CZ 3.24Å; E524-R565 IonicContact OE1-NH1 2.67Å; E524-R565 PolarHBondContact OE1-NH1 2.92Å; E524-R565 IonicContact OE1-NH2 2.77Å; E524-R565 PolarHBondContact OE1-NH2 2.93Å; E524-R565 IonicContact OE2-NH2 2.85Å; E524-R565 PolarHBondContact OE2-NH2 2.85Å
566	I	94.1	Very high	85	Confident	3 Å²	3	79.7 Å²	79.7	2%	0.015	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	128.1	175.9	-74.6	165.8	0	0	0	111	V523 F525 Y539 V541 Y555 M563 M581	V523-I566 PolarHBondContact N-O 2.8Å; V523-I566 PolarHBondContact O-N 2.67Å; F525-I566 HydrophobicContact CE1-CB 4.34Å; F525-I566 HydrophobicContact CE1-CD1 3.72Å; F525-I566 HydrophobicContact CE1-CG1 3.82Å; F525-I566 HydrophobicContact CZ-CD1 3.89Å; F525-I566 HydrophobicContact CZ-CG1 4.32Å; Y539-I566 HydrophobicContact CG-CD1 4.29Å; V541-I566 HydrophobicContact CB-CG2 4.43Å; V541-I566 HydrophobicContact CG2-CB 4.24Å; V541-I566 HydrophobicContact CG2-CD1 3.76Å; V541-I566 HydrophobicContact CG2-CG2 3.69Å; Y555-I566 HydrophobicContact CD1-CG1 4.37Å; Y555-I566 HydrophobicContact CD1-CG2 3.74Å; Y555-I566 HydrophobicContact CD2-CD1 4.41Å; Y555-I566 HydrophobicContact CD2-CG2 3.8Å; Y555-I566 HydrophobicContact CE1-CG2 3.46Å; Y555-I566 VanDerWaalsContact CE1-CG2 3.46Å; Y555-I566 HydrophobicContact CE2-CG2 3.57Å; Y555-I566 HydrophobicContact CG-CD1 4.24Å; Y555-I566 HydrophobicContact CG-CG1 4.29Å; Y555-I566 HydrophobicContact CG-CG2 3.9Å; M563-I566 HydrophobicContact CE-CD1 4.28Å; M563-I566 HydrophobicContact CE-CG1 3.68Å; M563-I566 HydrophobicContact SD-CD1 4.01Å; M563-I566 HydrophobicContact SD-CG1 4Å; I566-M581 HydrophobicContact CD1-CE 4.23Å
567	T	92.9	Very high	85.2	Confident	63 Å²	63	72.5 Å²	72.5	39%	0.387	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	121.5	177.4	-46.4	0	0	0	0	112.5	A521 V522 Y555 V569	A521-T567 CarbonylContact O-C 3.57Å; A521-T567 WeakPolarHBondContact O-CA 3.32Å; V522-T567 HydrophobicContact CG2-CG2 4.18Å; Y555-T567 PolarHBondContact OH-O 3.22Å; T567-V569 HydrophobicContact CG2-CG1 4.16Å
568	I	94.1	Very high	85.7	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	140.2	167	-54.7	175.4	0	0	0	108.8	T520 A521 V523 V541 W543 L571 V579	T520-I568 CarbonylContact C-O 3.52Å; T520-I568 WeakPolarHBondContact CA-O 3.37Å; T520-I568 VanDerWaalsContact CB-O 3.24Å; T520-I568 WeakPolarHBondContact CB-O 3.28Å; A521-I568 PolarHBondContact N-O 2.66Å; A521-I568 PolarHBondContact O-N 3.45Å; V523-I568 HydrophobicContact CG2-CD1 3.75Å; V523-I568 HydrophobicContact CG2-CG1 4.17Å; V541-I568 HydrophobicContact CG1-CD1 3.75Å; V541-I568 HydrophobicContact CG1-CG1 3.98Å; W543-I568 HydrophobicContact CB-CD1 4.25Å; W543-I568 HydrophobicContact CD2-CG2 3.63Å; W543-I568 HydrophobicContact CE3-CG2 4.05Å; W543-I568 HydrophobicContact CG-CD1 4.45Å; W543-I568 HydrophobicContact CG-CG2 3.94Å; W543-I568 HydrophobicContact CH2-CG2 4.42Å; W543-I568 HydrophobicContact CZ2-CG2 4Å; W543-I568 HydrophobicContact CZ3-CG2 4.44Å; I568-L571 HydrophobicContact CG2-CD1 4.36Å; I568-L571 HydrophobicContact CG2-CD2 3.84Å; I568-L571 HydrophobicContact CG2-CG 4.21Å; I568-V579 HydrophobicContact CD1-CB 4.38Å; I568-V579 HydrophobicContact CD1-CG2 3.7Å
569	V	90.1	Very high	86.5	Confident	80 Å²	80	66.2 Å²	66.2	49%	0.485	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	155.6	-176.2	-59	0	0	0	0	112.3	T520 T567	T520-V569 HydrophobicContact CG2-CB 4.3Å; T520-V569 HydrophobicContact CG2-CG1 3.93Å; T567-V569 HydrophobicContact CG2-CG1 4.16Å
570	G	87.3	Confident	88.1	Confident	66 Å²	66	60.4 Å²	60.4	68%	0.68	33%	0.333	S	S	*	.	S	Bend	trans	79.4	30.4	178.7	0	0	0	0	0	113.4	S519	S519-G570 PolarHBondContact O-N 2.73Å; S519-G570 VanDerWaalsContact O-N 3.09Å
571	L	90.4	Very high	89.9	Confident	10 Å²	10	57.5 Å²	57.5	5%	0.052	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-79.4	159.8	170.1	-53.7	-176.9	0	0	0	110.3	S519 A521 W543 I568 Y577 F598 T600	S519-L571 PolarHBondContact O-N 3.32Å; A521-L571 HydrophobicContact CB-CD1 3.82Å; W543-L571 VanDerWaalsContact CD1-CD2 3.46Å; W543-L571 HydrophobicContact CG-CD2 4.48Å; I568-L571 HydrophobicContact CG2-CD1 4.36Å; I568-L571 HydrophobicContact CG2-CD2 3.84Å; I568-L571 HydrophobicContact CG2-CG 4.21Å; L571-Y577 HydrophobicContact CB-CE2 3.88Å; L571-Y577 HydrophobicContact CD1-CD2 4.49Å; L571-Y577 HydrophobicContact CD2-CD1 4.15Å; L571-Y577 HydrophobicContact CD2-CD2 4.33Å; L571-Y577 HydrophobicContact CD2-CE1 3.88Å; L571-Y577 HydrophobicContact CD2-CE2 4.07Å; L571-Y577 HydrophobicContact CD2-CG 4.38Å; L571-Y577 HydrophobicContact CG-CE2 4.4Å; L571-F598 HydrophobicContact CD1-CE2 3.64Å; L571-F598 HydrophobicContact CD1-CZ 3.69Å; L571-T600 HydrophobicContact CB-CG2 3.82Å; L571-T600 HydrophobicContact CD1-CG2 3.74Å; L571-T600 HydrophobicContact CG-CG2 4.45Å
572	K	89.3	Confident	91.5	Very high	137 Å²	137	51.6 Å²	51.6	60%	0.596	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-89.7	145	171	-68	-175.5	175	-173	0	109.9	S518 T575 Y577 T600	S518-K572 CarbonylContact O-C 3.51Å; K572-T575 HydrophobicContact CB-CG2 4.45Å; K572-T575 WeakPolarHBondContact CB-OG1 3.31Å; K572-T575 WeakPolarHBondContact O-CB 3.44Å; K572-Y577 PolarHBondContact N-OH 2.71Å; K572-T600 WeakPolarHBondContact O-CB 3.09Å; K572-T600 PolarHBondContact O-OG1 2.79Å
573	P	87.6	Confident	92.4	Very high	47 Å²	47	44.2 Å²	44.2	31%	0.305	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	157.2	171.1	-21.1	30.5	0	0	0	113	S518 T575 T600 V603	S518-P573 WeakPolarHBondContact O-CA 3.47Å; S518-P573 WeakPolarHBondContact O-CD 3.37Å; S518-P573 VanDerWaalsContact O-CG 3.26Å; S518-P573 WeakPolarHBondContact O-CG 3.49Å; S518-P573 VanDerWaalsContact O-N 3.11Å; P573-T575 PolarHBondContact O-N 2.88Å; P573-T575 PolarHBondContact O-OG1 2.9Å; P573-T600 VanDerWaalsContact C-OG1 3.31Å; P573-V603 HydrophobicContact CB-CG2 3.8Å; P573-V603 HydrophobicContact CG-CG2 3.49Å; P573-V603 VanDerWaalsContact CG-CG2 3.49Å
574	E	87.8	Confident	92.9	Very high	117 Å²	117	43.8 Å²	43.8	55%	0.547	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	49	24.1	177.2	-60.2	-154.6	66.9	0	0	116.6	K599 T600 E601 P602	E574-K599 WeakPolarHBondContact O-CE 3.47Å; E574-K599 IonicContact OE1-NZ 2.7Å; E574-K599 PolarHBondContact OE1-NZ 2.65Å; E574-T600 VanDerWaalsContact CA-O 3.31Å; E574-T600 WeakPolarHBondContact CA-O 3.32Å; E574-T600 PolarHBondContact N-O 3.42Å; E574-T600 PolarHBondContact N-OG1 2.96Å; E574-T600 VanDerWaalsContact N-OG1 3.17Å; E574-E601 PolarHBondContact N-O 2.75Å; E574-P602 HydrophobicContact CG-CB 3.91Å
575	T	92.6	Very high	93.2	Very high	35 Å²	35	40.9 Å²	40.9	22%	0.215	22%	0.221	C	C	.	.			trans	-114.8	131.5	-168.8	-61.6	0	0	0	0	110.2	L545 K572 P573 Y577 T600	L545-T575 HydrophobicContact CD2-CG2 3.32Å; K572-T575 HydrophobicContact CB-CG2 4.45Å; K572-T575 WeakPolarHBondContact CB-OG1 3.31Å; K572-T575 WeakPolarHBondContact O-CB 3.44Å; P573-T575 PolarHBondContact O-N 2.88Å; P573-T575 PolarHBondContact O-OG1 2.9Å; T575-Y577 HydrophobicContact CG2-CD2 4.16Å; T575-Y577 HydrophobicContact CG2-CE2 3.58Å; T575-Y577 VanDerWaalsContact O-CD2 3.32Å; T575-Y577 WeakPolarHBondContact O-CD2 3.49Å; T575-T600 PolarHBondContact N-OG1 2.89Å; T575-T600 PolarHBondContact O-N 3.31Å; T575-T600 PolarHBondContact O-OG1 3.29Å; T575-T600 VanDerWaalsContact O-OG1 3.11Å
576	T	94.9	Very high	93	Very high	62 Å²	62	36.1 Å²	36.1	38%	0.38	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	133	175.4	-52.1	0	0	0	0	110.9	P546 T597 F598	P546-T576 VanDerWaalsContact CD-O 3.28Å; P546-T576 WeakPolarHBondContact CD-O 3.36Å; P546-T576 HydrophobicContact CG-CG2 4.34Å; T576-T597 HydrophobicContact CG2-CG2 3.62Å; T576-F598 CarbonylContact C-O 3.49Å; T576-F598 WeakPolarHBondContact CA-O 3.39Å
577	Y	96.5	Very high	92.9	Very high	17 Å²	17	39.9 Å²	39.9	7%	0.067	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	148.6	176.2	-72.5	-89.7	0	0	0	110.8	R544 L545 L571 K572 T575 T597 F598 T600	R544-Y577 CarbonylContact O-C 3.54Å; R544-Y577 VanDerWaalsContact O-CA 3.24Å; R544-Y577 WeakPolarHBondContact O-CA 3.36Å; R544-Y577 WeakPolarHBondContact O-CD1 3.35Å; L545-Y577 HydrophobicContact CD2-CD1 3.89Å; L545-Y577 HydrophobicContact CD2-CE1 3.5Å; L545-Y577 VanDerWaalsContact CD2-CE1 3.5Å; L545-Y577 HydrophobicContact CD2-CE2 4.31Å; L545-Y577 HydrophobicContact CD2-CG 4.43Å; L545-Y577 HydrophobicContact CG-CE1 4.13Å; L571-Y577 HydrophobicContact CB-CE2 3.88Å; L571-Y577 HydrophobicContact CD1-CD2 4.49Å; L571-Y577 HydrophobicContact CD2-CD1 4.15Å; L571-Y577 HydrophobicContact CD2-CD2 4.33Å; L571-Y577 HydrophobicContact CD2-CE1 3.88Å; L571-Y577 HydrophobicContact CD2-CE2 4.07Å; L571-Y577 HydrophobicContact CD2-CG 4.38Å; L571-Y577 HydrophobicContact CG-CE2 4.4Å; K572-Y577 PolarHBondContact N-OH 2.71Å; T575-Y577 HydrophobicContact CG2-CD2 4.16Å; T575-Y577 HydrophobicContact CG2-CE2 3.58Å; T575-Y577 VanDerWaalsContact O-CD2 3.32Å; T575-Y577 WeakPolarHBondContact O-CD2 3.49Å; Y577-T597 WeakPolarHBondContact O-CA 3.43Å; Y577-F598 HydrophobicContact CD2-CE2 4.34Å; Y577-F598 HydrophobicContact CD2-CZ 4.37Å; Y577-F598 HydrophobicContact CG-CZ 4.19Å; Y577-F598 PolarHBondContact N-O 3.47Å; Y577-F598 PolarHBondContact O-N 3.08Å; Y577-T600 HydrophobicContact CD2-CG2 4.13Å; Y577-T600 HydrophobicContact CE2-CG2 4.12Å
578	E	96.3	Very high	92.9	Very high	29 Å²	29	37.9 Å²	37.9	14%	0.136	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	143.2	162.5	-64.5	167.8	-143.1	0	0	108.6	W543 R544 P546 W550 S596	W543-E578 CarbonylContact C-O 3.44Å; W543-E578 WeakPolarHBondContact CA-O 3.29Å; R544-E578 HydrophobicContact CG-CB 3.94Å; R544-E578 IonicContact CZ-OE2 2.78Å; R544-E578 PolarHBondContact N-O 3.21Å; R544-E578 IonicContact NE-OE1 3.5Å; R544-E578 IonicContact NE-OE2 2.61Å; R544-E578 PolarHBondContact NE-OE2 2.87Å; R544-E578 IonicContact NH2-OE1 3.88Å; R544-E578 IonicContact NH2-OE2 3.24Å; R544-E578 PolarHBondContact NH2-OE2 3.06Å; R544-E578 PolarHBondContact O-N 3.34Å; P546-E578 WeakPolarHBondContact CA-OE1 3.19Å; P546-E578 HydrophobicContact CG-CG 4.49Å; W550-E578 HydrophobicContact CH2-CB 3.94Å; W550-E578 HydrophobicContact CZ3-CB 4.32Å; E578-S596 CarbonylContact C-O 3.46Å; E578-S596 WeakPolarHBondContact CA-O 3.4Å
579	V	96.7	Very high	92.9	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	140.8	176.2	55.7	0	0	0	0	111.3	V514 V523 V541 E542 W543 I568 S595 S596 F598	V514-V579 HydrophobicContact CG1-CG1 4.35Å; V514-V579 HydrophobicContact CG2-CG1 3.77Å; V523-V579 HydrophobicContact CG2-CG2 4.08Å; V541-V579 HydrophobicContact CG1-CG2 3.83Å; E542-V579 CarbonylContact O-C 3.47Å; E542-V579 VanDerWaalsContact O-CA 3.24Å; E542-V579 WeakPolarHBondContact O-CA 3.13Å; E542-V579 WeakPolarHBondContact O-CG2 3.35Å; W543-V579 HydrophobicContact CB-CB 4.4Å; I568-V579 HydrophobicContact CD1-CB 4.38Å; I568-V579 HydrophobicContact CD1-CG2 3.7Å; V579-S595 CarbonylContact O-C 3.57Å; V579-S595 WeakPolarHBondContact O-CA 3.01Å; V579-S596 PolarHBondContact N-O 2.99Å; V579-S596 PolarHBondContact O-N 3.16Å; V579-F598 HydrophobicContact CB-CE1 4.03Å; V579-F598 HydrophobicContact CG1-CD1 3.86Å; V579-F598 HydrophobicContact CG1-CE1 3.75Å
580	K	96.5	Very high	93.2	Very high	35 Å²	35	38 Å²	38	15%	0.152	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	163.6	168	69.4	-174.8	-176	69.6	0	110.4	E542 W550 S592 S593	E542-K580 HydrophobicContact CB-CG 4.15Å; E542-K580 PolarHBondContact N-O 2.87Å; E542-K580 PolarHBondContact O-N 2.85Å; E542-K580 VanDerWaalsContact O-O 3.13Å; E542-K580 WeakPolarHBondContact OE2-CE 3.24Å; E542-K580 IonicContact OE2-NZ 3.34Å; E542-K580 PolarHBondContact OE2-NZ 2.85Å; W550-K580 HydrophobicContact CE3-CG 4.41Å; W550-K580 HydrophobicContact CH2-CB 4.42Å; W550-K580 HydrophobicContact CH2-CD 3.97Å; W550-K580 HydrophobicContact CH2-CG 3.97Å; W550-K580 HydrophobicContact CZ2-CD 3.91Å; W550-K580 HydrophobicContact CZ2-CG 4.39Å; W550-K580 HydrophobicContact CZ3-CD 4.38Å; W550-K580 HydrophobicContact CZ3-CG 3.97Å; K580-S592 PolarHBondContact NZ-OG 3.25Å; K580-S593 WeakPolarHBondContact CA-OG 3.06Å
581	M	96.6	Very high	93.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	153.1	178.4	66.6	-175.5	-72.6	0	0	113.8	P509 I511 V523 F525 Y539 R540 V541 I566 S592 S593	P509-M581 HydrophobicContact CB-CE 4.09Å; P509-M581 HydrophobicContact CB-CG 4.12Å; P509-M581 HydrophobicContact CB-SD 4.34Å; P509-M581 HydrophobicContact CG-CE 4.25Å; P509-M581 HydrophobicContact CG-CG 4.31Å; I511-M581 HydrophobicContact CD1-CG 4.09Å; I511-M581 HydrophobicContact CD1-SD 4.35Å; I511-M581 HydrophobicContact CG1-CG 3.94Å; I511-M581 HydrophobicContact CG1-SD 3.81Å; V523-M581 HydrophobicContact CG1-SD 4.12Å; F525-M581 HydrophobicContact CB-CE 4.31Å; F525-M581 HydrophobicContact CB-SD 3.79Å; F525-M581 HydrophobicContact CD1-CE 3.72Å; F525-M581 HydrophobicContact CD1-SD 3.91Å; F525-M581 HydrophobicContact CD2-CE 3.45Å; F525-M581 VanDerWaalsContact CD2-CE 3.45Å; F525-M581 HydrophobicContact CD2-SD 4.09Å; F525-M581 HydrophobicContact CE1-CE 3.79Å; F525-M581 HydrophobicContact CE2-CE 3.52Å; F525-M581 HydrophobicContact CG-CE 3.55Å; F525-M581 HydrophobicContact CG-SD 3.66Å; F525-M581 HydrophobicContact CZ-CE 3.69Å; Y539-M581 HydrophobicContact CD1-CE 3.74Å; Y539-M581 HydrophobicContact CE1-CE 4.39Å; Y539-M581 HydrophobicContact CG-CE 4.19Å; R540-M581 CarbonylContact O-C 3.38Å; R540-M581 WeakPolarHBondContact O-CA 3.5Å; R540-M581 WeakPolarHBondContact O-CB 3.41Å; V541-M581 HydrophobicContact CG2-CB 3.97Å; I566-M581 HydrophobicContact CD1-CE 4.23Å; M581-S592 CarbonylContact O-C 3.59Å; M581-S592 WeakPolarHBondContact O-CA 3.46Å; M581-S593 PolarHBondContact N-OG 3.12Å; M581-S593 WeakPolarHBondContact O-CB 3.46Å; M581-S593 PolarHBondContact O-N 3.32Å
