A0A077Z6N6_TRITR Loading...

LRR 4 and LRR 5 and LRR 7 and LRR 1 and TIR and L RR 8 and LRR 6 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z6N6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,209 aa.

						>A0A077Z6N6_TRITR|A0A077Z6N6
MRVLAALCLLLLLLLASKTLLSDAATPSCPARCHCLNDKAGKNERWHVTCKWERIPLLDVLSAFPVNVTSLTIQCSDNMATSHYSSGMFTSLRGQLWNLTISNCRPADSSSSPVVITRNMPSLRYLQLDHLGEWWKPTDDDSLLLNDSSALERLVLSSNGLEKMPSLCHLTELKLLNLSSNRLSSLQWLSACSRKLVTLDVSRNRVASIGRHQLKAVKSLRVLVAAHNMLQAIGDDAFDDVVHLRELRLAANLLTTVASLPFQLEQLDLSANWLPSVPSVIGRMGHLQYLNLSDNRLEQFHFDCLRESASTVKVLDLSRNRLSLIGLANSLTTGEMKLSSLEVLLVVNNRLERFDLKGVEFPALKKLDLSGNHFPDVRFSHLKGMPNLRSLKISDSSVGSVEEDAFVGSTQVKELCLAGNFLVQVPKVIRMLTNLTNLDLSGNRIEAIPKFLFDNLPAMSGLNLANNHIVAIDRYVFTSVPNLVELNLANNAISQLSVNCFDGLTNLRRLHLQGNNIGDLQGVLSNLDRLDYVNVSGNWISSLNLKILPSSLSHLDASRNRISKVTNFLHGLNKETWLRQADFSFNNIQQLSADSVADTLRLVNFSHNSIERVQARSFFNCTQLSSVDLRYNKLRTIEASALQLRSTNLTASTASLVYLSNNPFQCDCYIGWLSGSLDDHAQLFCTPTALKNAEKSIIISKAPVEAFVCAYDHFCMVDCPCCEFDSCDCNSVCPADCSCYHDATLTLNKVVCSAAEVQPKNVPMLATEIRMDGVSAGGGDSRRLPRNAFLGRHRLRQLYLNSSRLGRIDEKAFNDLAALWLLDLSENELETLTGSEFYKVPKVTHLFLHKNRLATIGDYLFAQLANLRVLTLHGNRFHYLPPKIAASDAPYLRSVTLGQNPWKCDCGDKLLLQNWLPGNRALVPDHESLYCQEDLTAPASDSTVLRLLPPSKGHHFVKVNFWTFLIDLNRTFCRPKQVGASPADRSEPQQAEKEEGEDDFPVESSIGYKVCKNLRRKKFYKHYVGEVGTGDSSCDNGNYSLPASLLQHDLLIYCSWEERHWVEQQLVKRLEDELPYHRLCMLYRDLRTHQRVADELIAAMERSQRVIVVLSDSFIRNEWQQTAIRIAFNHLLRDRQRNLVLILPSQLAPDMDPILAHHLRTNRCLYWNEPLFWEKLRDSVPEQFAHDLVPSESSNYADMYGTIVPSHFV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	53.1	Low	73	Confident	202 Å²	202	117.2 Å²	117.2	100%	0.995	63%	0.626	S	S	*	*				0	-67.6	0	-74.3	-92.4	-105.7	0	0	112.2	V3 L4 A5	M1-V3 PolarHBondContact O-N 3.09Å; M1-L4 PolarHBondContact O-N 2.99Å; M1-A5 PolarHBondContact O-N 2.96Å; M1-A5 VanDerWaalsContact O-N 3.1Å
2	R	66.3	Low	73	Confident	233 Å²	233	116.9 Å²	116.9	88%	0.879	62%	0.623	S	S	*	*	H	α-helix	trans	-60.7	-36.6	-179.3	-69.7	-175.7	179.3	176.9	-0.3	114.7	A5 A6	R2-A5 PolarHBondContact O-N 3.49Å; R2-A6 PolarHBondContact O-N 2.86Å
3	V	72.4	Confident	72.2	Confident	110 Å²	110	116.9 Å²	116.9	67%	0.667	62%	0.623	S	S	*	*	H	α-helix	trans	-68.8	-36.9	176.3	-179.6	0	0	0	0	112.4	M1 A6 L7	M1-V3 PolarHBondContact O-N 3.09Å; V3-A6 PolarHBondContact O-N 2.83Å; V3-L7 HydrophobicContact CG1-CD1 4.32Å; V3-L7 PolarHBondContact O-N 3.16Å; V3-L7 VanDerWaalsContact O-N 3.1Å