582	S	96.6	Very high	93.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	150.2	179.4	28	0	0	0	0	109.8	Y539 R540 E589	Y539-S582 CarbonylContact C-O 3.59Å; Y539-S582 WeakPolarHBondContact CA-O 3.45Å; R540-S582 PolarHBondContact N-O 2.78Å; R540-S582 PolarHBondContact O-N 3.27Å; S582-E589 WeakPolarHBondContact CB-OE1 3.15Å; S582-E589 PolarHBondContact OG-OE1 2.82Å
583	A	95.3	Very high	94.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	150.8	173.1	0	0	0	0	0	110.8	P506 P509 P528 I536 Y539 G590	P506-A583 HydrophobicContact CB-CB 3.88Å; P506-A583 HydrophobicContact CG-CB 4.11Å; P509-A583 HydrophobicContact CG-CB 4.01Å; P528-A583 HydrophobicContact CG-CB 3.48Å; P528-A583 VanDerWaalsContact CG-CB 3.48Å; I536-A583 HydrophobicContact CD1-CB 4.24Å; I536-A583 HydrophobicContact CG2-CB 4.25Å; Y539-A583 HydrophobicContact CD1-CB 3.83Å; Y539-A583 HydrophobicContact CE1-CB 3.67Å; A583-G590 PolarHBondContact O-N 3.14Å
584	I	94.9	Very high	94.4	Very high	21 Å²	21	46.2 Å²	46.2	11%	0.108	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	120.1	-176.9	-46.2	-178.2	0	0	0	108.6	L537 K538 R540 G588 E589	L537-I584 PolarHBondContact N-O 3.37Å; K538-I584 HydrophobicContact CB-CB 4.17Å; K538-I584 HydrophobicContact CB-CD1 4.31Å; K538-I584 HydrophobicContact CB-CG1 4.45Å; K538-I584 HydrophobicContact CD-CD1 4.46Å; K538-I584 PolarHBondContact N-O 3.08Å; K538-I584 VanDerWaalsContact N-O 3.1Å; K538-I584 PolarHBondContact O-N 2.85Å; R540-I584 HydrophobicContact CB-CD1 4.31Å; I584-G588 WeakPolarHBondContact CA-O 3.36Å; I584-E589 HydrophobicContact CD1-CB 4.39Å; I584-E589 HydrophobicContact CD1-CG 4.34Å; I584-E589 HydrophobicContact CG1-CB 3.97Å; I584-E589 HydrophobicContact CG1-CG 3.9Å; I584-E589 HydrophobicContact CG2-CB 4.4Å
585	N	93.7	Very high	94.7	Very high	5 Å²	5	43.8 Å²	43.8	3%	0.027	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	-168.2	173.5	71.6	6.7	0	0	0	110.5	E504 P506 L531 V534 P535 I536 K587 G588	E504-N585 PolarHBondContact O-ND2 2.59Å; P506-N585 HydrophobicContact CG-CB 3.8Å; L531-N585 PolarHBondContact O-ND2 2.88Å; V534-N585 HydrophobicContact CG2-CB 4.07Å; V534-N585 WeakPolarHBondContact CG2-ND2 3.37Å; P535-N585 WeakPolarHBondContact O-CA 3.48Å; P535-N585 VanDerWaalsContact O-CB 3.29Å; P535-N585 WeakPolarHBondContact O-CB 3.4Å; I536-N585 HydrophobicContact CD1-CB 4.37Å; N585-K587 VanDerWaalsContact C-N 3.31Å; N585-K587 PolarHBondContact O-N 2.84Å; N585-K587 WeakPolarHBondContact OD1-CA 3.44Å; N585-K587 WeakPolarHBondContact OD1-CB 3.34Å; N585-K587 PolarHBondContact OD1-N 2.89Å; N585-G588 PolarHBondContact N-O 2.97Å; N585-G588 PolarHBondContact OD1-N 3.31Å; N585-G588 PolarHBondContact OD1-O 2.03Å
586	G	89.4	Confident	94.8	Very high	32 Å²	32	44.1 Å²	44.1	33%	0.33	23%	0.233	S	C	.	.	S	Bend	trans	-63.3	-31.5	176.8	0	0	0	0	0	114.6	W423	W423-G586 VanDerWaalsContact CH2-C 3.4Å; W423-G586 VanDerWaalsContact CZ2-C 3.49Å; W423-G586 WeakPolarHBondContact CZ2-O 3.44Å
587	K	91.5	Very high	94.8	Very high	81 Å²	81	45.3 Å²	45.3	35%	0.352	24%	0.24	S	C	.	.	S	Bend	trans	-74.8	-37.1	179.1	175.1	60.8	170.3	178.2	0	112.4	W423 V505 N585	W423-K587 HydrophobicContact CB-CD 3.68Å; W423-K587 HydrophobicContact CD2-CB 4.25Å; W423-K587 HydrophobicContact CD2-CD 4.05Å; W423-K587 HydrophobicContact CE3-CB 4.17Å; W423-K587 HydrophobicContact CG-CD 3.6Å; V505-K587 HydrophobicContact CG1-CG 4.09Å; N585-K587 VanDerWaalsContact C-N 3.31Å; N585-K587 PolarHBondContact O-N 2.84Å; N585-K587 WeakPolarHBondContact OD1-CA 3.44Å; N585-K587 WeakPolarHBondContact OD1-CB 3.34Å; N585-K587 PolarHBondContact OD1-N 2.89Å
588	G	92.4	Very high	94.7	Very high	22 Å²	22	45.2 Å²	45.2	23%	0.227	24%	0.24	C	C	.	.			trans	159.2	-163.5	179.5	0	0	0	0	0	114.4	I584 N585	I584-G588 WeakPolarHBondContact CA-O 3.36Å; N585-G588 PolarHBondContact N-O 2.97Å; N585-G588 PolarHBondContact OD1-N 3.31Å; N585-G588 PolarHBondContact OD1-O 2.03Å
589	E	95.5	Very high	94.6	Very high	73 Å²	73	48.7 Å²	48.7	34%	0.341	26%	0.255	S	S	.	.	B	Isolated β-bridge	trans	-92.3	130.8	179.5	-179.3	160.8	177.4	0	0	111.3	R540 S582 I584	R540-E589 VanDerWaalsContact CD-OE1 3.29Å; R540-E589 WeakPolarHBondContact CD-OE1 3.44Å; R540-E589 IonicContact CZ-OE1 3.37Å; R540-E589 IonicContact CZ-OE2 2.76Å; R540-E589 VanDerWaalsContact NE-CD 3.26Å; R540-E589 IonicContact NE-OE1 3.75Å; R540-E589 PolarHBondContact NE-OE1 2.85Å; R540-E589 IonicContact NE-OE2 3.09Å; R540-E589 PolarHBondContact NE-OE2 2.82Å; R540-E589 IonicContact NH2-OE2 2.65Å; R540-E589 PolarHBondContact NH2-OE2 3.19Å; S582-E589 WeakPolarHBondContact CB-OE1 3.15Å; S582-E589 PolarHBondContact OG-OE1 2.82Å; I584-E589 HydrophobicContact CD1-CB 4.39Å; I584-E589 HydrophobicContact CD1-CG 4.34Å; I584-E589 HydrophobicContact CG1-CB 3.97Å; I584-E589 HydrophobicContact CG1-CG 3.9Å; I584-E589 HydrophobicContact CG2-CB 4.4Å
590	G	95.6	Very high	94.4	Very high	10 Å²	10	48.8 Å²	48.8	10%	0.103	26%	0.256	C	S	.	.			trans	-81.3	178.8	177.6	0	0	0	0	0	113.6	P506 A583	P506-G590 WeakPolarHBondContact O-CA 3.42Å; A583-G590 PolarHBondContact O-N 3.14Å
591	E	94.9	Very high	93.9	Very high	144 Å²	144	51.2 Å²	51.2	67%	0.673	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-60.1	150.3	176.1	-66.3	-163.3	146.3	0	0	112.1	S508	S508-E591 WeakPolarHBondContact CA-O 3.27Å; S508-E591 WeakPolarHBondContact CB-O 3.44Å
592	S	95.4	Very high	93.4	Very high	42 Å²	42	54.8 Å²	54.8	29%	0.294	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-74.7	146.5	170.6	-56.9	0	0	0	0	111.7	S508 K580 M581	S508-S592 WeakPolarHBondContact CB-O 3.48Å; K580-S592 PolarHBondContact NZ-OG 3.25Å; M581-S592 CarbonylContact O-C 3.59Å; M581-S592 WeakPolarHBondContact O-CA 3.46Å
593	S	96.4	Very high	92.9	Very high	8 Å²	8	56.3 Å²	56.3	6%	0.056	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-50.6	160	161.8	78.3	0	0	0	0	111.3	P509 I511 K580 M581	P509-S593 WeakPolarHBondContact O-CB 3.25Å; I511-S593 WeakPolarHBondContact CD1-OG 3.35Å; K580-S593 WeakPolarHBondContact CA-OG 3.06Å; M581-S593 PolarHBondContact N-OG 3.12Å; M581-S593 WeakPolarHBondContact O-CB 3.46Å; M581-S593 PolarHBondContact O-N 3.32Å
594	R	93.6	Very high	92.4	Very high	237 Å²	237	60.9 Å²	60.9	89%	0.894	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-56.9	144.9	160	-65.7	-177.6	179.9	179.7	1.7	109.2
595	S	93.6	Very high	92.1	Very high	67 Å²	67	64.6 Å²	64.6	47%	0.469	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-77.2	122.9	178.8	54.5	0	0	0	0	111.1	V579	V579-S595 CarbonylContact O-C 3.57Å; V579-S595 WeakPolarHBondContact O-CA 3.01Å
596	S	94.7	Very high	91.9	Very high	41 Å²	41	64.6 Å²	64.6	29%	0.287	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	152.7	168.8	-171.6	0	0	0	0	110.6	E578 V579	E578-S596 CarbonylContact C-O 3.46Å; E578-S596 WeakPolarHBondContact CA-O 3.4Å; V579-S596 PolarHBondContact N-O 2.99Å; V579-S596 PolarHBondContact O-N 3.16Å
597	T	95.3	Very high	91.9	Very high	87 Å²	87	65.8 Å²	65.8	53%	0.534	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	126.3	179.6	-58.6	0	0	0	0	109.8	T576 Y577	T576-T597 HydrophobicContact CG2-CG2 3.62Å; Y577-T597 WeakPolarHBondContact O-CA 3.43Å
598	F	94.8	Very high	91.9	Very high	15 Å²	15	63.8 Å²	63.8	7%	0.066	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	159.6	-179.1	69.2	-81.4	0	0	0	110.8	V514 P516 A521 L571 T576 Y577 V579 T600	V514-F598 HydrophobicContact CB-CB 4.32Å; V514-F598 HydrophobicContact CB-CD1 4.3Å; V514-F598 HydrophobicContact CB-CG 4.38Å; V514-F598 HydrophobicContact CG1-CB 4.18Å; V514-F598 HydrophobicContact CG1-CD1 3.59Å; V514-F598 HydrophobicContact CG1-CD2 4.19Å; V514-F598 HydrophobicContact CG1-CE1 3.92Å; V514-F598 HydrophobicContact CG1-CE2 4.48Å; V514-F598 HydrophobicContact CG1-CG 3.72Å; V514-F598 HydrophobicContact CG1-CZ 4.35Å; P516-F598 HydrophobicContact CB-CD2 4.15Å; A521-F598 HydrophobicContact CB-CD2 4.24Å; A521-F598 HydrophobicContact CB-CE2 3.53Å; A521-F598 HydrophobicContact CB-CZ 3.77Å; L571-F598 HydrophobicContact CD1-CE2 3.64Å; L571-F598 HydrophobicContact CD1-CZ 3.69Å; T576-F598 CarbonylContact C-O 3.49Å; T576-F598 WeakPolarHBondContact CA-O 3.39Å; Y577-F598 HydrophobicContact CD2-CE2 4.34Å; Y577-F598 HydrophobicContact CD2-CZ 4.37Å; Y577-F598 HydrophobicContact CG-CZ 4.19Å; Y577-F598 PolarHBondContact N-O 3.47Å; Y577-F598 PolarHBondContact O-N 3.08Å; V579-F598 HydrophobicContact CB-CE1 4.03Å; V579-F598 HydrophobicContact CG1-CD1 3.86Å; V579-F598 HydrophobicContact CG1-CE1 3.75Å; F598-T600 HydrophobicContact CE2-CG2 4.03Å
599	K	94.1	Very high	91.8	Very high	103 Å²	103	63 Å²	63	45%	0.448	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	128.3	170.9	-169.7	-163.3	174.4	-160.1	0	108.3	P516 E574	P516-K599 WeakPolarHBondContact CB-O 3.33Å; E574-K599 WeakPolarHBondContact O-CE 3.47Å; E574-K599 IonicContact OE1-NZ 2.7Å; E574-K599 PolarHBondContact OE1-NZ 2.65Å
600	T	91.4	Very high	91.5	Very high	2 Å²	2	64 Å²	64	1%	0.012	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-64	151.5	172.4	48.8	0	0	0	0	111.6	F517 L571 K572 P573 E574 T575 Y577 F598	F517-T600 WeakPolarHBondContact O-CA 3.41Å; F517-T600 WeakPolarHBondContact O-CB 3.46Å; F517-T600 VanDerWaalsContact O-CG2 3.32Å; F517-T600 WeakPolarHBondContact O-CG2 3.32Å; L571-T600 HydrophobicContact CB-CG2 3.82Å; L571-T600 HydrophobicContact CD1-CG2 3.74Å; L571-T600 HydrophobicContact CG-CG2 4.45Å; K572-T600 WeakPolarHBondContact O-CB 3.09Å; K572-T600 PolarHBondContact O-OG1 2.79Å; P573-T600 VanDerWaalsContact C-OG1 3.31Å; E574-T600 VanDerWaalsContact CA-O 3.31Å; E574-T600 WeakPolarHBondContact CA-O 3.32Å; E574-T600 PolarHBondContact N-O 3.42Å; E574-T600 PolarHBondContact N-OG1 2.96Å; E574-T600 VanDerWaalsContact N-OG1 3.17Å; T575-T600 PolarHBondContact N-OG1 2.89Å; T575-T600 PolarHBondContact O-N 3.31Å; T575-T600 PolarHBondContact O-OG1 3.29Å; T575-T600 VanDerWaalsContact O-OG1 3.11Å; Y577-T600 HydrophobicContact CD2-CG2 4.13Å; Y577-T600 HydrophobicContact CE2-CG2 4.12Å; F598-T600 HydrophobicContact CE2-CG2 4.03Å
601	E	86.6	Confident	91	Very high	85 Å²	85	64.7 Å²	64.7	40%	0.397	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-69.8	161.7	-179	-64.9	-163.1	126.3	0	0	112.7	P516 F517 S518 E574	P516-E601 HydrophobicContact CG-CG 4.46Å; F517-E601 PolarHBondContact O-N 3.04Å; F517-E601 VanDerWaalsContact O-N 3.16Å; S518-E601 WeakPolarHBondContact CA-O 3.38Å; S518-E601 WeakPolarHBondContact CB-O 3.29Å; E574-E601 PolarHBondContact N-O 2.75Å
602	P	86.5	Confident	90.3	Very high	76 Å²	76	61.2 Å²	61.2	49%	0.494	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-65.7	154.2	164	29.6	-36	0	0	0	111.6	S518 E574 R604	S518-P602 WeakPolarHBondContact CB-O 3.18Å; E574-P602 HydrophobicContact CG-CB 3.91Å; P602-R604 PolarHBondContact O-N 2.94Å
603	V	85	Confident	89.3	Confident	31 Å²	31	61.5 Å²	61.5	19%	0.188	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-66	122.2	171.2	179.6	0	0	0	0	109.3	P573 G632 R685	P573-V603 HydrophobicContact CB-CG2 3.8Å; P573-V603 HydrophobicContact CG-CG2 3.49Å; P573-V603 VanDerWaalsContact CG-CG2 3.49Å; V603-G632 WeakPolarHBondContact CA-O 3.41Å; V603-R685 HydrophobicContact CB-CB 4.44Å; V603-R685 HydrophobicContact CG1-CB 3.76Å; V603-R685 WeakPolarHBondContact O-CD 3.31Å; V603-R685 WeakPolarHBondContact O-CG 3.04Å
604	R	86.2	Confident	87.9	Confident	97 Å²	97	65.3 Å²	65.3	37%	0.366	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-96.1	170.4	171.2	64.9	177	-168.3	84.3	-14.6	110.9	P602 T607 D630 G632 N683	P602-R604 PolarHBondContact O-N 2.94Å; R604-T607 PolarHBondContact NH1-OG1 2.76Å; R604-T607 PolarHBondContact NH2-OG1 2.86Å; R604-D630 IonicContact CZ-OD2 2.67Å; R604-D630 IonicContact NE-OD2 2.76Å; R604-D630 IonicContact NH2-OD1 2.84Å; R604-D630 IonicContact NH2-OD2 3.73Å; R604-D630 PolarHBondContact NH2-OD2 3.3Å; R604-G632 PolarHBondContact N-O 3.3Å; R604-G632 VanDerWaalsContact N-O 3.1Å; R604-N683 PolarHBondContact O-ND2 3.16Å
605	E	87.3	Confident	86.6	Confident	98 Å²	98	57.8 Å²	57.8	46%	0.458	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-69.3	153.8	171.8	-65.3	179.7	120.6	0	0	110.6	R685 G686 R687	E605-R685 HydrophobicContact CG-CB 4.49Å; E605-R685 HydrophobicContact CG-CG 4.05Å; E605-G686 VanDerWaalsContact OE1-CA 3.25Å; E605-G686 WeakPolarHBondContact OE1-CA 3.36Å; E605-R687 PolarHBondContact OE1-N 2.88Å
606	P	89.5	Confident	85.1	Confident	6 Å²	6	57.3 Å²	57.3	4%	0.039	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-63.4	148.6	-179.1	-20.3	33.9	0	0	0	111.5	I636 A681 N683 S688	P606-I636 HydrophobicContact CB-CG1 4.5Å; P606-I636 HydrophobicContact CG-CG1 4.45Å; P606-A681 HydrophobicContact CB-CB 3.81Å; P606-A681 HydrophobicContact CG-CB 4.17Å; P606-N683 HydrophobicContact CG-CB 3.76Å; P606-S688 WeakPolarHBondContact O-CA 2.99Å; P606-S688 WeakPolarHBondContact O-CB 3.33Å
607	T	89.9	Confident	83.3	Confident	56 Å²	56	63.1 Å²	63.1	34%	0.344	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-67.2	139.8	166.6	-58.8	0	0	0	0	109.4	R604 Q629 D630	R604-T607 PolarHBondContact NH1-OG1 2.76Å; R604-T607 PolarHBondContact NH2-OG1 2.86Å; T607-Q629 HydrophobicContact CG2-CB 3.98Å; T607-Q629 HydrophobicContact CG2-CG 4.41Å; T607-D630 PolarHBondContact N-O 3.45Å
608	S	90.5	Very high	81.7	Confident	39 Å²	39	61.3 Å²	61.3	27%	0.273	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-53.1	129.8	-179.3	-56.1	0	0	0	0	112.3	Q629 E689	S608-Q629 VanDerWaalsContact O-CG 3.29Å; S608-Q629 WeakPolarHBondContact O-CG 3.4Å; S608-E689 WeakPolarHBondContact CB-O 3.39Å; S608-E689 WeakPolarHBondContact OG-CB 3.44Å; S608-E689 PolarHBondContact OG-O 2.87Å
609	P	90.8	Very high	80.2	Confident	5 Å²	5	62.3 Å²	62.3	3%	0.032	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-56.2	150	174.5	-27.9	36.6	0	0	0	113	L611 W626 Y639 V679 A681 S691	P609-L611 PolarHBondContact O-N 2.87Å; P609-W626 HydrophobicContact CB-CB 3.94Å; P609-W626 HydrophobicContact CB-CG 4.16Å; P609-Y639 HydrophobicContact CG-CD1 4.07Å; P609-Y639 HydrophobicContact CG-CE1 3.78Å; P609-V679 HydrophobicContact CG-CG1 4.45Å; P609-A681 HydrophobicContact CG-CB 3.84Å; P609-S691 WeakPolarHBondContact CD-OG 3.34Å; P609-S691 WeakPolarHBondContact O-CB 3.25Å; P609-S691 PolarHBondContact O-OG 2.85Å
610	I	88.5	Confident	79.5	Confident	94 Å²	94	61.2 Å²	61.2	48%	0.482	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	118.3	169	-62.2	177.7	0	0	0	107.2	W626 T627 Q629	I610-W626 CarbonylContact O-C 3.53Å; I610-W626 WeakPolarHBondContact O-CA 3.4Å; I610-W626 VanDerWaalsContact O-CB 3.25Å; I610-W626 WeakPolarHBondContact O-CB 3.33Å; I610-T627 PolarHBondContact N-O 2.81Å; I610-T627 PolarHBondContact O-N 2.86Å; I610-Q629 HydrophobicContact CG1-CG 4.29Å
611	L	86.5	Confident	79.1	Confident	26 Å²	26	62.4 Å²	62.4	14%	0.136	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	121.9	-168.9	177.6	60.6	0	0	0	112.4	P609 V624 K625 W626 V679 S691 T693	P609-L611 PolarHBondContact O-N 2.87Å; L611-V624 HydrophobicContact CD1-CB 4.2Å; L611-V624 HydrophobicContact CD1-CG2 4.37Å; L611-K625 WeakPolarHBondContact CD1-O 3.32Å; L611-W626 HydrophobicContact CD1-CB 4.3Å; L611-W626 HydrophobicContact CD1-CE3 4.31Å; L611-V679 HydrophobicContact CD1-CB 4.14Å; L611-V679 HydrophobicContact CD1-CG2 3.57Å; L611-V679 HydrophobicContact CD2-CB 4.07Å; L611-V679 HydrophobicContact CD2-CG2 3.87Å; L611-V679 HydrophobicContact CG-CG2 4.36Å; L611-S691 WeakPolarHBondContact CD2-O 3.36Å; L611-T693 HydrophobicContact CD2-CG2 3.55Å; L611-T693 HydrophobicContact CG-CG2 3.78Å
612	E	80.2	Confident	79	Confident	71 Å²	71	58.4 Å²	58.4	33%	0.332	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	129.2	-177	-62.3	167.2	172.6	0	0	110.1	I614 K625	E612-I614 HydrophobicContact CB-CD1 3.93Å; E612-I614 HydrophobicContact CB-CG1 3.87Å; E612-K625 PolarHBondContact N-O 2.98Å; E612-K625 PolarHBondContact O-N 2.87Å; E612-K625 IonicContact OE2-NZ 2.74Å; E612-K625 PolarHBondContact OE2-NZ 3.43Å
613	V	73.4	Confident	79.1	Confident	48 Å²	48	58.1 Å²	58.1	29%	0.291	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	121.3	166.3	-172.3	0	0	0	0	107.9	V624 T693 F695	V613-V624 HydrophobicContact CG1-CG1 4.29Å; V613-V624 HydrophobicContact CG2-CG1 4.04Å; V613-T693 HydrophobicContact CG2-CG2 3.39Å; V613-F695 HydrophobicContact CG1-CB 4.01Å; V613-F695 HydrophobicContact CG1-CD1 4.32Å; V613-F695 HydrophobicContact CG1-CG 4.21Å; V613-F695 HydrophobicContact CG2-CD1 4.47Å
614	I	67.2	Low	79.3	Confident	87 Å²	87	56.7 Å²	56.7	45%	0.446	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	-34.3	-167.6	-51.6	-167.1	0	0	0	113.5	E612 K623 K625	E612-I614 HydrophobicContact CB-CD1 3.93Å; E612-I614 HydrophobicContact CB-CG1 3.87Å; I614-K623 PolarHBondContact N-O 3.12Å; I614-K625 HydrophobicContact CD1-CB 3.77Å; I614-K625 HydrophobicContact CD1-CD 3.46Å; I614-K625 VanDerWaalsContact CD1-CD 3.46Å; I614-K625 HydrophobicContact CD1-CG 4.25Å; I614-K625 HydrophobicContact CG1-CB 4.24Å
615	L	66.1	Low	79.5	Confident	80 Å²	80	55.1 Å²	55.1	42%	0.419	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	130.8	170.1	-68.4	98.4	0	0	0	113.3	K617 K623	L615-K617 HydrophobicContact CB-CG 3.99Å; L615-K617 HydrophobicContact CD2-CD 4.41Å; L615-K617 HydrophobicContact CD2-CG 3.98Å; L615-K623 PolarHBondContact N-O 2.72Å; L615-K623 PolarHBondContact O-N 2.75Å
616	V	63.3	Low	79.8	Confident	57 Å²	57	50.5 Å²	50.5	35%	0.345	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	118.5	152.1	-179	0	0	0	0	106.5	A622 F695	V616-A622 HydrophobicContact CG2-CB 4.12Å; V616-F695 HydrophobicContact CG2-CD2 3.69Å; V616-F695 HydrophobicContact CG2-CE2 4.16Å
617	K	57.3	Low	79.8	Confident	163 Å²	163	53 Å²	53	71%	0.709	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112	-14.3	-172.9	-88.9	-144.3	176.2	-165	0	114.8	L615 S621	L615-K617 HydrophobicContact CB-CG 3.99Å; L615-K617 HydrophobicContact CD2-CD 4.41Å; L615-K617 HydrophobicContact CD2-CG 3.98Å; K617-S621 PolarHBondContact N-O 3.15Å
618	S	60	Low	79.7	Confident	49 Å²	49	55.6 Å²	55.6	34%	0.343	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	170.4	172.4	81.3	0	0	0	0	109.9	N620 S621	S618-N620 PolarHBondContact O-N 3.18Å; S618-N620 PolarHBondContact OG-N 3.17Å; S618-N620 VanDerWaalsContact OG-N 3.17Å; S618-S621 PolarHBondContact N-O 2.83Å; S618-S621 PolarHBondContact OG-N 3.24Å; S618-S621 PolarHBondContact OG-OG 3.07Å
619	S	64.8	Low	79.6	Confident	35 Å²	35	56.7 Å²	56.7	25%	0.245	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-20.3	174.7	65.1	0	0	0	0	112.9	W671	S619-W671 VanDerWaalsContact CB-CD1 3.45Å; S619-W671 VanDerWaalsContact CB-NE1 3.31Å; S619-W671 VanDerWaalsContact O-CD1 3.25Å; S619-W671 PolarHBondContact OG-NE1 2.89Å; S619-W671 VanDerWaalsContact OG-NE1 3.17Å
620	N	77.9	Confident	79.2	Confident	81 Å²	81	60.3 Å²	60.3	43%	0.433	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	11.3	-176.1	-165	0.7	0	0	0	113.5	S618 S667 G668 L669	S618-N620 PolarHBondContact O-N 3.18Å; S618-N620 PolarHBondContact OG-N 3.17Å; S618-N620 VanDerWaalsContact OG-N 3.17Å; N620-S667 WeakPolarHBondContact O-CA 3.2Å; N620-G668 PolarHBondContact O-N 2.9Å; N620-G668 WeakPolarHBondContact OD1-CA 3.44Å; N620-G668 PolarHBondContact OD1-N 3Å; N620-L669 PolarHBondContact OD1-N 2.87Å; N620-L669 PolarHBondContact OD1-O 3Å
621	S	82.6	Confident	78.9	Confident	27 Å²	27	57 Å²	57	19%	0.189	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	147.3	-179.9	65.8	0	0	0	0	116.4	K617 S618 L666	K617-S621 PolarHBondContact N-O 3.15Å; S618-S621 PolarHBondContact N-O 2.83Å; S618-S621 PolarHBondContact OG-N 3.24Å; S618-S621 PolarHBondContact OG-OG 3.07Å; S621-L666 WeakPolarHBondContact CA-O 3.01Å; S621-L666 WeakPolarHBondContact CB-O 3.32Å
622	A	85.3	Confident	78.6	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	145.7	-179.2	0	0	0	0	0	112.4	V616 L666 L669 F695	V616-A622 HydrophobicContact CG2-CB 4.12Å; A622-L666 PolarHBondContact N-O 3.4Å; A622-L666 VanDerWaalsContact N-O 3.14Å; A622-L666 PolarHBondContact O-N 2.85Å; A622-L669 HydrophobicContact CB-CD1 3.87Å; A622-F695 HydrophobicContact CB-CD2 4.26Å; A622-F695 HydrophobicContact CB-CE1 4.31Å; A622-F695 HydrophobicContact CB-CE2 3.52Å; A622-F695 HydrophobicContact CB-CZ 3.56Å
623	K	87.9	Confident	78.3	Confident	71 Å²	71	52.8 Å²	52.8	31%	0.309	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	124.8	178.1	-172.7	-178.5	-179.9	174.9	0	111.3	I614 L615 Y663 A664 M665	I614-K623 PolarHBondContact N-O 3.12Å; L615-K623 PolarHBondContact N-O 2.72Å; L615-K623 PolarHBondContact O-N 2.75Å; K623-Y663 HydrophobicContact CD-CD2 4.43Å; K623-A664 WeakPolarHBondContact CA-O 3.47Å; K623-M665 HydrophobicContact CB-CE 4.23Å; K623-M665 HydrophobicContact CB-SD 4.11Å
624	V	89.2	Confident	78.6	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	151.7	170	-54.7	0	0	0	0	110.5	L611 V613 W626 I641 Y663 A664 L666 V677	L611-V624 HydrophobicContact CD1-CB 4.2Å; L611-V624 HydrophobicContact CD1-CG2 4.37Å; V613-V624 HydrophobicContact CG1-CG1 4.29Å; V613-V624 HydrophobicContact CG2-CG1 4.04Å; V624-W626 HydrophobicContact CG2-CZ3 4.25Å; V624-I641 HydrophobicContact CG2-CD1 3.51Å; V624-Y663 CarbonylContact O-C 3.6Å; V624-Y663 WeakPolarHBondContact O-CA 3.45Å; V624-Y663 WeakPolarHBondContact O-CB 3.29Å; V624-A664 HydrophobicContact CG2-CB 4.01Å; V624-A664 PolarHBondContact N-O 2.99Å; V624-A664 VanDerWaalsContact N-O 3.12Å; V624-A664 PolarHBondContact O-N 2.91Å; V624-L666 HydrophobicContact CG1-CD1 4.29Å; V624-V677 HydrophobicContact CG1-CG1 4.36Å; V624-V677 HydrophobicContact CG1-CG2 4.43Å; V624-V677 HydrophobicContact CG2-CG1 4.46Å
625	K	91.6	Very high	79.3	Confident	65 Å²	65	51.3 Å²	51.3	28%	0.283	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	152	-179.1	-175.8	-157.6	153.1	-137.4	0	109	L611 E612 I614 N662	L611-K625 WeakPolarHBondContact CD1-O 3.32Å; E612-K625 PolarHBondContact N-O 2.98Å; E612-K625 PolarHBondContact O-N 2.87Å; E612-K625 IonicContact OE2-NZ 2.74Å; E612-K625 PolarHBondContact OE2-NZ 3.43Å; I614-K625 HydrophobicContact CD1-CB 3.77Å; I614-K625 HydrophobicContact CD1-CD 3.46Å; I614-K625 VanDerWaalsContact CD1-CD 3.46Å; I614-K625 HydrophobicContact CD1-CG 4.25Å; I614-K625 HydrophobicContact CG1-CB 4.24Å; K625-N662 CarbonylContact C-O 3.56Å; K625-N662 WeakPolarHBondContact CA-O 3.09Å; K625-N662 WeakPolarHBondContact CG-O 3.17Å
626	W	92.7	Very high	80.4	Confident	1 Å²	1	48 Å²	48	0%	0.004	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	161.7	171.9	56.9	90	0	0	0	112.8	P609 I610 L611 V624 Y639 L657 S661 N662 Y663 A664 V679	P609-W626 HydrophobicContact CB-CB 3.94Å; P609-W626 HydrophobicContact CB-CG 4.16Å; I610-W626 CarbonylContact O-C 3.53Å; I610-W626 WeakPolarHBondContact O-CA 3.4Å; I610-W626 VanDerWaalsContact O-CB 3.25Å; I610-W626 WeakPolarHBondContact O-CB 3.33Å; L611-W626 HydrophobicContact CD1-CB 4.3Å; L611-W626 HydrophobicContact CD1-CE3 4.31Å; V624-W626 HydrophobicContact CG2-CZ3 4.25Å; W626-Y639 AromaticContact CD1-CD1 3.94Å; W626-Y639 AromaticContact CD1-CE1 3.65Å; W626-Y639 AromaticContact CD1-CZ 3.88Å; W626-Y639 AromaticContact CE2-CD1 4Å; W626-Y639 AromaticContact CE2-CD2 3.96Å; W626-Y639 AromaticContact CE2-CG 3.77Å; W626-Y639 HydrophobicContact CZ2-CD1 4.45Å; W626-Y639 AromaticContact CZ2-CD2 3.89Å; W626-Y639 HydrophobicContact CZ2-CD2 3.89Å; W626-Y639 AromaticContact CZ2-CG 3.79Å; W626-Y639 HydrophobicContact CZ2-CG 3.79Å; W626-Y639 AromaticContact NE1-CD1 3.33Å; W626-Y639 VanDerWaalsContact NE1-CD1 3.33Å; W626-Y639 AromaticContact NE1-CD2 3.45Å; W626-Y639 AromaticContact NE1-CE1 3.31Å; W626-Y639 VanDerWaalsContact NE1-CE1 3.31Å; W626-Y639 AromaticContact NE1-CE2 3.43Å; W626-Y639 AromaticContact NE1-CG 3.4Å; W626-Y639 AromaticContact NE1-CZ 3.37Å; W626-L657 HydrophobicContact CH2-CD1 3.73Å; W626-L657 HydrophobicContact CZ2-CD1 4.47Å; W626-S661 WeakPolarHBondContact CZ2-O 3.42Å; W626-S661 PolarHBondContact NE1-O 3.19Å; W626-S661 VanDerWaalsContact NE1-O 3.13Å; W626-N662 PolarHBondContact N-O 2.89Å; W626-N662 WeakPolarHBondContact O-CB 3.25Å; W626-Y663 VanDerWaalsContact CH2-O 3.29Å; W626-Y663 WeakPolarHBondContact CH2-O 3.29Å; W626-A664 HydrophobicContact CH2-CB 4.04Å; W626-A664 HydrophobicContact CZ3-CB 3.85Å; W626-V679 HydrophobicContact CD2-CG1 3.84Å; W626-V679 HydrophobicContact CE3-CG1 3.98Å; W626-V679 HydrophobicContact CE3-CG2 3.95Å; W626-V679 HydrophobicContact CG-CG1 4.15Å; W626-V679 HydrophobicContact CZ3-CG1 4.43Å; W626-V679 HydrophobicContact CZ3-CG2 4.18Å
627	T	90.8	Very high	81.8	Confident	58 Å²	58	49.8 Å²	49.8	36%	0.356	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	128.9	175.3	-61	0	0	0	0	109.6	I610	I610-T627 PolarHBondContact N-O 2.81Å; I610-T627 PolarHBondContact O-N 2.86Å
628	K	86.9	Confident	83.5	Confident	110 Å²	110	46.3 Å²	46.3	48%	0.478	25%	0.245	S	C	.	.			trans	-57.3	136.1	173.8	173.7	176.5	179.6	-164.2	0	109.7	D631 I636	K628-D631 IonicContact NZ-OD2 3.19Å; K628-D631 PolarHBondContact NZ-OD2 3.33Å; K628-I636 HydrophobicContact CD-CD1 4.09Å; K628-I636 HydrophobicContact CG-CD1 3.95Å
629	Q	88.9	Confident	85.1	Confident	63 Å²	63	44.3 Å²	44.3	29%	0.294	23%	0.23	S	C	.	.			trans	-108	-174.4	168.1	-65.1	-57.5	-56.1	0	0	110.4	T607 S608 I610 D631	T607-Q629 HydrophobicContact CG2-CB 3.98Å; T607-Q629 HydrophobicContact CG2-CG 4.41Å; S608-Q629 VanDerWaalsContact O-CG 3.29Å; S608-Q629 WeakPolarHBondContact O-CG 3.4Å; I610-Q629 HydrophobicContact CG1-CG 4.29Å; Q629-D631 PolarHBondContact O-N 3.16Å
630	D	82.1	Confident	86.5	Confident	80 Å²	80	42.7 Å²	42.7	43%	0.428	22%	0.218	S	C	.	.			trans	-49.4	127.9	171.3	-178.5	-2.5	0	0	0	110.8	R604 T607 G632	R604-D630 IonicContact CZ-OD2 2.67Å; R604-D630 IonicContact NE-OD2 2.76Å; R604-D630 IonicContact NH2-OD1 2.84Å; R604-D630 IonicContact NH2-OD2 3.73Å; R604-D630 PolarHBondContact NH2-OD2 3.3Å; T607-D630 PolarHBondContact N-O 3.45Å; D630-G632 VanDerWaalsContact C-N 3.32Å; D630-G632 PolarHBondContact OD1-N 3.09Å
631	D	82.9	Confident	87.3	Confident	25 Å²	25	39 Å²	39	13%	0.134	20%	0.198	C	C	.	.			trans	-87.6	2.8	-177.3	61.5	35.1	0	0	0	114.1	K628 Q629 G633 S634 I636 N683	K628-D631 IonicContact NZ-OD2 3.19Å; K628-D631 PolarHBondContact NZ-OD2 3.33Å; Q629-D631 PolarHBondContact O-N 3.16Å; D631-G633 VanDerWaalsContact C-N 3.26Å; D631-G633 PolarHBondContact O-N 3.11Å; D631-G633 PolarHBondContact OD1-N 2.98Å; D631-S634 WeakPolarHBondContact CB-O 3.25Å; D631-S634 VanDerWaalsContact O-O 3.12Å; D631-I636 HydrophobicContact CB-CD1 4.26Å; D631-I636 HydrophobicContact CB-CG1 3.74Å; D631-N683 PolarHBondContact O-ND2 2.8Å
632	G	79.2	Confident	87.8	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	14.6	179.1	0	0	0	0	0	114.1	S518 V603 R604 D630	S518-G632 PolarHBondContact OG-O 2.83Å; V603-G632 WeakPolarHBondContact CA-O 3.41Å; R604-G632 PolarHBondContact N-O 3.3Å; R604-G632 VanDerWaalsContact N-O 3.1Å; D630-G632 VanDerWaalsContact C-N 3.32Å; D630-G632 PolarHBondContact OD1-N 3.09Å
633	G	73.7	Confident	88.1	Confident	8 Å²	8	43.5 Å²	43.5	8%	0.082	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.2	10.2	177.7	0	0	0	0	0	115.2	S518 D631	S518-G633 VanDerWaalsContact OG-CA 3.3Å; S518-G633 WeakPolarHBondContact OG-CA 3.28Å; D631-G633 VanDerWaalsContact C-N 3.26Å; D631-G633 PolarHBondContact O-N 3.11Å; D631-G633 PolarHBondContact OD1-N 2.98Å
634	S	80.8	Confident	88.3	Confident	10 Å²	10	41.3 Å²	41.3	7%	0.07	20%	0.202	C	C	.	.	S	Bend	trans	-127.9	130.3	165.1	177.6	0	0	0	0	107.9	D631 I636 N683 Q684	D631-S634 WeakPolarHBondContact CB-O 3.25Å; D631-S634 VanDerWaalsContact O-O 3.12Å; S634-I636 PolarHBondContact O-N 2.76Å; S634-N683 WeakPolarHBondContact O-CB 3.48Å; S634-Q684 WeakPolarHBondContact OG-CB 3.1Å
635	P	82.3	Confident	88.3	Confident	94 Å²	94	41.5 Å²	41.5	61%	0.61	20%	0.204	S	C	*	.			trans	-51	133.1	-179.8	-27.8	34.9	0	0	0	111.8	I637	P635-I637 PolarHBondContact O-N 3.1Å
636	I	88.3	Confident	88.1	Confident	12 Å²	12	43.1 Å²	43.1	6%	0.062	21%	0.21	C	C	.	.			trans	-51.2	128.1	168	-62.8	171.5	0	0	0	107.3	P606 K628 D631 S634 R638 Y639 S659 A681 E682	P606-I636 HydrophobicContact CB-CG1 4.5Å; P606-I636 HydrophobicContact CG-CG1 4.45Å; K628-I636 HydrophobicContact CD-CD1 4.09Å; K628-I636 HydrophobicContact CG-CD1 3.95Å; D631-I636 HydrophobicContact CB-CD1 4.26Å; D631-I636 HydrophobicContact CB-CG1 3.74Å; S634-I636 PolarHBondContact O-N 2.76Å; I636-R638 WeakPolarHBondContact CG2-O 3.39Å; I636-Y639 HydrophobicContact CD1-CE1 4.13Å; I636-Y639 WeakPolarHBondContact CD1-OH 3.39Å; I636-Y639 HydrophobicContact CG2-CE1 4.35Å; I636-Y639 HydrophobicContact CG2-CE2 4.26Å; I636-S659 WeakPolarHBondContact O-CB 3.41Å; I636-S659 PolarHBondContact O-OG 2.91Å; I636-A681 HydrophobicContact CD1-CB 3.99Å; I636-A681 HydrophobicContact CG1-CB 4.34Å; I636-A681 HydrophobicContact CG2-CB 4.4Å; I636-E682 CarbonylContact C-O 3.58Å; I636-E682 WeakPolarHBondContact CA-O 3.48Å; I636-E682 WeakPolarHBondContact CG2-O 3.33Å
637	I	91.8	Very high	87.8	Confident	94 Å²	94	49.6 Å²	49.6	48%	0.482	24%	0.241	S	C	.	.			trans	-91.4	-33.3	178.9	54.1	163.5	0	0	0	111.2	P635 E682	P635-I637 PolarHBondContact O-N 3.1Å; I637-E682 HydrophobicContact CD1-CG 4.42Å; I637-E682 HydrophobicContact CG1-CB 4.49Å; I637-E682 WeakPolarHBondContact CG1-O 3.22Å; I637-E682 PolarHBondContact N-O 2.97Å
638	R	93.3	Very high	87.7	Confident	90 Å²	90	51.4 Å²	51.4	34%	0.34	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	161.9	174.7	59.1	-171.4	179	-150.3	-15.5	111.5	I636 L640 H656 L657 E682	I636-R638 WeakPolarHBondContact CG2-O 3.39Å; R638-L640 HydrophobicContact CG-CD1 4.18Å; R638-H656 WeakPolarHBondContact CD-ND1 3.13Å; R638-H656 PolarHBondContact NE-ND1 2.88Å; R638-L657 CarbonylContact C-O 3.58Å; R638-L657 VanDerWaalsContact CA-O 3.26Å; R638-L657 WeakPolarHBondContact CA-O 3.48Å; R638-L657 WeakPolarHBondContact CB-O 3.18Å; R638-E682 HydrophobicContact CG-CB 4.42Å; R638-E682 IonicContact CZ-OE2 3.95Å; R638-E682 PolarHBondContact N-O 3.25Å; R638-E682 IonicContact NE-OE2 3.43Å; R638-E682 PolarHBondContact NE-OE2 2.99Å; R638-E682 IonicContact NH2-OE1 2.77Å; R638-E682 IonicContact NH2-OE2 3.85Å; R638-E682 PolarHBondContact NH2-OE2 2.88Å; R638-E682 PolarHBondContact O-N 2.68Å
639	Y	95.3	Very high	87.6	Confident	6 Å²	6	50.6 Å²	50.6	2%	0.024	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	152.4	160.5	-62.8	-83.3	0	0	0	109.8	P609 W626 I636 L657 S659 S661 V679 V680 A681	P609-Y639 HydrophobicContact CG-CD1 4.07Å; P609-Y639 HydrophobicContact CG-CE1 3.78Å; W626-Y639 AromaticContact CD1-CD1 3.94Å; W626-Y639 AromaticContact CD1-CE1 3.65Å; W626-Y639 AromaticContact CD1-CZ 3.88Å; W626-Y639 AromaticContact CE2-CD1 4Å; W626-Y639 AromaticContact CE2-CD2 3.96Å; W626-Y639 AromaticContact CE2-CG 3.77Å; W626-Y639 HydrophobicContact CZ2-CD1 4.45Å; W626-Y639 AromaticContact CZ2-CD2 3.89Å; W626-Y639 HydrophobicContact CZ2-CD2 3.89Å; W626-Y639 AromaticContact CZ2-CG 3.79Å; W626-Y639 HydrophobicContact CZ2-CG 3.79Å; W626-Y639 AromaticContact NE1-CD1 3.33Å; W626-Y639 VanDerWaalsContact NE1-CD1 3.33Å; W626-Y639 AromaticContact NE1-CD2 3.45Å; W626-Y639 AromaticContact NE1-CE1 3.31Å; W626-Y639 VanDerWaalsContact NE1-CE1 3.31Å; W626-Y639 AromaticContact NE1-CE2 3.43Å; W626-Y639 AromaticContact NE1-CG 3.4Å; W626-Y639 AromaticContact NE1-CZ 3.37Å; I636-Y639 HydrophobicContact CD1-CE1 4.13Å; I636-Y639 WeakPolarHBondContact CD1-OH 3.39Å; I636-Y639 HydrophobicContact CG2-CE1 4.35Å; I636-Y639 HydrophobicContact CG2-CE2 4.26Å; Y639-L657 PolarHBondContact N-O 2.89Å; Y639-L657 PolarHBondContact O-N 2.96Å; Y639-S659 WeakPolarHBondContact CE2-O 3.27Å; Y639-S661 WeakPolarHBondContact CD2-O 3.28Å; Y639-S661 WeakPolarHBondContact CE2-O 3.48Å; Y639-V679 HydrophobicContact CD1-CG1 4.41Å; Y639-V680 CarbonylContact C-O 3.55Å; Y639-V680 VanDerWaalsContact CA-O 3.26Å; Y639-V680 WeakPolarHBondContact CA-O 3.44Å; Y639-A681 HydrophobicContact CD1-CB 3.94Å; Y639-A681 HydrophobicContact CE1-CB 3.78Å
640	L	94.3	Very high	87.6	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	135.5	176.6	-55.5	96	0	0	0	109	R638 E654 T655 H656 V679 V680 E682 R687	R638-L640 HydrophobicContact CG-CD1 4.18Å; L640-E654 HydrophobicContact CB-CG 4.04Å; L640-E654 VanDerWaalsContact CD2-CD 3.42Å; L640-E654 HydrophobicContact CD2-CG 3.92Å; L640-E654 WeakPolarHBondContact CD2-OE1 3.15Å; L640-T655 WeakPolarHBondContact CA-O 3.38Å; L640-H656 WeakPolarHBondContact CD2-CE1 3.46Å; L640-H656 VanDerWaalsContact CD2-ND1 3.35Å; L640-H656 WeakPolarHBondContact CD2-ND1 3.43Å; L640-V679 WeakPolarHBondContact O-CA 3.41Å; L640-V680 HydrophobicContact CB-CB 4.38Å; L640-V680 HydrophobicContact CD1-CG1 4.14Å; L640-V680 PolarHBondContact N-O 3.3Å; L640-V680 PolarHBondContact O-N 3.38Å; L640-E682 HydrophobicContact CD1-CB 3.51Å; L640-E682 HydrophobicContact CD1-CG 4.32Å; L640-R687 VanDerWaalsContact CD2-CZ 3.44Å
641	I	93.3	Very high	88	Confident	3 Å²	3	52.6 Å²	52.6	2%	0.015	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	134.4	-179.3	-173.3	171.2	0	0	0	111.4	V624 T655 L657 A664 L666 V677 R678 V679	V624-I641 HydrophobicContact CG2-CD1 3.51Å; I641-T655 HydrophobicContact CG2-CG2 4.34Å; I641-T655 PolarHBondContact N-O 2.85Å; I641-T655 PolarHBondContact O-N 3.36Å; I641-L657 HydrophobicContact CG2-CD1 3.99Å; I641-A664 HydrophobicContact CD1-CB 3.56Å; I641-A664 HydrophobicContact CG2-CB 4.27Å; I641-L666 HydrophobicContact CD1-CD2 3.73Å; I641-L666 HydrophobicContact CG1-CD2 4.4Å; I641-V677 HydrophobicContact CD1-CG1 3.79Å; I641-V677 HydrophobicContact CG1-CG1 3.91Å; I641-R678 WeakPolarHBondContact CA-O 3.38Å; I641-V679 HydrophobicContact CB-CG2 4.24Å; I641-V679 HydrophobicContact CD1-CG2 3.87Å; I641-V679 HydrophobicContact CG1-CG2 3.9Å
642	R	92.6	Very high	88.3	Confident	97 Å²	97	55 Å²	55	37%	0.366	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	149.3	170.3	-59.9	-174.2	-168.8	-145.4	-5.3	109.4	W651 E654 V677 R678	R642-W651 HydrophobicContact CB-CD2 4.23Å; R642-W651 HydrophobicContact CB-CE3 3.6Å; R642-W651 HydrophobicContact CB-CZ3 4.24Å; R642-E654 HydrophobicContact CG-CB 4.01Å; R642-E654 HydrophobicContact CG-CG 4.2Å; R642-E654 IonicContact CZ-OE1 3.74Å; R642-E654 IonicContact CZ-OE2 3.51Å; R642-E654 VanDerWaalsContact CZ-OE2 3.29Å; R642-E654 VanDerWaalsContact NE-CD 3.34Å; R642-E654 IonicContact NE-OE1 2.78Å; R642-E654 IonicContact NE-OE2 3.61Å; R642-E654 PolarHBondContact NE-OE2 2.76Å; R642-E654 IonicContact NH2-OE1 3.34Å; R642-E654 PolarHBondContact NH2-OE1 3.04Å; R642-E654 IonicContact NH2-OE2 2.71Å; R642-E654 PolarHBondContact NH2-OE2 3.21Å; R642-V677 WeakPolarHBondContact O-CA 3.49Å; R642-R678 PolarHBondContact N-O 2.82Å; R642-R678 PolarHBondContact O-N 2.87Å
643	Y	92	Very high	88.7	Confident	26 Å²	26	60.3 Å²	60.3	10%	0.102	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	150.1	175.1	59.2	-72.6	0	0	0	110.5	W651 K652 L666 S667 L669 Y675 E676	Y643-W651 VanDerWaalsContact C-CE3 3.48Å; Y643-K652 HydrophobicContact CD1-CB 4.33Å; Y643-K652 HydrophobicContact CD2-CB 4.39Å; Y643-K652 HydrophobicContact CD2-CG 4.05Å; Y643-K652 HydrophobicContact CE1-CB 4.03Å; Y643-K652 HydrophobicContact CE2-CB 4.1Å; Y643-K652 HydrophobicContact CE2-CD 4.21Å; Y643-K652 HydrophobicContact CE2-CG 3.77Å; Y643-K652 HydrophobicContact CG-CB 4.48Å; Y643-K652 VanDerWaalsContact O-CB 3.32Å; Y643-K652 WeakPolarHBondContact O-CB 3.49Å; Y643-K652 WeakPolarHBondContact O-CG 3.43Å; Y643-K652 PolarHBondContact O-N 2.89Å; Y643-L666 HydrophobicContact CD1-CD2 3.6Å; Y643-L666 HydrophobicContact CD2-CD1 4.46Å; Y643-L666 HydrophobicContact CE1-CD2 3.91Å; Y643-L666 HydrophobicContact CG-CD1 4.14Å; Y643-L666 HydrophobicContact CG-CD2 4.03Å; Y643-S667 PolarHBondContact OH-O 2.78Å; Y643-L669 HydrophobicContact CD2-CD2 3.75Å; Y643-L669 HydrophobicContact CE2-CD2 3.65Å; Y643-Y675 HydrophobicContact CD2-CD1 4.31Å; Y643-E676 CarbonylContact C-O 3.58Å; Y643-E676 VanDerWaalsContact CA-O 3.23Å; Y643-E676 WeakPolarHBondContact CA-O 3.42Å
644	K	92.7	Very high	89.6	Confident	25 Å²	25	61.9 Å²	61.9	11%	0.109	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	151.6	172.4	71.9	176.8	-170.9	71.4	0	111.3	K646 M648 S649 D650 W651 Y675 E676	K644-K646 PolarHBondContact NZ-O 2.95Å; K644-M648 WeakPolarHBondContact CD-O 3.36Å; K644-M648 WeakPolarHBondContact CE-O 3.44Å; K644-M648 PolarHBondContact NZ-O 2.93Å; K644-S649 WeakPolarHBondContact CD-O 3.42Å; K644-D650 VanDerWaalsContact CB-O 3.23Å; K644-D650 WeakPolarHBondContact CB-O 3.43Å; K644-W651 HydrophobicContact CB-CD2 4.23Å; K644-W651 HydrophobicContact CB-CE3 3.97Å; K644-W651 HydrophobicContact CB-CZ3 4.31Å; K644-W651 HydrophobicContact CD-CD2 3.87Å; K644-W651 HydrophobicContact CD-CE3 4.28Å; K644-W651 HydrophobicContact CD-CG 4.29Å; K644-W651 HydrophobicContact CD-CH2 4.26Å; K644-W651 HydrophobicContact CD-CZ2 3.84Å; K644-W651 HydrophobicContact CD-CZ3 4.48Å; K644-W651 HydrophobicContact CG-CD2 4.06Å; K644-W651 HydrophobicContact CG-CE3 3.93Å; K644-W651 HydrophobicContact CG-CH2 3.96Å; K644-W651 HydrophobicContact CG-CZ2 4.07Å; K644-W651 HydrophobicContact CG-CZ3 3.91Å; K644-Y675 CarbonylContact O-C 3.58Å; K644-Y675 VanDerWaalsContact O-CA 3.27Å; K644-Y675 WeakPolarHBondContact O-CA 3.24Å; K644-Y675 WeakPolarHBondContact O-CD1 3.49Å; K644-E676 PolarHBondContact N-O 2.67Å; K644-E676 PolarHBondContact O-N 2.69Å
645	A	89.1	Confident	90.1	Very high	4 Å²	4	64.4 Å²	64.4	3%	0.033	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	139.5	165.6	0	0	0	0	0	108.5	H647 M648 T673 D674 Y675	A645-H647 PolarHBondContact O-N 3.11Å; A645-M648 HydrophobicContact CB-CG 4.14Å; A645-M648 PolarHBondContact O-N 3.44Å; A645-T673 HydrophobicContact CB-CG2 3.71Å; A645-D674 CarbonylContact C-O 3.51Å; A645-D674 WeakPolarHBondContact CA-O 3.44Å; A645-Y675 HydrophobicContact CB-CD1 4.29Å; A645-Y675 HydrophobicContact CB-CE1 3.83Å; A645-Y675 VanDerWaalsContact N-CD1 3.33Å
646	K	87.8	Confident	90.7	Very high	98 Å²	98	64.1 Å²	64.1	43%	0.426	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-33.5	-175.5	-73.6	-168.7	-177.1	175.1	0	112.5	K644 M648 D674 E676 S694	K644-K646 PolarHBondContact NZ-O 2.95Å; K646-M648 VanDerWaalsContact C-N 3.33Å; K646-M648 PolarHBondContact O-N 2.64Å; K646-D674 HydrophobicContact CB-CB 4.25Å; K646-D674 HydrophobicContact CD-CB 3.79Å; K646-D674 HydrophobicContact CG-CB 3.96Å; K646-D674 PolarHBondContact N-O 3.45Å; K646-E676 HydrophobicContact CG-CB 4.48Å; K646-S694 WeakPolarHBondContact CE-OG 3.38Å; K646-S694 VanDerWaalsContact NZ-CB 3.33Å; K646-S694 PolarHBondContact NZ-OG 3.1Å
647	H	85.4	Confident	90.9	Very high	138 Å²	138	65.2 Å²	65.2	64%	0.639	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-17.4	178.2	67.2	-108	0	0	0	114.4	A645	A645-H647 PolarHBondContact O-N 3.11Å
648	M	88.8	Confident	90.9	Very high	95 Å²	95	64.4 Å²	64.4	47%	0.468	32%	0.323	S	S	.	.			trans	-87.3	144.2	175.3	-67.1	-62.7	-74.1	0	0	110.5	K644 A645 K646	K644-M648 WeakPolarHBondContact CD-O 3.36Å; K644-M648 WeakPolarHBondContact CE-O 3.44Å; K644-M648 PolarHBondContact NZ-O 2.93Å; A645-M648 HydrophobicContact CB-CG 4.14Å; A645-M648 PolarHBondContact O-N 3.44Å; K646-M648 VanDerWaalsContact C-N 3.33Å; K646-M648 PolarHBondContact O-N 2.64Å
649	S	85.4	Confident	90.7	Very high	93 Å²	93	62.5 Å²	62.5	65%	0.65	32%	0.323	S	S	*	.	S	Bend	trans	-68	-42.4	165.8	48.1	0	0	0	0	111.5	K644	K644-S649 WeakPolarHBondContact CD-O 3.42Å
650	D	89.6	Confident	90.5	Very high	112 Å²	112	68.2 Å²	68.2	60%	0.599	36%	0.359	S	S	*	.	S	Bend	trans	-90.9	144.5	-159.2	-59.2	-5.3	0	0	0	112.6	K644	K644-D650 VanDerWaalsContact CB-O 3.23Å; K644-D650 WeakPolarHBondContact CB-O 3.43Å
651	W	90.4	Very high	90.3	Very high	74 Å²	74	69.6 Å²	69.6	28%	0.28	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-86.3	138.5	177.7	-67.9	88.4	0	0	0	111.5	R642 Y643 K644 E676 R678	R642-W651 HydrophobicContact CB-CD2 4.23Å; R642-W651 HydrophobicContact CB-CE3 3.6Å; R642-W651 HydrophobicContact CB-CZ3 4.24Å; Y643-W651 VanDerWaalsContact C-CE3 3.48Å; K644-W651 HydrophobicContact CB-CD2 4.23Å; K644-W651 HydrophobicContact CB-CE3 3.97Å; K644-W651 HydrophobicContact CB-CZ3 4.31Å; K644-W651 HydrophobicContact CD-CD2 3.87Å; K644-W651 HydrophobicContact CD-CE3 4.28Å; K644-W651 HydrophobicContact CD-CG 4.29Å; K644-W651 HydrophobicContact CD-CH2 4.26Å; K644-W651 HydrophobicContact CD-CZ2 3.84Å; K644-W651 HydrophobicContact CD-CZ3 4.48Å; K644-W651 HydrophobicContact CG-CD2 4.06Å; K644-W651 HydrophobicContact CG-CE3 3.93Å; K644-W651 HydrophobicContact CG-CH2 3.96Å; K644-W651 HydrophobicContact CG-CZ2 4.07Å; K644-W651 HydrophobicContact CG-CZ3 3.91Å; W651-E676 HydrophobicContact CH2-CB 4.14Å; W651-E676 HydrophobicContact CH2-CG 3.94Å; W651-E676 VanDerWaalsContact CH2-OE1 3.29Å; W651-E676 WeakPolarHBondContact CH2-OE1 3.4Å; W651-R678 HydrophobicContact CH2-CG 3.68Å; W651-R678 VanDerWaalsContact CH2-NE 3.35Å; W651-R678 HydrophobicContact CZ2-CG 4.37Å; W651-R678 VanDerWaalsContact CZ2-NE 3.28Å; W651-R678 HydrophobicContact CZ3-CG 4.08Å
652	K	87.8	Confident	90.2	Very high	74 Å²	74	73.3 Å²	73.3	32%	0.322	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-60.8	150.8	164	-58.5	-98.5	-179.6	159.6	0	108.4	Y643 G668	Y643-K652 HydrophobicContact CD1-CB 4.33Å; Y643-K652 HydrophobicContact CD2-CB 4.39Å; Y643-K652 HydrophobicContact CD2-CG 4.05Å; Y643-K652 HydrophobicContact CE1-CB 4.03Å; Y643-K652 HydrophobicContact CE2-CB 4.1Å; Y643-K652 HydrophobicContact CE2-CD 4.21Å; Y643-K652 HydrophobicContact CE2-CG 3.77Å; Y643-K652 HydrophobicContact CG-CB 4.48Å; Y643-K652 VanDerWaalsContact O-CB 3.32Å; Y643-K652 WeakPolarHBondContact O-CB 3.49Å; Y643-K652 WeakPolarHBondContact O-CG 3.43Å; Y643-K652 PolarHBondContact O-N 2.89Å; K652-G668 PolarHBondContact NZ-O 3Å
653	P	89.2	Confident	90.2	Very high	112 Å²	112	74.5 Å²	74.5	73%	0.727	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-52	144.4	-174.3	-29.9	36.4	0	0	0	114.7	T655	P653-T655 PolarHBondContact O-N 2.98Å
654	E	90.9	Very high	90.1	Very high	42 Å²	42	73.6 Å²	73.6	20%	0.196	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-65.2	119.4	179.8	-176.2	154.3	73.1	0	0	111	L640 R642 R687	L640-E654 HydrophobicContact CB-CG 4.04Å; L640-E654 VanDerWaalsContact CD2-CD 3.42Å; L640-E654 HydrophobicContact CD2-CG 3.92Å; L640-E654 WeakPolarHBondContact CD2-OE1 3.15Å; R642-E654 HydrophobicContact CG-CB 4.01Å; R642-E654 HydrophobicContact CG-CG 4.2Å; R642-E654 IonicContact CZ-OE1 3.74Å; R642-E654 IonicContact CZ-OE2 3.51Å; R642-E654 VanDerWaalsContact CZ-OE2 3.29Å; R642-E654 VanDerWaalsContact NE-CD 3.34Å; R642-E654 IonicContact NE-OE1 2.78Å; R642-E654 IonicContact NE-OE2 3.61Å; R642-E654 PolarHBondContact NE-OE2 2.76Å; R642-E654 IonicContact NH2-OE1 3.34Å; R642-E654 PolarHBondContact NH2-OE1 3.04Å; R642-E654 IonicContact NH2-OE2 2.71Å; R642-E654 PolarHBondContact NH2-OE2 3.21Å; E654-R687 IonicContact OE1-CZ 3.11Å; E654-R687 IonicContact OE1-NH1 3.28Å; E654-R687 PolarHBondContact OE1-NH1 2.84Å; E654-R687 IonicContact OE1-NH2 3.6Å; E654-R687 PolarHBondContact OE1-NH2 2.88Å; E654-R687 IonicContact OE2-NH1 2.73Å; E654-R687 PolarHBondContact OE2-NH1 2.76Å
655	T	92.6	Very high	89.8	Confident	63 Å²	63	77.8 Å²	77.8	39%	0.387	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	126.3	174.8	-56.9	0	0	0	0	108.9	L640 I641 P653 L657	L640-T655 WeakPolarHBondContact CA-O 3.38Å; I641-T655 HydrophobicContact CG2-CG2 4.34Å; I641-T655 PolarHBondContact N-O 2.85Å; I641-T655 PolarHBondContact O-N 3.36Å; P653-T655 PolarHBondContact O-N 2.98Å; T655-L657 HydrophobicContact CG2-CD2 4.13Å; T655-L657 HydrophobicContact CG2-CG 4.32Å
656	H	94	Very high	89.8	Confident	87 Å²	87	77.8 Å²	77.8	40%	0.403	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	132.2	178.2	-63.6	-105.7	0	0	0	109.9	R638 L640	R638-H656 WeakPolarHBondContact CD-ND1 3.13Å; R638-H656 PolarHBondContact NE-ND1 2.88Å; L640-H656 WeakPolarHBondContact CD2-CE1 3.46Å; L640-H656 VanDerWaalsContact CD2-ND1 3.35Å; L640-H656 WeakPolarHBondContact CD2-ND1 3.43Å
657	L	93.3	Very high	89.7	Confident	36 Å²	36	76.5 Å²	76.5	19%	0.188	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	141.9	-174.9	-63.3	172.2	0	0	0	111	W626 R638 Y639 I641 T655 A664	W626-L657 HydrophobicContact CH2-CD1 3.73Å; W626-L657 HydrophobicContact CZ2-CD1 4.47Å; R638-L657 CarbonylContact C-O 3.58Å; R638-L657 VanDerWaalsContact CA-O 3.26Å; R638-L657 WeakPolarHBondContact CA-O 3.48Å; R638-L657 WeakPolarHBondContact CB-O 3.18Å; Y639-L657 PolarHBondContact N-O 2.89Å; Y639-L657 PolarHBondContact O-N 2.96Å; I641-L657 HydrophobicContact CG2-CD1 3.99Å; T655-L657 HydrophobicContact CG2-CD2 4.13Å; T655-L657 HydrophobicContact CG2-CG 4.32Å; L657-A664 HydrophobicContact CD1-CB 3.64Å
658	P	91.8	Very high	89.7	Confident	76 Å²	76	71.6 Å²	71.6	49%	0.494	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.1	151.1	179.6	-28.3	35	0	0	0	113.7	T660 S661	P658-T660 PolarHBondContact O-N 2.72Å; P658-T660 VanDerWaalsContact O-N 3.11Å; P658-S661 WeakPolarHBondContact O-CB 3.43Å; P658-S661 PolarHBondContact O-N 3.41Å; P658-S661 PolarHBondContact O-OG 2.84Å
659	S	89.2	Confident	89.6	Confident	50 Å²	50	67.3 Å²	67.3	35%	0.35	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-14.1	178.3	54.5	0	0	0	0	115.5	I636 Y639 S661	I636-S659 WeakPolarHBondContact O-CB 3.41Å; I636-S659 PolarHBondContact O-OG 2.91Å; Y639-S659 WeakPolarHBondContact CE2-O 3.27Å; S659-S661 VanDerWaalsContact C-N 3.34Å
660	T	89.4	Confident	89.6	Confident	127 Å²	127	66.9 Å²	66.9	78%	0.779	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-10.5	169.3	51.3	0	0	0	0	113.5	P658	P658-T660 PolarHBondContact O-N 2.72Å; P658-T660 VanDerWaalsContact O-N 3.11Å
661	S	91.2	Very high	89.3	Confident	30 Å²	30	67 Å²	67	21%	0.21	36%	0.364	C	S	.	.			trans	-76.3	131.5	178.8	-61.6	0	0	0	0	111.3	W626 Y639 P658 S659	W626-S661 WeakPolarHBondContact CZ2-O 3.42Å; W626-S661 PolarHBondContact NE1-O 3.19Å; W626-S661 VanDerWaalsContact NE1-O 3.13Å; Y639-S661 WeakPolarHBondContact CD2-O 3.28Å; Y639-S661 WeakPolarHBondContact CE2-O 3.48Å; P658-S661 WeakPolarHBondContact O-CB 3.43Å; P658-S661 PolarHBondContact O-N 3.41Å; P658-S661 PolarHBondContact O-OG 2.84Å; S659-S661 VanDerWaalsContact C-N 3.34Å
662	N	91.6	Very high	88.9	Confident	81 Å²	81	67.7 Å²	67.7	43%	0.433	37%	0.373	S	S	.	.			trans	-119	12.7	172.3	68.5	-8.4	0	0	0	112.3	K625 W626	K625-N662 CarbonylContact C-O 3.56Å; K625-N662 WeakPolarHBondContact CA-O 3.09Å; K625-N662 WeakPolarHBondContact CG-O 3.17Å; W626-N662 PolarHBondContact N-O 2.89Å; W626-N662 WeakPolarHBondContact O-CB 3.25Å
663	Y	91.4	Very high	88.8	Confident	122 Å²	122	65.1 Å²	65.1	48%	0.478	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	161.6	175.4	74.2	-99.8	0	0	0	112.6	K623 V624 W626	K623-Y663 HydrophobicContact CD-CD2 4.43Å; V624-Y663 CarbonylContact O-C 3.6Å; V624-Y663 WeakPolarHBondContact O-CA 3.45Å; V624-Y663 WeakPolarHBondContact O-CB 3.29Å; W626-Y663 VanDerWaalsContact CH2-O 3.29Å; W626-Y663 WeakPolarHBondContact CH2-O 3.29Å
664	A	89.5	Confident	88.7	Confident	6 Å²	6	62.3 Å²	62.3	5%	0.05	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	155.9	171.4	0	0	0	0	0	110.9	K623 V624 W626 I641 L657	K623-A664 WeakPolarHBondContact CA-O 3.47Å; V624-A664 HydrophobicContact CG2-CB 4.01Å; V624-A664 PolarHBondContact N-O 2.99Å; V624-A664 VanDerWaalsContact N-O 3.12Å; V624-A664 PolarHBondContact O-N 2.91Å; W626-A664 HydrophobicContact CH2-CB 4.04Å; W626-A664 HydrophobicContact CZ3-CB 3.85Å; I641-A664 HydrophobicContact CD1-CB 3.56Å; I641-A664 HydrophobicContact CG2-CB 4.27Å; L657-A664 HydrophobicContact CD1-CB 3.64Å
665	M	87.3	Confident	88.6	Confident	114 Å²	114	60.3 Å²	60.3	56%	0.562	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.7	125.6	167.8	-171	69.2	74.2	0	0	108.7	K623	K623-M665 HydrophobicContact CB-CE 4.23Å; K623-M665 HydrophobicContact CB-SD 4.11Å
666	L	89	Confident	88.6	Confident	3 Å²	3	59 Å²	59	2%	0.016	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	143.5	174.9	-51.7	-176.3	0	0	0	109.1	S621 A622 V624 I641 Y643 L669 V677 F695	S621-L666 WeakPolarHBondContact CA-O 3.01Å; S621-L666 WeakPolarHBondContact CB-O 3.32Å; A622-L666 PolarHBondContact N-O 3.4Å; A622-L666 VanDerWaalsContact N-O 3.14Å; A622-L666 PolarHBondContact O-N 2.85Å; V624-L666 HydrophobicContact CG1-CD1 4.29Å; I641-L666 HydrophobicContact CD1-CD2 3.73Å; I641-L666 HydrophobicContact CG1-CD2 4.4Å; Y643-L666 HydrophobicContact CD1-CD2 3.6Å; Y643-L666 HydrophobicContact CD2-CD1 4.46Å; Y643-L666 HydrophobicContact CE1-CD2 3.91Å; Y643-L666 HydrophobicContact CG-CD1 4.14Å; Y643-L666 HydrophobicContact CG-CD2 4.03Å; L666-L669 HydrophobicContact CB-CD1 4.28Å; L666-L669 HydrophobicContact CB-CD2 4.41Å; L666-V677 HydrophobicContact CD1-CG1 4.31Å; L666-V677 HydrophobicContact CD1-CG2 3.65Å; L666-F695 HydrophobicContact CD1-CE1 3.86Å; L666-F695 HydrophobicContact CD1-CZ 4.12Å
667	S	85.9	Confident	88.4	Confident	72 Å²	72	54.9 Å²	54.9	50%	0.503	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	165.3	-177.9	57.7	0	0	0	0	111.1	N620 Y643	N620-S667 WeakPolarHBondContact O-CA 3.2Å; Y643-S667 PolarHBondContact OH-O 2.78Å
668	G	84.7	Confident	88.4	Confident	35 Å²	35	57.1 Å²	57.1	36%	0.361	31%	0.309	S	S	.	.	S	Bend	trans	68.7	47.2	-174.4	0	0	0	0	0	110.9	N620 K652	N620-G668 PolarHBondContact O-N 2.9Å; N620-G668 WeakPolarHBondContact OD1-CA 3.44Å; N620-G668 PolarHBondContact OD1-N 3Å; K652-G668 PolarHBondContact NZ-O 3Å
669	L	87.2	Confident	88.5	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.021	29%	0.286	C	S	.	.			trans	-106.4	136	179.3	-51.7	179.7	0	0	0	109.9	N620 A622 Y643 L666 Y675 F695 T697	N620-L669 PolarHBondContact OD1-N 2.87Å; N620-L669 PolarHBondContact OD1-O 3Å; A622-L669 HydrophobicContact CB-CD1 3.87Å; Y643-L669 HydrophobicContact CD2-CD2 3.75Å; Y643-L669 HydrophobicContact CE2-CD2 3.65Å; L666-L669 HydrophobicContact CB-CD1 4.28Å; L666-L669 HydrophobicContact CB-CD2 4.41Å; L669-Y675 HydrophobicContact CB-CE2 4.02Å; L669-Y675 HydrophobicContact CD2-CD1 3.94Å; L669-Y675 HydrophobicContact CD2-CD2 4.3Å; L669-Y675 HydrophobicContact CD2-CE1 3.76Å; L669-Y675 HydrophobicContact CD2-CE2 4.09Å; L669-Y675 HydrophobicContact CD2-CG 4.26Å; L669-F695 HydrophobicContact CD1-CE2 4.08Å; L669-F695 HydrophobicContact CD1-CZ 3.87Å; L669-T697 HydrophobicContact CB-CG2 3.82Å; L669-T697 HydrophobicContact CD1-CG2 4.02Å
670	D	85.9	Confident	88.8	Confident	85 Å²	85	51.9 Å²	51.9	46%	0.455	27%	0.274	S	S	.	.			trans	-84.6	153.3	-179.9	-49.2	-66.9	0	0	0	109.9	Y675 T697	D670-Y675 WeakPolarHBondContact CB-OH 3.43Å; D670-Y675 PolarHBondContact N-OH 2.84Å; D670-Y675 PolarHBondContact OD2-OH 2.64Å; D670-T697 WeakPolarHBondContact O-CB 3.44Å; D670-T697 WeakPolarHBondContact O-CG2 3.23Å; D670-T697 PolarHBondContact O-OG1 2.88Å
671	W	82.1	Confident	89	Confident	115 Å²	115	45.8 Å²	45.8	44%	0.436	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	151.3	-173.4	-54.5	-24.7	0	0	0	112.9	S619 T673 E700	S619-W671 VanDerWaalsContact CB-CD1 3.45Å; S619-W671 VanDerWaalsContact CB-NE1 3.31Å; S619-W671 VanDerWaalsContact O-CD1 3.25Å; S619-W671 PolarHBondContact OG-NE1 2.89Å; S619-W671 VanDerWaalsContact OG-NE1 3.17Å; W671-T673 PolarHBondContact O-N 3.01Å; W671-T673 PolarHBondContact O-OG1 3.3Å; W671-E700 HydrophobicContact CD2-CB 4.2Å; W671-E700 HydrophobicContact CD2-CG 4.44Å; W671-E700 HydrophobicContact CE3-CB 3.65Å; W671-E700 HydrophobicContact CE3-CG 3.71Å; W671-E700 HydrophobicContact CH2-CG 4.03Å; W671-E700 HydrophobicContact CZ3-CB 4.01Å; W671-E700 HydrophobicContact CZ3-CG 3.5Å; W671-E700 VanDerWaalsContact CZ3-OE1 3.26Å; W671-E700 WeakPolarHBondContact CZ3-OE1 3.41Å; W671-E700 WeakPolarHBondContact CZ3-OE2 3.26Å
672	N	82.6	Confident	89.1	Confident	88 Å²	88	45.3 Å²	45.3	47%	0.471	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.4	33.9	-179.8	-171.3	26.2	0	0	0	114.4	R696 T697 A698	N672-R696 PolarHBondContact OD1-NH1 2.86Å; N672-T697 PolarHBondContact N-OG1 2.02Å; N672-T697 VanDerWaalsContact N-OG1 3.16Å; N672-A698 PolarHBondContact N-O 3.27Å
673	T	85.8	Confident	89	Confident	20 Å²	20	41.6 Å²	41.6	12%	0.123	21%	0.211	C	C	.	.			trans	-115.7	132.6	-169.5	-69.5	0	0	0	0	110.5	A645 W671 Y675 R696 T697	A645-T673 HydrophobicContact CB-CG2 3.71Å; W671-T673 PolarHBondContact O-N 3.01Å; W671-T673 PolarHBondContact O-OG1 3.3Å; T673-Y675 HydrophobicContact CG2-CD2 4.18Å; T673-Y675 HydrophobicContact CG2-CE2 3.58Å; T673-Y675 WeakPolarHBondContact O-CD2 3.43Å; T673-R696 WeakPolarHBondContact O-CA 3.39Å; T673-T697 PolarHBondContact N-OG1 2.97Å; T673-T697 PolarHBondContact O-N 3.14Å; T673-T697 VanDerWaalsContact O-N 3.08Å; T673-T697 PolarHBondContact O-OG1 2.84Å
674	D	87.8	Confident	88.7	Confident	53 Å²	53	43.8 Å²	43.8	28%	0.283	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	128	173.9	-65	-52.2	0	0	0	110.7	A645 K646 F695 R696	A645-D674 CarbonylContact C-O 3.51Å; A645-D674 WeakPolarHBondContact CA-O 3.44Å; K646-D674 HydrophobicContact CB-CB 4.25Å; K646-D674 HydrophobicContact CD-CB 3.79Å; K646-D674 HydrophobicContact CG-CB 3.96Å; K646-D674 PolarHBondContact N-O 3.45Å; D674-F695 CarbonylContact C-O 3.57Å; D674-F695 WeakPolarHBondContact CA-O 3.35Å; D674-R696 WeakPolarHBondContact OD1-CB 3.46Å; D674-R696 IonicContact OD1-CZ 2.7Å; D674-R696 IonicContact OD1-NE 2.87Å; D674-R696 PolarHBondContact OD1-NE 2.94Å; D674-R696 IonicContact OD1-NH2 3.92Å; D674-R696 PolarHBondContact OD1-NH2 3.38Å; D674-R696 IonicContact OD2-CZ 2.75Å; D674-R696 IonicContact OD2-NE 2.71Å; D674-R696 IonicContact OD2-NH2 3.61Å; D674-R696 PolarHBondContact OD2-NH2 2.57Å
675	Y	89.1	Confident	88.7	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	141	173	-74.3	-92	0	0	0	111.5	Y643 K644 A645 L669 D670 T673 S694 F695 T697	Y643-Y675 HydrophobicContact CD2-CD1 4.31Å; K644-Y675 CarbonylContact O-C 3.58Å; K644-Y675 VanDerWaalsContact O-CA 3.27Å; K644-Y675 WeakPolarHBondContact O-CA 3.24Å; K644-Y675 WeakPolarHBondContact O-CD1 3.49Å; A645-Y675 HydrophobicContact CB-CD1 4.29Å; A645-Y675 HydrophobicContact CB-CE1 3.83Å; A645-Y675 VanDerWaalsContact N-CD1 3.33Å; L669-Y675 HydrophobicContact CB-CE2 4.02Å; L669-Y675 HydrophobicContact CD2-CD1 3.94Å; L669-Y675 HydrophobicContact CD2-CD2 4.3Å; L669-Y675 HydrophobicContact CD2-CE1 3.76Å; L669-Y675 HydrophobicContact CD2-CE2 4.09Å; L669-Y675 HydrophobicContact CD2-CG 4.26Å; D670-Y675 WeakPolarHBondContact CB-OH 3.43Å; D670-Y675 PolarHBondContact N-OH 2.84Å; D670-Y675 PolarHBondContact OD2-OH 2.64Å; T673-Y675 HydrophobicContact CG2-CD2 4.18Å; T673-Y675 HydrophobicContact CG2-CE2 3.58Å; T673-Y675 WeakPolarHBondContact O-CD2 3.43Å; Y675-S694 CarbonylContact O-C 3.53Å; Y675-S694 WeakPolarHBondContact O-CA 3.29Å; Y675-S694 WeakPolarHBondContact O-CB 3.22Å; Y675-F695 HydrophobicContact CD2-CE2 4.33Å; Y675-F695 HydrophobicContact CD2-CZ 4.22Å; Y675-F695 HydrophobicContact CG-CZ 4.14Å; Y675-F695 PolarHBondContact N-O 2.7Å; Y675-F695 PolarHBondContact O-N 2.88Å; Y675-T697 HydrophobicContact CD2-CG2 4.09Å; Y675-T697 HydrophobicContact CE2-CG2 3.92Å
676	E	91	Very high	88.7	Confident	35 Å²	35	47.3 Å²	47.3	16%	0.164	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	139	162.3	-169.3	-174.8	132	0	0	108.8	Y643 K644 K646 W651 R678 I692 T693	Y643-E676 CarbonylContact C-O 3.58Å; Y643-E676 VanDerWaalsContact CA-O 3.23Å; Y643-E676 WeakPolarHBondContact CA-O 3.42Å; K644-E676 PolarHBondContact N-O 2.67Å; K644-E676 PolarHBondContact O-N 2.69Å; K646-E676 HydrophobicContact CG-CB 4.48Å; W651-E676 HydrophobicContact CH2-CB 4.14Å; W651-E676 HydrophobicContact CH2-CG 3.94Å; W651-E676 VanDerWaalsContact CH2-OE1 3.29Å; W651-E676 WeakPolarHBondContact CH2-OE1 3.4Å; E676-R678 IonicContact OE1-CZ 2.96Å; E676-R678 IonicContact OE1-NE 3.2Å; E676-R678 PolarHBondContact OE1-NE 2.92Å; E676-R678 IonicContact OE1-NH2 3.17Å; E676-R678 PolarHBondContact OE1-NH2 3.05Å; E676-I692 HydrophobicContact CG-CG2 3.68Å; E676-T693 WeakPolarHBondContact CA-O 3.32Å
677	V	91.3	Very high	88.9	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	138.8	177.6	-172.6	0	0	0	0	108.9	V624 I641 R642 L666 I692 T693 F695	V624-V677 HydrophobicContact CG1-CG1 4.36Å; V624-V677 HydrophobicContact CG1-CG2 4.43Å; V624-V677 HydrophobicContact CG2-CG1 4.46Å; I641-V677 HydrophobicContact CD1-CG1 3.79Å; I641-V677 HydrophobicContact CG1-CG1 3.91Å; R642-V677 WeakPolarHBondContact O-CA 3.49Å; L666-V677 HydrophobicContact CD1-CG1 4.31Å; L666-V677 HydrophobicContact CD1-CG2 3.65Å; V677-I692 WeakPolarHBondContact O-CA 3.41Å; V677-T693 HydrophobicContact CB-CG2 4.04Å; V677-T693 PolarHBondContact N-O 2.89Å; V677-T693 PolarHBondContact O-N 2.89Å; V677-F695 HydrophobicContact CG2-CD1 3.92Å; V677-F695 HydrophobicContact CG2-CE1 3.53Å
678	R	93.1	Very high	89.2	Confident	83 Å²	83	48.2 Å²	48.2	31%	0.313	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	130.1	173.8	-62.7	-173.1	-176.7	-164.3	2	110.2	I641 R642 W651 E676 P690 S691 I692	I641-R678 WeakPolarHBondContact CA-O 3.38Å; R642-R678 PolarHBondContact N-O 2.82Å; R642-R678 PolarHBondContact O-N 2.87Å; W651-R678 HydrophobicContact CH2-CG 3.68Å; W651-R678 VanDerWaalsContact CH2-NE 3.35Å; W651-R678 HydrophobicContact CZ2-CG 4.37Å; W651-R678 VanDerWaalsContact CZ2-NE 3.28Å; W651-R678 HydrophobicContact CZ3-CG 4.08Å; E676-R678 IonicContact OE1-CZ 2.96Å; E676-R678 IonicContact OE1-NE 3.2Å; E676-R678 PolarHBondContact OE1-NE 2.92Å; E676-R678 IonicContact OE1-NH2 3.17Å; E676-R678 PolarHBondContact OE1-NH2 3.05Å; R678-P690 HydrophobicContact CB-CB 4.18Å; R678-P690 HydrophobicContact CG-CB 4.45Å; R678-S691 VanDerWaalsContact CA-O 3.3Å; R678-S691 WeakPolarHBondContact CA-O 2.99Å; R678-I692 HydrophobicContact CG-CG1 4.16Å; R678-I692 HydrophobicContact CG-CG2 4.33Å
679	V	94	Very high	89.6	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	135.8	170.6	176.9	0	0	0	0	109.5	P609 L611 W626 Y639 L640 I641 S691	P609-V679 HydrophobicContact CG-CG1 4.45Å; L611-V679 HydrophobicContact CD1-CB 4.14Å; L611-V679 HydrophobicContact CD1-CG2 3.57Å; L611-V679 HydrophobicContact CD2-CB 4.07Å; L611-V679 HydrophobicContact CD2-CG2 3.87Å; L611-V679 HydrophobicContact CG-CG2 4.36Å; W626-V679 HydrophobicContact CD2-CG1 3.84Å; W626-V679 HydrophobicContact CE3-CG1 3.98Å; W626-V679 HydrophobicContact CE3-CG2 3.95Å; W626-V679 HydrophobicContact CG-CG1 4.15Å; W626-V679 HydrophobicContact CZ3-CG1 4.43Å; W626-V679 HydrophobicContact CZ3-CG2 4.18Å; Y639-V679 HydrophobicContact CD1-CG1 4.41Å; L640-V679 WeakPolarHBondContact O-CA 3.41Å; I641-V679 HydrophobicContact CB-CG2 4.24Å; I641-V679 HydrophobicContact CD1-CG2 3.87Å; I641-V679 HydrophobicContact CG1-CG2 3.9Å; V679-S691 PolarHBondContact N-O 2.83Å; V679-S691 WeakPolarHBondContact O-CB 3.5Å; V679-S691 PolarHBondContact O-N 2.9Å; V679-S691 PolarHBondContact O-OG 2.76Å
680	V	94.2	Very high	89.7	Confident	16 Å²	16	55.3 Å²	55.3	10%	0.097	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	136.9	-179.4	166.3	0	0	0	0	108.5	Y639 L640 R687 P690	Y639-V680 CarbonylContact C-O 3.55Å; Y639-V680 VanDerWaalsContact CA-O 3.26Å; Y639-V680 WeakPolarHBondContact CA-O 3.44Å; L640-V680 HydrophobicContact CB-CB 4.38Å; L640-V680 HydrophobicContact CD1-CG1 4.14Å; L640-V680 PolarHBondContact N-O 3.3Å; L640-V680 PolarHBondContact O-N 3.38Å; V680-R687 HydrophobicContact CG1-CB 3.7Å; V680-R687 HydrophobicContact CG1-CG 3.91Å; V680-P690 HydrophobicContact CG2-CB 3.76Å
681	A	94.2	Very high	90	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	140.9	164.3	0	0	0	0	0	109.6	P606 P609 I636 Y639 R687 S688	P606-A681 HydrophobicContact CB-CB 3.81Å; P606-A681 HydrophobicContact CG-CB 4.17Å; P609-A681 HydrophobicContact CG-CB 3.84Å; I636-A681 HydrophobicContact CD1-CB 3.99Å; I636-A681 HydrophobicContact CG1-CB 4.34Å; I636-A681 HydrophobicContact CG2-CB 4.4Å; Y639-A681 HydrophobicContact CD1-CB 3.94Å; Y639-A681 HydrophobicContact CE1-CB 3.78Å; A681-R687 CarbonylContact O-C 3.42Å; A681-R687 WeakPolarHBondContact O-CA 3.49Å; A681-S688 PolarHBondContact N-OG 2.79Å; A681-S688 PolarHBondContact O-N 3.23Å
682	E	93.7	Very high	90.3	Very high	20 Å²	20	50.9 Å²	50.9	9%	0.093	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	132	175.8	-167.9	178.4	-121.4	0	0	109.3	I636 I637 R638 L640 G686 R687	I636-E682 CarbonylContact C-O 3.58Å; I636-E682 WeakPolarHBondContact CA-O 3.48Å; I636-E682 WeakPolarHBondContact CG2-O 3.33Å; I637-E682 HydrophobicContact CD1-CG 4.42Å; I637-E682 HydrophobicContact CG1-CB 4.49Å; I637-E682 WeakPolarHBondContact CG1-O 3.22Å; I637-E682 PolarHBondContact N-O 2.97Å; R638-E682 HydrophobicContact CG-CB 4.42Å; R638-E682 IonicContact CZ-OE2 3.95Å; R638-E682 PolarHBondContact N-O 3.25Å; R638-E682 IonicContact NE-OE2 3.43Å; R638-E682 PolarHBondContact NE-OE2 2.99Å; R638-E682 IonicContact NH2-OE1 2.77Å; R638-E682 IonicContact NH2-OE2 3.85Å; R638-E682 PolarHBondContact NH2-OE2 2.88Å; R638-E682 PolarHBondContact O-N 2.68Å; L640-E682 HydrophobicContact CD1-CB 3.51Å; L640-E682 HydrophobicContact CD1-CG 4.32Å; E682-G686 VanDerWaalsContact CA-O 3.31Å; E682-G686 WeakPolarHBondContact CA-O 3.38Å; E682-G686 WeakPolarHBondContact CG-O 3.21Å; E682-R687 HydrophobicContact CB-CG 4.14Å; E682-R687 HydrophobicContact CG-CG 3.74Å; E682-R687 WeakPolarHBondContact OE1-CG 3.44Å; E682-R687 IonicContact OE1-CZ 2.77Å; E682-R687 IonicContact OE1-NE 3.84Å; E682-R687 PolarHBondContact OE1-NE 2.78Å; E682-R687 IonicContact OE1-NH2 3.42Å; E682-R687 PolarHBondContact OE1-NH2 2.99Å
683	N	90.3	Very high	90.5	Very high	3 Å²	3	48.5 Å²	48.5	2%	0.016	23%	0.231	C	C	.	.			trans	-115.1	-165.9	171.7	71.4	6	0	0	0	109.8	R604 P606 D631 S634 R685 G686	R604-N683 PolarHBondContact O-ND2 3.16Å; P606-N683 HydrophobicContact CG-CB 3.76Å; D631-N683 PolarHBondContact O-ND2 2.8Å; S634-N683 WeakPolarHBondContact O-CB 3.48Å; N683-R685 VanDerWaalsContact C-N 3.26Å; N683-R685 PolarHBondContact O-N 2.81Å; N683-R685 WeakPolarHBondContact OD1-CA 3.46Å; N683-R685 WeakPolarHBondContact OD1-CB 3.49Å; N683-R685 PolarHBondContact OD1-N 2.93Å; N683-G686 PolarHBondContact N-O 2.86Å; N683-G686 PolarHBondContact OD1-N 2.98Å; N683-G686 VanDerWaalsContact OD1-N 3.12Å; N683-G686 PolarHBondContact OD1-O 3.37Å
684	Q	84.8	Confident	90.5	Very high	167 Å²	167	50.2 Å²	50.2	78%	0.78	24%	0.244	S	C	*	.	S	Bend	trans	-66.5	-24.3	177.6	-172.7	178	-5	0	0	113.8	S634	S634-Q684 WeakPolarHBondContact OG-CB 3.1Å
685	R	87.9	Confident	90.4	Very high	177 Å²	177	48.7 Å²	48.7	67%	0.668	24%	0.235	S	C	*	.	S	Bend	trans	-82.1	-40.9	-178.6	-178.3	65.7	-171.7	161.1	2.7	112.4	V603 E605 N683	V603-R685 HydrophobicContact CB-CB 4.44Å; V603-R685 HydrophobicContact CG1-CB 3.76Å; V603-R685 WeakPolarHBondContact O-CD 3.31Å; V603-R685 WeakPolarHBondContact O-CG 3.04Å; E605-R685 HydrophobicContact CG-CB 4.49Å; E605-R685 HydrophobicContact CG-CG 4.05Å; N683-R685 VanDerWaalsContact C-N 3.26Å; N683-R685 PolarHBondContact O-N 2.81Å; N683-R685 WeakPolarHBondContact OD1-CA 3.46Å; N683-R685 WeakPolarHBondContact OD1-CB 3.49Å; N683-R685 PolarHBondContact OD1-N 2.93Å
686	G	87.3	Confident	90.2	Very high	18 Å²	18	55.1 Å²	55.1	19%	0.186	26%	0.259	C	S	.	.			trans	164.6	-152.2	-177.3	0	0	0	0	0	113.3	E605 E682 N683	E605-G686 VanDerWaalsContact OE1-CA 3.25Å; E605-G686 WeakPolarHBondContact OE1-CA 3.36Å; E682-G686 VanDerWaalsContact CA-O 3.31Å; E682-G686 WeakPolarHBondContact CA-O 3.38Å; E682-G686 WeakPolarHBondContact CG-O 3.21Å; N683-G686 PolarHBondContact N-O 2.86Å; N683-G686 PolarHBondContact OD1-N 2.98Å; N683-G686 VanDerWaalsContact OD1-N 3.12Å; N683-G686 PolarHBondContact OD1-O 3.37Å
687	R	93.1	Very high	89.7	Confident	87 Å²	87	53.7 Å²	53.7	33%	0.328	25%	0.253	S	S	.	.	B	Isolated β-bridge	trans	-110.2	139.8	-168.7	-73.6	-178.5	-177.2	-154	0.4	110.5	E605 L640 E654 V680 A681 E682	E605-R687 PolarHBondContact OE1-N 2.88Å; L640-R687 VanDerWaalsContact CD2-CZ 3.44Å; E654-R687 IonicContact OE1-CZ 3.11Å; E654-R687 IonicContact OE1-NH1 3.28Å; E654-R687 PolarHBondContact OE1-NH1 2.84Å; E654-R687 IonicContact OE1-NH2 3.6Å; E654-R687 PolarHBondContact OE1-NH2 2.88Å; E654-R687 IonicContact OE2-NH1 2.73Å; E654-R687 PolarHBondContact OE2-NH1 2.76Å; V680-R687 HydrophobicContact CG1-CB 3.7Å; V680-R687 HydrophobicContact CG1-CG 3.91Å; A681-R687 CarbonylContact O-C 3.42Å; A681-R687 WeakPolarHBondContact O-CA 3.49Å; E682-R687 HydrophobicContact CB-CG 4.14Å; E682-R687 HydrophobicContact CG-CG 3.74Å; E682-R687 WeakPolarHBondContact OE1-CG 3.44Å; E682-R687 IonicContact OE1-CZ 2.77Å; E682-R687 IonicContact OE1-NE 3.84Å; E682-R687 PolarHBondContact OE1-NE 2.78Å; E682-R687 IonicContact OE1-NH2 3.42Å; E682-R687 PolarHBondContact OE1-NH2 2.99Å
688	S	94.1	Very high	89	Confident	7 Å²	7	56.1 Å²	56.1	5%	0.049	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-63.2	155.7	167	75.9	0	0	0	0	110.7	P606 A681	P606-S688 WeakPolarHBondContact O-CA 2.99Å; P606-S688 WeakPolarHBondContact O-CB 3.33Å; A681-S688 PolarHBondContact N-OG 2.79Å; A681-S688 PolarHBondContact O-N 3.23Å
689	E	91.9	Very high	88.1	Confident	148 Å²	148	56 Å²	56	69%	0.692	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-53.4	144.5	159.4	-75.1	-63.9	163.2	0	0	109.8	S608 S691	S608-E689 WeakPolarHBondContact CB-O 3.39Å; S608-E689 WeakPolarHBondContact OG-CB 3.44Å; S608-E689 PolarHBondContact OG-O 2.87Å; E689-S691 PolarHBondContact O-N 2.91Å
690	P	89.8	Confident	86.9	Confident	40 Å²	40	62.2 Å²	62.2	26%	0.26	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-77.4	124.7	-171.9	30.1	-32	0	0	0	111.4	R678 V680 I692	R678-P690 HydrophobicContact CB-CB 4.18Å; R678-P690 HydrophobicContact CG-CB 4.45Å; V680-P690 HydrophobicContact CG2-CB 3.76Å; P690-I692 VanDerWaalsContact O-CG1 3.29Å; P690-I692 WeakPolarHBondContact O-CG1 3.4Å; P690-I692 PolarHBondContact O-N 2.9Å
691	S	91.5	Very high	85.5	Confident	13 Å²	13	65.8 Å²	65.8	9%	0.091	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	116.1	170.1	-46.1	0	0	0	0	108.8	P609 L611 R678 V679 E689	P609-S691 WeakPolarHBondContact CD-OG 3.34Å; P609-S691 WeakPolarHBondContact O-CB 3.25Å; P609-S691 PolarHBondContact O-OG 2.85Å; L611-S691 WeakPolarHBondContact CD2-O 3.36Å; R678-S691 VanDerWaalsContact CA-O 3.3Å; R678-S691 WeakPolarHBondContact CA-O 2.99Å; V679-S691 PolarHBondContact N-O 2.83Å; V679-S691 WeakPolarHBondContact O-CB 3.5Å; V679-S691 PolarHBondContact O-N 2.9Å; V679-S691 PolarHBondContact O-OG 2.76Å; E689-S691 PolarHBondContact O-N 2.91Å
692	I	88.4	Confident	83.5	Confident	94 Å²	94	72.6 Å²	72.6	48%	0.482	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	136.8	-173.8	-43.9	-171.5	0	0	0	110.5	E676 V677 R678 P690	E676-I692 HydrophobicContact CG-CG2 3.68Å; V677-I692 WeakPolarHBondContact O-CA 3.41Å; R678-I692 HydrophobicContact CG-CG1 4.16Å; R678-I692 HydrophobicContact CG-CG2 4.33Å; P690-I692 VanDerWaalsContact O-CG1 3.29Å; P690-I692 WeakPolarHBondContact O-CG1 3.4Å; P690-I692 PolarHBondContact O-N 2.9Å
693	T	86.6	Confident	81.3	Confident	37 Å²	37	78.2 Å²	78.2	23%	0.227	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	171.1	169.5	-166.7	0	0	0	0	110.8	L611 V613 E676 V677	L611-T693 HydrophobicContact CD2-CG2 3.55Å; L611-T693 HydrophobicContact CG-CG2 3.78Å; V613-T693 HydrophobicContact CG2-CG2 3.39Å; E676-T693 WeakPolarHBondContact CA-O 3.32Å; V677-T693 HydrophobicContact CB-CG2 4.04Å; V677-T693 PolarHBondContact N-O 2.89Å; V677-T693 PolarHBondContact O-N 2.89Å
694	S	87	Confident	79	Confident	57 Å²	57	84.4 Å²	84.4	40%	0.399	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	148.4	174.6	68.6	0	0	0	0	113.7	K646 Y675	K646-S694 WeakPolarHBondContact CE-OG 3.38Å; K646-S694 VanDerWaalsContact NZ-CB 3.33Å; K646-S694 PolarHBondContact NZ-OG 3.1Å; Y675-S694 CarbonylContact O-C 3.53Å; Y675-S694 WeakPolarHBondContact O-CA 3.29Å; Y675-S694 WeakPolarHBondContact O-CB 3.22Å
695	F	85.4	Confident	77.1	Confident	20 Å²	20	82.4 Å²	82.4	9%	0.088	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	166.8	179.8	71.6	-85.5	0	0	0	110.5	V613 V616 A622 L666 L669 D674 Y675 V677 T697	V613-F695 HydrophobicContact CG1-CB 4.01Å; V613-F695 HydrophobicContact CG1-CD1 4.32Å; V613-F695 HydrophobicContact CG1-CG 4.21Å; V613-F695 HydrophobicContact CG2-CD1 4.47Å; V616-F695 HydrophobicContact CG2-CD2 3.69Å; V616-F695 HydrophobicContact CG2-CE2 4.16Å; A622-F695 HydrophobicContact CB-CD2 4.26Å; A622-F695 HydrophobicContact CB-CE1 4.31Å; A622-F695 HydrophobicContact CB-CE2 3.52Å; A622-F695 HydrophobicContact CB-CZ 3.56Å; L666-F695 HydrophobicContact CD1-CE1 3.86Å; L666-F695 HydrophobicContact CD1-CZ 4.12Å; L669-F695 HydrophobicContact CD1-CE2 4.08Å; L669-F695 HydrophobicContact CD1-CZ 3.87Å; D674-F695 CarbonylContact C-O 3.57Å; D674-F695 WeakPolarHBondContact CA-O 3.35Å; Y675-F695 HydrophobicContact CD2-CE2 4.33Å; Y675-F695 HydrophobicContact CD2-CZ 4.22Å; Y675-F695 HydrophobicContact CG-CZ 4.14Å; Y675-F695 PolarHBondContact N-O 2.7Å; Y675-F695 PolarHBondContact O-N 2.88Å; V677-F695 HydrophobicContact CG2-CD1 3.92Å; V677-F695 HydrophobicContact CG2-CE1 3.53Å; F695-T697 HydrophobicContact CE2-CG2 4.06Å
696	R	83.6	Confident	74.9	Confident	135 Å²	135	81.5 Å²	81.5	51%	0.509	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	141.7	172.3	-169.2	175.6	-77.1	-152.5	-3.2	110.8	N672 T673 D674	N672-R696 PolarHBondContact OD1-NH1 2.86Å; T673-R696 WeakPolarHBondContact O-CA 3.39Å; D674-R696 WeakPolarHBondContact OD1-CB 3.46Å; D674-R696 IonicContact OD1-CZ 2.7Å; D674-R696 IonicContact OD1-NE 2.87Å; D674-R696 PolarHBondContact OD1-NE 2.94Å; D674-R696 IonicContact OD1-NH2 3.92Å; D674-R696 PolarHBondContact OD1-NH2 3.38Å; D674-R696 IonicContact OD2-CZ 2.75Å; D674-R696 IonicContact OD2-NE 2.71Å; D674-R696 IonicContact OD2-NH2 3.61Å; D674-R696 PolarHBondContact OD2-NH2 2.57Å
697	T	81.9	Confident	72.4	Confident	6 Å²	6	87.6 Å²	87.6	4%	0.037	50%	0.497	C	S	.	.	P	Polyproline II helix	trans	-75.3	159	170.9	48.5	0	0	0	0	112.4	L669 D670 N672 T673 Y675 F695	L669-T697 HydrophobicContact CB-CG2 3.82Å; L669-T697 HydrophobicContact CD1-CG2 4.02Å; D670-T697 WeakPolarHBondContact O-CB 3.44Å; D670-T697 WeakPolarHBondContact O-CG2 3.23Å; D670-T697 PolarHBondContact O-OG1 2.88Å; N672-T697 PolarHBondContact N-OG1 2.02Å; N672-T697 VanDerWaalsContact N-OG1 3.16Å; T673-T697 PolarHBondContact N-OG1 2.97Å; T673-T697 PolarHBondContact O-N 3.14Å; T673-T697 VanDerWaalsContact O-N 3.08Å; T673-T697 PolarHBondContact O-OG1 2.84Å; Y675-T697 HydrophobicContact CD2-CG2 4.09Å; Y675-T697 HydrophobicContact CE2-CG2 3.92Å; F695-T697 HydrophobicContact CE2-CG2 4.06Å
698	A	76.2	Confident	69.7	Low	51 Å²	51	87.7 Å²	87.7	42%	0.421	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-66.9	160	174	0	0	0	0	0	112.2	N672	N672-A698 PolarHBondContact N-O 3.27Å
699	S	73.9	Confident	66.8	Low	80 Å²	80	95.2 Å²	95.2	56%	0.559	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-70	164.8	169.2	-56	0	0	0	0	112.1
700	E	69.6	Low	64	Low	130 Å²	130	91.5 Å²	91.5	61%	0.607	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-63.9	135.5	173.3	-173.7	173.8	-170.8	0	0	111.9	W671	W671-E700 HydrophobicContact CD2-CB 4.2Å; W671-E700 HydrophobicContact CD2-CG 4.44Å; W671-E700 HydrophobicContact CE3-CB 3.65Å; W671-E700 HydrophobicContact CE3-CG 3.71Å; W671-E700 HydrophobicContact CH2-CG 4.03Å; W671-E700 HydrophobicContact CZ3-CB 4.01Å; W671-E700 HydrophobicContact CZ3-CG 3.5Å; W671-E700 VanDerWaalsContact CZ3-OE1 3.26Å; W671-E700 WeakPolarHBondContact CZ3-OE1 3.41Å; W671-E700 WeakPolarHBondContact CZ3-OE2 3.26Å
701	P	64.8	Low	61.1	Low	92 Å²	92	93.1 Å²	93.1	60%	0.597	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-80.6	126.3	174.2	31.6	-32.7	0	0	0	111.6
702	T	52.7	Low	58.3	Low	143 Å²	143	98.5 Å²	98.5	88%	0.877	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-67.6	136.3	172.1	27.2	0	0	0	0	111.9
703	T	47	Very low	55.6	Low	138 Å²	138	97.6 Å²	97.6	85%	0.847	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-90.4	146.4	177.1	48.6	0	0	0	0	112.4
704	V	41.7	Very low	53	Low	133 Å²	133	104.6 Å²	104.6	81%	0.806	67%	0.668	S	S	*	*			trans	-127.9	136.7	166	-175	0	0	0	0	106.7
705	P	43.6	Very low	50.4	Low	124 Å²	124	105.2 Å²	105.2	81%	0.805	68%	0.683	S	S	*	*			trans	-70.4	154.8	-171.8	-20.8	34.2	0	0	0	115.1
706	D	42.4	Very low	48	Very low	159 Å²	159	111.4 Å²	111.4	85%	0.85	72%	0.723	S	S	*	*			trans	-60.1	149	177.4	-74.9	-63.2	0	0	0	114.7
707	T	34.7	Very low	45.7	Very low	146 Å²	146	108.8 Å²	108.8	90%	0.896	74%	0.738	S	S	*	*				-155.8	160.7	124.7	-4.2	0	0	0	0	111.5
708	A	36.6	Very low	43.4	Very low	89 Å²	89	112.9 Å²	112.9	74%	0.736	77%	0.772	S	S	*	*			trans	-64.6	171.4	-179.8	0	0	0	0	0	112.6
709	D	32.9	Very low	41.8	Very low	164 Å²	164	118.2 Å²	118.2	88%	0.877	79%	0.792	S	S	*	*			cis	-155.9	-177.5	27.1	-163.2	10	0	0	0	112.9
710	G	33	Very low	40.1	Very low	70 Å²	70	121.6 Å²	121.6	72%	0.722	81%	0.809	S	S	*	*			trans	-56.2	166.1	-165.2	0	0	0	0	0	119.9
711	G	30.2	Very low	38.7	Very low	75 Å²	75	118.2 Å²	118.2	77%	0.773	81%	0.809	S	S	*	*			trans	175.8	100.1	177.2	0	0	0	0	0	115.4
712	S	32.9	Very low	37.7	Very low	125 Å²	125	120.1 Å²	120.1	87%	0.874	81%	0.813	S	S	*	*			trans	-20.3	143	159.8	53.8	0	0	0	0	120.3
713	G	31.1	Very low	37.1	Very low	75 Å²	75	120.1 Å²	120.1	77%	0.773	81%	0.807	S	S	*	*			trans	95.2	105.6	138.3	0	0	0	0	0	117.7	G715	G713-G715 PolarHBondContact O-N 2.85Å
714	L	32.9	Very low	37	Very low	184 Å²	184	120 Å²	120	96%	0.963	80%	0.8	S	S	*	*			trans	-76.5	110.2	166.5	-88.2	85.8	0	0	0	111.1
715	G	30.5	Very low	37.1	Very low	70 Å²	70	118.1 Å²	118.1	72%	0.722	79%	0.788	S	S	*	*			trans	-76.1	160.7	157.4	0	0	0	0	0	112.2	G713	G713-G715 PolarHBondContact O-N 2.85Å
716	T	36.3	Very low	37.1	Very low	150 Å²	150	115.7 Å²	115.7	92%	0.92	77%	0.771	S	S	*	*			trans	-73.3	141.1	179.7	49.5	0	0	0	0	113.2
717	G	34.8	Very low	37.1	Very low	81 Å²	81	115.3 Å²	115.3	84%	0.835	76%	0.762	S	S	*	*			trans	-176.8	57.1	175.5	0	0	0	0	0	117.3
718	A	33	Very low	37.6	Very low	91 Å²	91	114.1 Å²	114.1	75%	0.752	75%	0.75	S	S	*	*			trans	-154.7	50.4	176.1	0	0	0	0	0	114.6
719	I	42.6	Very low	37.9	Very low	164 Å²	164	115.7 Å²	115.7	84%	0.841	75%	0.745	S	S	*	*			trans	-125.9	64.5	178.2	-45	-179.8	0	0	0	112.2
720	V	39.5	Very low	38.4	Very low	150 Å²	150	112.8 Å²	112.8	91%	0.909	73%	0.729	S	S	*	*	S	Bend	trans	-146	120.9	146.9	-174.4	0	0	0	0	106.7
721	G	40.3	Very low	38.8	Very low	60 Å²	60	114.5 Å²	114.5	62%	0.619	72%	0.721	S	S	*	*	S	Bend	trans	145.3	-18.9	178.6	0	0	0	0	0	116.2
722	I	43.1	Very low	39.5	Very low	132 Å²	132	115.5 Å²	115.5	68%	0.677	71%	0.712	S	S	*	*	S	Bend	trans	-89.5	-25	-179.2	-64.6	175.3	0	0	0	112.4	I724 V725 V726	I722-I724 PolarHBondContact O-N 2.95Å; I722-V725 PolarHBondContact O-N 3Å; I722-V726 HydrophobicContact CG2-CG2 4.39Å
723	L	40.2	Very low	39.8	Very low	142 Å²	142	112 Å²	112	74%	0.743	69%	0.691	S	S	*	*	H	α-helix	trans	-67.1	-25.4	-170.2	-85.1	159.8	0	0	0	115.8
724	I	44.6	Very low	40.4	Very low	136 Å²	136	112.4 Å²	112.4	70%	0.697	68%	0.678	S	S	*	*	H	α-helix	trans	-78.2	-32.3	-178.9	-64	176.3	0	0	0	111.7	I722	I722-I724 PolarHBondContact O-N 2.95Å
725	V	43.2	Very low	40.9	Very low	93 Å²	93	109.6 Å²	109.6	56%	0.564	66%	0.664	S	S	*	*	H	α-helix	trans	-72.7	-35.3	-179.1	-177.2	0	0	0	0	111.5	I722 L729	I722-V725 PolarHBondContact O-N 3Å; V725-L729 HydrophobicContact CG1-CD1 4.16Å; V725-L729 PolarHBondContact O-N 2.9Å
726	V	45.4	Very low	41.4	Very low	74 Å²	74	110.3 Å²	110.3	45%	0.448	65%	0.654	S	S	.	*	H	α-helix	trans	-67	-38.2	179.6	178.9	0	0	0	0	111.8	I722 L729 L730	I722-V726 HydrophobicContact CG2-CG2 4.39Å; V726-L729 PolarHBondContact O-N 2.84Å; V726-L730 HydrophobicContact CG1-CD1 4.2Å; V726-L730 PolarHBondContact O-N 2.63Å
727	F	42.3	Very low	41.6	Very low	151 Å²	151	107 Å²	107	66%	0.662	63%	0.634	S	S	*	*	H	α-helix	trans	-70.2	-36.4	-177.1	-144.8	-92.6	0	0	0	112.8	L730	F727-L730 PolarHBondContact O-N 2.82Å
728	L	45.3	Very low	41.7	Very low	121 Å²	121	107 Å²	107	63%	0.634	62%	0.619	S	S	*	*	H	α-helix	trans	-69.9	-30.8	174.7	-82	162	0	0	0	113.1
729	L	42	Very low	41.9	Very low	122 Å²	122	111.4 Å²	111.4	64%	0.639	62%	0.618	S	S	*	*	H	α-helix	trans	-75.2	-26	175.4	-76.7	166.9	0	0	0	113.2	V725 V726	V725-L729 HydrophobicContact CG1-CD1 4.16Å; V725-L729 PolarHBondContact O-N 2.9Å; V726-L729 PolarHBondContact O-N 2.84Å
730	L	43.2	Very low	41.5	Very low	102 Å²	102	111.1 Å²	111.1	53%	0.534	61%	0.611	S	S	.	*	H	α-helix	trans	-74.7	-34.8	179	-82.2	169.1	0	0	0	113.5	V726 F727 V732 A733	V726-L730 HydrophobicContact CG1-CD1 4.2Å; V726-L730 PolarHBondContact O-N 2.63Å; F727-L730 PolarHBondContact O-N 2.82Å; L730-V732 PolarHBondContact O-N 2.98Å; L730-A733 WeakPolarHBondContact O-CB 3.39Å; L730-A733 PolarHBondContact O-N 2.97Å
731	L	41.5	Very low	41.4	Very low	106 Å²	106	110.7 Å²	110.7	56%	0.555	60%	0.603	S	S	*	*	H	α-helix	trans	-63.3	-40.8	178.4	-75.7	165.5	0	0	0	112.2	A733 V734	L731-A733 PolarHBondContact O-N 2.91Å; L731-V734 PolarHBondContact O-N 3.12Å; L731-V734 VanDerWaalsContact O-N 3.17Å
732	V	44	Very low	41.2	Very low	97 Å²	97	115.1 Å²	115.1	59%	0.588	61%	0.612	S	S	*	*	H	α-helix	trans	-63.9	-26.7	177.6	-176.5	0	0	0	0	112.3	L730 V736	L730-V732 PolarHBondContact O-N 2.98Å; V732-V736 WeakPolarHBondContact O-CG2 3.44Å
733	A	40.6	Very low	40.9	Very low	52 Å²	52	115 Å²	115	43%	0.43	61%	0.607	S	S	.	*	H	α-helix	trans	-74.9	-24.3	178.2	0	0	0	0	0	113.5	L730 L731 T737	L730-A733 WeakPolarHBondContact O-CB 3.39Å; L730-A733 PolarHBondContact O-N 2.97Å; L731-A733 PolarHBondContact O-N 2.91Å; A733-T737 PolarHBondContact O-N 2.93Å; A733-T737 PolarHBondContact O-OG1 3.38Å
734	V	43	Very low	40.6	Very low	82 Å²	82	114 Å²	114	50%	0.497	61%	0.611	S	S	.	*	H	α-helix	trans	-77	-45.3	-179	179.6	0	0	0	0	111.2	L731 V736 T737 C738	L731-V734 PolarHBondContact O-N 3.12Å; L731-V734 VanDerWaalsContact O-N 3.17Å; V734-V736 VanDerWaalsContact C-N 3.29Å; V734-V736 PolarHBondContact O-N 2.89Å; V734-T737 WeakPolarHBondContact CA-OG1 3.5Å; V734-T737 PolarHBondContact O-N 2.8Å; V734-T737 VanDerWaalsContact O-N 3.15Å; V734-T737 PolarHBondContact O-OG1 2.98Å; V734-T737 VanDerWaalsContact O-OG1 3.08Å; V734-C738 PolarHBondContact O-N 2.86Å
735	D	43.9	Very low	39.9	Very low	126 Å²	126	111.6 Å²	111.6	67%	0.674	62%	0.619	S	S	*	*	H	α-helix	trans	-59.2	-41	175.6	-78.7	-40.3	0	0	0	111.9	T737 C738 Y739	D735-T737 VanDerWaalsContact C-N 3.34Å; D735-T737 PolarHBondContact O-N 2.9Å; D735-C738 PolarHBondContact O-N 3.2Å; D735-Y739 PolarHBondContact O-N 2.83Å
736	V	40.3	Very low	39.1	Very low	84 Å²	84	114.7 Å²	114.7	51%	0.509	63%	0.632	S	S	.	*	H	α-helix	trans	-66	-34.3	177.8	175.8	0	0	0	0	112	V732 V734 F740	V732-V736 WeakPolarHBondContact O-CG2 3.44Å; V734-V736 VanDerWaalsContact C-N 3.29Å; V734-V736 PolarHBondContact O-N 2.89Å; V736-F740 HydrophobicContact CG1-CD2 4.45Å; V736-F740 WeakPolarHBondContact O-CD2 3.44Å; V736-F740 PolarHBondContact O-N 2.8Å
737	T	40.3	Very low	38.3	Very low	81 Å²	81	118.6 Å²	118.6	50%	0.497	65%	0.649	S	S	.	*	H	α-helix	trans	-76.8	-34.5	176.3	33.7	0	0	0	0	112.9	A733 V734 D735 Y739 F740 L741	A733-T737 PolarHBondContact O-N 2.93Å; A733-T737 PolarHBondContact O-OG1 3.38Å; V734-T737 WeakPolarHBondContact CA-OG1 3.5Å; V734-T737 PolarHBondContact O-N 2.8Å; V734-T737 VanDerWaalsContact O-N 3.15Å; V734-T737 PolarHBondContact O-OG1 2.98Å; V734-T737 VanDerWaalsContact O-OG1 3.08Å; D735-T737 VanDerWaalsContact C-N 3.34Å; D735-T737 PolarHBondContact O-N 2.9Å; T737-Y739 VanDerWaalsContact C-N 3.33Å; T737-Y739 PolarHBondContact O-N 2.88Å; T737-F740 PolarHBondContact O-N 3.44Å; T737-L741 WeakPolarHBondContact O-CG 3.49Å; T737-L741 PolarHBondContact O-N 2.91Å; T737-L741 VanDerWaalsContact O-N 3.13Å
738	C	36.9	Very low	37.6	Very low	80 Å²	80	119.7 Å²	119.7	54%	0.541	66%	0.658	S	S	.	*	H	α-helix	trans	-63	-36.9	171.1	-73.9	0	0	0	0	112.6	V734 D735	V734-C738 PolarHBondContact O-N 2.86Å; D735-C738 PolarHBondContact O-N 3.2Å
739	Y	36.9	Very low	36.7	Very low	184 Å²	184	119.5 Å²	119.5	72%	0.722	67%	0.666	S	S	*	*	H	α-helix	trans	-66.1	-38.4	177.8	-159.4	-96	0	0	0	112.6	D735 T737	D735-Y739 PolarHBondContact O-N 2.83Å; T737-Y739 VanDerWaalsContact C-N 3.33Å; T737-Y739 PolarHBondContact O-N 2.88Å
740	F	35	Very low	36	Very low	159 Å²	159	121.5 Å²	121.5	70%	0.697	68%	0.675	S	S	*	*	H	α-helix	trans	-79.6	-25.6	180	-90.4	-86.1	0	0	0	114.6	V736 T737 N742	V736-F740 HydrophobicContact CG1-CD2 4.45Å; V736-F740 WeakPolarHBondContact O-CD2 3.44Å; V736-F740 PolarHBondContact O-N 2.8Å; T737-F740 PolarHBondContact O-N 3.44Å; F740-N742 VanDerWaalsContact C-N 3.26Å; F740-N742 PolarHBondContact O-N 3.14Å
741	L	37.9	Very low	35.3	Very low	141 Å²	141	120.8 Å²	120.8	74%	0.738	68%	0.684	S	S	*	*	H	α-helix	trans	-74.2	-13.2	179.4	-80	166.4	0	0	0	114.1	T737	T737-L741 WeakPolarHBondContact O-CG 3.49Å; T737-L741 PolarHBondContact O-N 2.91Å; T737-L741 VanDerWaalsContact O-N 3.13Å
742	N	36.7	Very low	34.5	Very low	152 Å²	152	121.7 Å²	121.7	81%	0.813	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	12.4	-177	-148.4	25.6	0	0	0	114.3	F740	F740-N742 VanDerWaalsContact C-N 3.26Å; F740-N742 PolarHBondContact O-N 3.14Å
743	K	36.5	Very low	33.8	Very low	131 Å²	131	125.1 Å²	125.1	57%	0.57	71%	0.709	S	S	*	*	S	Bend	trans	-121.7	-1.9	180	-110.2	-171	173.3	-172.1	0	115.5	D559 G560	D559-K743 PolarHBondContact O-NZ 3.44Å; G560-K743 PolarHBondContact O-NZ 3.29Å
744	C	32.2	Very low	33.1	Very low	121 Å²	121	128.4 Å²	128.4	82%	0.818	72%	0.723	S	S	*	*			trans	-136.5	124.6	177.1	-80.9	0	0	0	0	111.8
745	G	30.2	Very low	32.3	Very low	84 Å²	84	130.8 Å²	130.8	87%	0.866	74%	0.742	S	S	*	*			trans	-163.6	38.8	-169.4	0	0	0	0	0	117.2
746	L	28.2	Very low	31.6	Very low	159 Å²	159	128.6 Å²	128.6	83%	0.832	75%	0.749	S	S	*	*			trans	-132.6	142.9	167.4	-158.6	74.9	0	0	0	110.6
747	L	28.4	Very low	31	Very low	156 Å²	156	135.1 Å²	135.1	82%	0.817	77%	0.771	S	S	*	*			trans	57.3	107.6	-173.7	-65.9	105	0	0	0	116.3
748	M	27.2	Very low	30.5	Very low	173 Å²	173	136.1 Å²	136.1	85%	0.852	79%	0.787	S	S	*	*				-158.6	128.7	114.1	-101.6	-70	-94.1	0	0	109.7
749	C	26.4	Very low	30.1	Very low	117 Å²	117	135.8 Å²	135.8	79%	0.791	80%	0.797	S	S	*	*			trans	-147.6	154.3	172.9	-89.2	0	0	0	0	107.7
750	I	27.8	Very low	29.9	Very low	165 Å²	165	133.6 Å²	133.6	85%	0.846	81%	0.806	S	S	*	*			trans	71.3	121.6	-170.5	-47.5	166.4	0	0	0	111
751	A	26.6	Very low	29.6	Very low	86 Å²	86	129.6 Å²	129.6	71%	0.711	81%	0.809	S	S	*	*			cis	-140.8	177.5	-9.2	0	0	0	0	0	108.1
752	V	26.1	Very low	29.2	Very low	126 Å²	126	127.8 Å²	127.8	76%	0.764	82%	0.815	S	S	*	*				-162.4	144	64.1	161.4	0	0	0	0	110.5	V754	V752-V754 HydrophobicContact CG1-CG2 4.14Å
753	N	28.8	Very low	28.8	Very low	169 Å²	169	130.3 Å²	130.3	90%	0.904	82%	0.819	S	S	*	*			trans	-88.8	109.8	168.8	-111.6	-25.3	0	0	0	110.9
754	V	26.7	Very low	28.3	Very low	121 Å²	121	128.9 Å²	128.9	73%	0.733	83%	0.825	S	S	*	*			trans	-150.8	125.4	156.1	179.6	0	0	0	0	110.5	V752	V752-V754 HydrophobicContact CG1-CG2 4.14Å
755	C	25.7	Very low	28.2	Very low	131 Å²	131	133.1 Å²	133.1	89%	0.885	83%	0.829	S	S	*	*			trans	40.5	125.5	160.5	-62.7	0	0	0	0	121.8
756	G	28.2	Very low	28.2	Very low	81 Å²	81	135.6 Å²	135.6	84%	0.835	82%	0.823	S	S	*	*			trans	-175.6	53.3	169.6	0	0	0	0	0	116.6	A758	G756-A758 PolarHBondContact O-N 3.2Å
757	K	29.1	Very low	28.2	Very low	220 Å²	220	135 Å²	135	96%	0.957	82%	0.819	S	S	*	*			trans	-82.7	108	171.6	-86.6	-168.9	175.9	-175.1	0	111.6
758	A	29.4	Very low	28.1	Very low	102 Å²	102	137 Å²	137	84%	0.843	82%	0.824	S	S	*	*			trans	-163.9	134	150.3	0	0	0	0	0	109.7	G756	G756-A758 PolarHBondContact O-N 3.2Å
759	G	29.2	Very low	28.2	Very low	73 Å²	73	137 Å²	137	75%	0.753	82%	0.822	S	S	*	*			trans	-93	152.7	175.3	0	0	0	0	0	112.3
760	P	31.4	Very low	28.2	Very low	139 Å²	139	134.8 Å²	134.8	90%	0.903	82%	0.819	S	S	*	*			trans	-83	150	177.3	34.1	-34.5	0	0	0	112.3
761	G	29.2	Very low	28.2	Very low	74 Å²	74	136.2 Å²	136.2	76%	0.763	82%	0.819	S	S	*	*			trans	-152.4	157.4	171.6	0	0	0	0	0	111.8
762	A	28.8	Very low	28.3	Very low	104 Å²	104	136.9 Å²	136.9	86%	0.86	83%	0.825	S	S	*	*			trans	65.5	89	176.6	0	0	0	0	0	118.1
763	K	29.2	Very low	28.5	Very low	205 Å²	205	135.2 Å²	135.2	89%	0.891	82%	0.824	S	S	*	*				-92.9	158.6	123.2	-73.3	-178	-179.7	-178	0	107.1
764	S	26.6	Very low	28.4	Very low	100 Å²	100	137.3 Å²	137.3	70%	0.699	83%	0.825	S	S	*	*			cis	-168	152.4	-19.5	45	0	0	0	0	106.6
765	K	28.7	Very low	28.5	Very low	210 Å²	210	136.2 Å²	136.2	91%	0.913	82%	0.823	S	S	*	*			trans	-142.1	138.2	163.8	-101.4	-169	174.6	-174.6	0	110.3
766	D	30.1	Very low	28.7	Very low	136 Å²	136	140.2 Å²	140.2	73%	0.727	83%	0.825	S	S	*	*			trans	-91.2	147	-174.4	-71.1	-70.2	0	0	0	113
767	I	28.1	Very low	28.8	Very low	147 Å²	147	143.6 Å²	143.6	75%	0.754	83%	0.825	S	S	*	*			trans	39.2	113	136.4	-52.3	167.2	0	0	0	117.6
768	E	27.3	Very low	28.8	Very low	198 Å²	198	141.1 Å²	141.1	93%	0.925	82%	0.816	S	S	*	*				-144.7	157.5	126.5	-140.2	173.4	-154.5	0	0	110.9
769	E	28.5	Very low	28.7	Very low	174 Å²	174	140.8 Å²	140.8	81%	0.813	81%	0.808	S	S	*	*			trans	-84.2	138.1	-169.4	-61.3	-169	136.5	0	0	113.5
770	G	26.7	Very low	28.8	Very low	70 Å²	70	146.5 Å²	146.5	72%	0.722	81%	0.812	S	S	*	*			trans	-86.7	163.3	176.3	0	0	0	0	0	114.5
771	K	28.9	Very low	28.8	Very low	195 Å²	195	147 Å²	147	85%	0.848	80%	0.803	S	S	*	*			trans	-157.2	147.8	165.2	-113.8	152.2	-167.3	151.5	0	114.5
772	A	28.7	Very low	29.6	Very low	100 Å²	100	149.1 Å²	149.1	83%	0.826	80%	0.803	S	S	*	*			trans	61.3	112.7	158.7	0	0	0	0	0	119.1
773	A	29.3	Very low	29.7	Very low	91 Å²	91	150.5 Å²	150.5	75%	0.752	79%	0.794	S	S	*	*			trans	-69.7	164.7	163.5	0	0	0	0	0	112.9
774	F	27.6	Very low	29.6	Very low	212 Å²	212	146.7 Å²	146.7	93%	0.93	79%	0.788	S	S	*	*				-154.4	158.2	126.4	-121.8	-82.9	0	0	0	110.3
775	S	27.8	Very low	29.7	Very low	98 Å²	98	151 Å²	151	69%	0.685	80%	0.797	S	S	*	*			trans	-98.3	150.8	175.7	63.6	0	0	0	0	112.4
776	K	29.6	Very low	29.7	Very low	215 Å²	215	147.2 Å²	147.2	94%	0.935	79%	0.791	S	S	*	*			trans	-160.8	173.3	134.1	-114.9	176.4	-177.7	-173.6	0	112.2
777	D	30	Very low	29.7	Very low	153 Å²	153	151.2 Å²	151.2	82%	0.818	80%	0.796	S	S	*	*			trans	-115.3	-175	-158.6	-158.8	-11.3	0	0	0	111.4
778	E	29.4	Very low	29.8	Very low	167 Å²	167	151.1 Å²	151.1	78%	0.78	80%	0.802	S	S	*	*			trans	83.9	84.4	162.9	-59.3	-164.4	132.7	0	0	120.2
779	S	28.8	Very low	30	Very low	96 Å²	96	150.2 Å²	150.2	67%	0.671	80%	0.795	S	S	*	*				113.5	154.5	97.8	78.6	0	0	0	0	121.1
780	K	30.9	Very low	30	Very low	193 Å²	193	150.9 Å²	150.9	84%	0.839	80%	0.799	S	S	*	*			trans	84.7	82	156.9	-67	171.1	-170.4	172.1	0	120.1
781	E	31.2	Very low	30.2	Very low	150 Å²	150	155 Å²	155	70%	0.701	80%	0.799	S	S	*	*			trans	-59.5	165.2	130.9	-132.2	-169.7	-108.1	0	0	110.9	I783	E781-I783 HydrophobicContact CG-CG1 4.41Å
782	P	44.7	Very low	30.2	Very low	118 Å²	118	152.1 Å²	152.1	77%	0.766	79%	0.793	S	S	*	*				-142	155.5	69.6	38.8	-22.2	0	0	0	116.9
783	I	31.5	Very low	30.5	Very low	132 Å²	132	153.7 Å²	153.7	68%	0.677	79%	0.792	S	S	*	*			trans	-91.7	134.8	164.9	-59.3	159.8	0	0	0	109.7	E781	E781-I783 HydrophobicContact CG-CG1 4.41Å
784	V	27.2	Very low	31.3	Very low	125 Å²	125	154.5 Å²	154.5	76%	0.758	79%	0.79	S	S	*	*			trans	-145.4	115.2	151.7	-174.7	0	0	0	0	110.9	V786	V784-V786 HydrophobicContact CG1-CG2 3.84Å
785	E	29.1	Very low	31.5	Very low	192 Å²	192	151 Å²	151	90%	0.897	78%	0.781	S	S	*	*			trans	-130.4	133.5	150.4	-125.3	-170.8	-163.4	0	0	107.6
786	V	28	Very low	31.7	Very low	129 Å²	129	153.8 Å²	153.8	78%	0.782	78%	0.783	S	S	*	*			trans	-114.9	117.3	-175.9	175.5	0	0	0	0	110.2	V784	V784-V786 HydrophobicContact CG1-CG2 3.84Å
787	R	31.4	Very low	31.8	Very low	220 Å²	220	152.3 Å²	152.3	83%	0.83	78%	0.779	S	S	*	*			trans	-66.4	147.5	169.7	-68.5	170.9	165.9	151.6	-7	111.7
788	T	29.3	Very low	31.8	Very low	145 Å²	145	148.9 Å²	148.9	89%	0.89	78%	0.781	S	S	*	*			trans	-116.9	161.3	133.9	41.4	0	0	0	0	109.6
789	K	31.7	Very low	31.7	Very low	179 Å²	179	145 Å²	145	78%	0.778	79%	0.786	S	S	*	*			trans	-119.4	159.2	-179.4	-60.8	175.2	176.6	179.8	0	109.3
790	E	29.4	Very low	31.8	Very low	189 Å²	189	144 Å²	144	88%	0.883	79%	0.791	S	S	*	*			trans	159.7	161.1	136.8	-89.7	159.9	-157.4	0	0	108.5
791	E	30.5	Very low	33.2	Very low	156 Å²	156	140.6 Å²	140.6	73%	0.729	79%	0.788	S	S	*	*				-160.3	160.8	-52.4	-155.6	-178.7	-121.4	0	0	107.2
792	N	28.4	Very low	33.3	Very low	135 Å²	135	140.5 Å²	140.5	72%	0.722	80%	0.798	S	S	*	*			trans	74.8	142.6	163.3	-56.7	-54.1	0	0	0	121.6
793	T	34.3	Very low	33	Very low	132 Å²	132	143 Å²	143	81%	0.81	80%	0.799	S	S	*	*			trans	-90.5	-176.7	170	47.3	0	0	0	0	109.8
794	P	47.4	Very low	34.2	Very low	109 Å²	109	142.4 Å²	142.4	71%	0.708	80%	0.804	S	S	*	*			cis	-150	-171.1	21.5	45.3	-22.7	0	0	0	119
795	N	31.1	Very low	34.5	Very low	138 Å²	138	141.3 Å²	141.3	74%	0.738	79%	0.794	S	S	*	*			trans	31.6	124.4	150.9	-71.4	16.3	0	0	0	124.8
796	Q	33	Very low	34.8	Very low	157 Å²	157	139.7 Å²	139.7	73%	0.734	79%	0.786	S	S	*	*			trans	58.6	142.4	130.1	-73.4	-171	-80.8	0	0	124.4
797	E	30.8	Very low	34.9	Very low	183 Å²	183	139.9 Å²	139.9	86%	0.855	79%	0.788	S	S	*	*			trans	64.7	143.2	160	-68.2	174.2	-164.1	0	0	118.1
798	G	29.3	Very low	34.9	Very low	82 Å²	82	135.8 Å²	135.8	85%	0.845	79%	0.787	S	S	*	*			cis	177.3	172	-4.9	0	0	0	0	0	111.6
799	G	28.8	Very low	36.1	Very low	86 Å²	86	134 Å²	134	89%	0.887	78%	0.778	S	S	*	*			trans	160.9	138	171.7	0	0	0	0	0	117
800	G	30.7	Very low	36.1	Very low	75 Å²	75	132.4 Å²	132.4	77%	0.773	78%	0.777	S	S	*	*			trans	-122.5	-140.7	166.7	0	0	0	0	0	110.1
801	P	59.4	Low	36.2	Very low	121 Å²	121	129.7 Å²	129.7	79%	0.786	77%	0.774	S	S	*	*			cis	-136.9	177.3	-16.9	42.2	-26.9	0	0	0	114
802	T	33	Very low	36.4	Very low	148 Å²	148	131 Å²	131	91%	0.908	78%	0.78	S	S	*	*			trans	-176.9	148.9	137.6	16.6	0	0	0	0	114
803	E	38.3	Very low	37.5	Very low	170 Å²	170	130.2 Å²	130.2	79%	0.794	78%	0.782	S	S	*	*			trans	-90.6	-176	176.2	-69.2	174.4	142.1	0	0	111.4
804	P	57.8	Low	37.3	Very low	119 Å²	119	131.8 Å²	131.8	77%	0.773	79%	0.786	S	S	*	*			cis	-137.4	-176.8	11.2	37	-14.3	0	0	0	115.8
805	N	33.1	Very low	36.4	Very low	103 Å²	103	130 Å²	130	55%	0.551	79%	0.787	S	S	*	*			cis	-158.8	168.3	-20.5	-107.5	27.7	0	0	0	111.3
806	E	35.5	Very low	36.5	Very low	158 Å²	158	132.6 Å²	132.6	74%	0.738	79%	0.792	S	S	*	*			trans	22.4	137.5	140.4	-50.8	171.1	123	0	0	121.2
807	T	30.2	Very low	36.3	Very low	132 Å²	132	131 Å²	131	81%	0.81	79%	0.793	S	S	*	*			cis	-158.4	175.2	47.3	22.6	0	0	0	0	113.3
808	T	30.1	Very low	36.3	Very low	134 Å²	134	128.4 Å²	128.4	82%	0.822	79%	0.789	S	S	*	*			trans	-140	-177.9	-174.1	37.7	0	0	0	0	110.4
809	P	55.8	Low	36.4	Very low	107 Å²	107	133.5 Å²	133.5	70%	0.695	79%	0.788	S	S	*	*			cis	-138.2	-161	-25.7	30	-5.6	0	0	0	114
810	L	31.5	Very low	36.5	Very low	146 Å²	146	133.5 Å²	133.5	76%	0.764	77%	0.774	S	S	*	*			trans	87	115.2	146.3	-76.4	169.1	0	0	0	123.4
811	T	30.5	Very low	36.8	Very low	133 Å²	133	136.9 Å²	136.9	82%	0.816	78%	0.775	S	S	*	*			trans	71.7	152.7	139.6	45	0	0	0	0	124.2
812	E	35.8	Very low	35.5	Very low	182 Å²	182	138.6 Å²	138.6	85%	0.85	78%	0.777	S	S	*	*			trans	-53.2	166.7	174.6	-67	175.7	168.4	0	0	115
813	P	49.9	Very low	35.5	Very low	119 Å²	119	136 Å²	136	77%	0.773	77%	0.77	S	S	*	*			cis	-154.4	-166	39.3	45.4	-22.4	0	0	0	119.4
814	D	31.9	Very low	35.2	Very low	166 Å²	166	137.7 Å²	137.7	89%	0.888	78%	0.775	S	S	*	*			trans	-1.2	139.3	161.4	-80	-54.7	0	0	0	122.7
815	G	28.1	Very low	34.1	Very low	70 Å²	70	135.4 Å²	135.4	72%	0.722	77%	0.767	S	S	*	*				126.9	113.7	115.8	0	0	0	0	0	122.1
816	K	32.3	Very low	34	Very low	194 Å²	194	139.3 Å²	139.3	84%	0.843	78%	0.781	S	S	*	*			trans	72.6	107	131.2	-83.6	-177.7	177	171.9	0	124.2
817	T	29.8	Very low	35.1	Very low	123 Å²	123	137.2 Å²	137.2	76%	0.755	78%	0.782	S	S	*	*				85.1	138	118.4	51	0	0	0	0	126.2
818	V	31.5	Very low	35.1	Very low	128 Å²	128	139.6 Å²	139.6	78%	0.776	78%	0.784	S	S	*	*			trans	94.3	115.6	139.4	161.5	0	0	0	0	122.2
819	K	29.9	Very low	35.3	Very low	190 Å²	190	138.8 Å²	138.8	83%	0.826	78%	0.778	S	S	*	*				-174	121.8	128.9	-93.3	166.7	-178	178.6	0	106.8
820	S	32.2	Very low	34.2	Very low	86 Å²	86	142 Å²	142	60%	0.601	78%	0.781	S	S	*	*				69.3	128.3	57.1	75.5	0	0	0	0	113.7
821	D	35.8	Very low	34.1	Very low	146 Å²	146	142.2 Å²	142.2	78%	0.781	78%	0.783	S	S	*	*			cis	-168	175	0.9	-110.3	-30.6	0	0	0	113.1
822	N	33.5	Very low	34.2	Very low	157 Å²	157	139.9 Å²	139.9	84%	0.84	78%	0.777	S	S	*	*			trans	72.6	140.1	167.9	-66.4	-50.5	0	0	0	117.9
823	A	32.6	Very low	33.9	Very low	92 Å²	92	137.6 Å²	137.6	76%	0.76	78%	0.776	S	S	*	*			cis	-154.9	-171.4	-6	0	0	0	0	0	108
824	K	32.2	Very low	33	Very low	207 Å²	207	136.3 Å²	136.3	90%	0.9	78%	0.775	S	S	*	*			cis	-152.5	-154.4	11.8	-159.5	-157.8	165.5	-170.2	0	109.2
825	A	33.2	Very low	33	Very low	71 Å²	71	136.9 Å²	136.9	59%	0.587	77%	0.773	S	S	*	*			trans	-148.7	154.9	-173.5	0	0	0	0	0	116
826	E	32.5	Very low	33.3	Very low	185 Å²	185	139.3 Å²	139.3	86%	0.864	77%	0.773	S	S	*	*			trans	61.9	159.7	148.2	-79.7	-177.1	174.9	0	0	122.3
827	P	58.1	Low	33.1	Very low	114 Å²	114	139 Å²	139	74%	0.74	77%	0.771	S	S	*	*			cis	-119.7	-155.7	-6.4	29.1	-4.9	0	0	0	111.2
828	E	30.1	Very low	33.2	Very low	182 Å²	182	138.8 Å²	138.8	85%	0.85	77%	0.771	S	S	*	*			cis	-133.4	-138.5	9.1	-67.7	-172.5	69.2	0	0	113.8
829	V	33.5	Very low	33.4	Very low	116 Å²	116	139 Å²	139	70%	0.703	77%	0.771	S	S	*	*			trans	-147.6	126.9	-140.3	163.2	0	0	0	0	116.9
830	K	33.2	Very low	34.2	Very low	175 Å²	175	135.9 Å²	135.9	76%	0.761	77%	0.771	S	S	*	*			trans	34	138.7	139.7	-50.2	171.7	-171.8	172.2	0	123.4
831	N	29.3	Very low	34.3	Very low	150 Å²	150	139 Å²	139	80%	0.802	78%	0.781	S	S	*	*				175	138	110.8	-89.5	-21.2	0	0	0	111.4
832	A	33.1	Very low	34.1	Very low	84 Å²	84	141.4 Å²	141.4	69%	0.694	79%	0.787	S	S	*	*				59.8	138	82.7	0	0	0	0	0	114.1
833	T	29.7	Very low	34.1	Very low	135 Å²	135	138 Å²	138	83%	0.828	78%	0.782	S	S	*	*			cis	-161.7	139.5	13.9	5.2	0	0	0	0	108.2
834	A	31.8	Very low	35.1	Very low	91 Å²	91	139.3 Å²	139.3	75%	0.752	78%	0.782	S	S	*	*				81.6	150.1	89.1	0	0	0	0	0	119.2
835	E	31.3	Very low	35	Very low	179 Å²	179	141.6 Å²	141.6	84%	0.836	79%	0.785	S	S	*	*			trans	76.6	108.7	162.3	-67.8	-170.5	-177.6	0	0	124.8
836	V	32.9	Very low	35.1	Very low	121 Å²	121	142.2 Å²	142.2	73%	0.733	79%	0.79	S	S	*	*				35.4	122.4	115.5	-174.1	0	0	0	0	121
837	K	29.3	Very low	35	Very low	186 Å²	186	141.5 Å²	141.5	81%	0.809	79%	0.793	S	S	*	*				-176	116.5	128.8	-101.4	159	-173.6	163.9	0	112.3
838	T	31.1	Very low	33.7	Very low	120 Å²	120	139.3 Å²	139.3	74%	0.736	79%	0.791	S	S	*	*				65.7	126.6	97.8	65.5	0	0	0	0	117.9
839	V	36.7	Very low	33.8	Very low	131 Å²	131	137.1 Å²	137.1	79%	0.794	79%	0.785	S	S	*	*			trans	-52.3	146.5	169.2	175	0	0	0	0	114.1
840	P	46.3	Very low	33.9	Very low	125 Å²	125	139.7 Å²	139.7	81%	0.812	79%	0.789	S	S	*	*			trans	-107	147.2	142.5	35.8	-29.4	0	0	0	111.7
841	N	34.7	Very low	34	Very low	153 Å²	153	136.2 Å²	136.2	82%	0.818	79%	0.787	S	S	*	*			trans	-110	132.7	-175.1	-173.5	22.2	0	0	0	109.1
842	E	30.5	Very low	34.5	Very low	195 Å²	195	138.9 Å²	138.9	91%	0.911	79%	0.791	S	S	*	*			trans	-153.9	139.8	168.9	-137.6	171.6	-132.1	0	0	113.9
843	A	34	Very low	35	Very low	87 Å²	87	143.5 Å²	143.5	72%	0.719	83%	0.829	S	S	*	*			trans	-163.1	174.8	179.6	0	0	0	0	0	107.6
844	P	53	Low	35.2	Very low	119 Å²	119	143.9 Å²	143.9	77%	0.773	83%	0.829	S	S	*	*			cis	-125.1	-175.9	-8.4	41.5	-28	0	0	0	112.5
845	R	30.6	Very low	35.4	Very low	254 Å²	254	146.7 Å²	146.7	96%	0.958	83%	0.833	S	S	*	*			trans	-147	156.9	150.1	-113.1	170.9	-169.4	178.7	4.1	111.3
846	A	34.7	Very low	35.6	Very low	85 Å²	85	144.9 Å²	144.9	70%	0.702	83%	0.833	S	S	*	*			trans	-122.5	-178.1	-160.9	0	0	0	0	0	113.4
847	N	31.8	Very low	35.8	Very low	170 Å²	170	146.3 Å²	146.3	91%	0.909	84%	0.839	S	S	*	*			trans	82.4	137.5	-176.4	-48.5	-16	0	0	0	114
848	G	30.9	Very low	36.2	Very low	68 Å²	68	143.8 Å²	143.8	70%	0.701	84%	0.841	S	S	*	*			cis	161.1	150.1	-9.7	0	0	0	0	0	113.8
849	N	32.3	Very low	36.5	Very low	135 Å²	135	145.4 Å²	145.4	72%	0.722	85%	0.848	S	S	*	*			trans	62.2	133.9	168.3	-80.8	36.9	0	0	0	120.2
850	E	34.6	Very low	36.5	Very low	170 Å²	170	146.4 Å²	146.4	79%	0.794	85%	0.852	S	S	*	*				58.8	143.8	129	-64.8	171.1	147.6	0	0	120.3
851	S	35	Very low	35.8	Very low	103 Å²	103	148.1 Å²	148.1	72%	0.72	86%	0.855	S	S	*	*			cis	-163.7	160.8	-0.4	47.7	0	0	0	0	111.5
852	K	39.7	Very low	35.9	Very low	206 Å²	206	147.7 Å²	147.7	90%	0.896	86%	0.858	S	S	*	*			trans	15.1	116	149.5	-61.8	177.8	178.5	178.3	0	118.4
853	A	43	Very low	36.3	Very low	180 Å²	180	143.4 Å²	143.4	100%	1.488	85%	0.853	S	S	*	*				-142.6	0	126.1	0	0	0	0	0	107.6

Retrieved 853 of 853 residues in 2515.3 ms (Link to these results)

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