4	L	73.8	Confident	71	Confident	126 Å²	126	116.2 Å²	116.2	66%	0.66	62%	0.618	S	S	*	*	H	α-helix	trans	-66.7	-39.3	175.5	-92.5	149.1	0	0	0	111.7	M1 A6 L7 C8	M1-L4 PolarHBondContact O-N 2.99Å; L4-A6 VanDerWaalsContact C-N 3.35Å; L4-A6 PolarHBondContact O-N 3.19Å; L4-L7 PolarHBondContact O-N 3.34Å; L4-C8 PolarHBondContact O-N 3.24Å; L4-C8 VanDerWaalsContact O-N 3.12Å
5	A	76.9	Confident	69.9	Low	55 Å²	55	116.6 Å²	116.6	46%	0.455	62%	0.62	S	S	.	*	H	α-helix	trans	-64	-38.9	174.7	0	0	0	0	0	112.3	M1 R2 C8 L9	M1-A5 PolarHBondContact O-N 2.96Å; M1-A5 VanDerWaalsContact O-N 3.1Å; R2-A5 PolarHBondContact O-N 3.49Å; A5-C8 PolarHBondContact O-N 3.23Å; A5-L9 PolarHBondContact O-N 3.35Å; A5-L9 VanDerWaalsContact O-N 3.16Å
6	A	77.4	Confident	68.2	Low	53 Å²	53	113.2 Å²	113.2	44%	0.438	61%	0.613	S	S	.	*	H	α-helix	trans	-66.6	-39.2	176.8	0	0	0	0	0	112.6	R2 V3 L4 L9 L10	R2-A6 PolarHBondContact O-N 2.86Å; V3-A6 PolarHBondContact O-N 2.83Å; L4-A6 VanDerWaalsContact C-N 3.35Å; L4-A6 PolarHBondContact O-N 3.19Å; A6-L9 PolarHBondContact O-N 2.69Å; A6-L10 PolarHBondContact O-N 3.21Å; A6-L10 VanDerWaalsContact O-N 3.11Å
7	L	78.6	Confident	66.5	Low	104 Å²	104	111.4 Å²	111.4	55%	0.545	61%	0.611	S	S	.	*	H	α-helix	trans	-65.9	-40.2	175.8	-90.9	153.8	0	0	0	112.6	V3 L4 L10 L11	V3-L7 HydrophobicContact CG1-CD1 4.32Å; V3-L7 PolarHBondContact O-N 3.16Å; V3-L7 VanDerWaalsContact O-N 3.1Å; L4-L7 PolarHBondContact O-N 3.34Å; L7-L10 PolarHBondContact O-N 3.32Å; L7-L11 PolarHBondContact O-N 2.83Å
8	C	77	Confident	64.7	Low	80 Å²	80	115.6 Å²	115.6	54%	0.541	62%	0.622	S	S	.	*	H	α-helix	trans	-63.8	-40	174.4	-87.3	0	0	0	0	112.8	L4 A5 L11 L12	L4-C8 PolarHBondContact O-N 3.24Å; L4-C8 VanDerWaalsContact O-N 3.12Å; A5-C8 PolarHBondContact O-N 3.23Å; C8-L11 PolarHBondContact O-N 3.4Å; C8-L12 WeakPolarHBondContact O-CG 3.19Å; C8-L12 PolarHBondContact O-N 2.78Å
9	L	76.6	Confident	63.1	Low	111 Å²	111	115.6 Å²	115.6	58%	0.581	63%	0.627	S	S	*	*	H	α-helix	trans	-64.6	-38.7	176.4	-91	154.3	0	0	0	112.2	A5 A6 L12 L13	A5-L9 PolarHBondContact O-N 3.35Å; A5-L9 VanDerWaalsContact O-N 3.16Å; A6-L9 PolarHBondContact O-N 2.69Å; L9-L12 PolarHBondContact O-N 3.23Å; L9-L13 WeakPolarHBondContact O-CG 3.48Å; L9-L13 PolarHBondContact O-N 2.9Å
10	L	75.2	Confident	61.5	Low	108 Å²	108	117.2 Å²	117.2	57%	0.565	63%	0.634	S	S	*	*	H	α-helix	trans	-66.9	-38.7	175.9	-114.5	144.7	0	0	0	112.3	A6 L7 L13 L14	A6-L10 PolarHBondContact O-N 3.21Å; A6-L10 VanDerWaalsContact O-N 3.11Å; L7-L10 PolarHBondContact O-N 3.32Å; L10-L13 PolarHBondContact O-N 3.49Å; L10-L14 WeakPolarHBondContact O-CB 3.49Å; L10-L14 WeakPolarHBondContact O-CG 3.35Å; L10-L14 PolarHBondContact O-N 3.24Å
11	L	75.4	Confident	60	Low	107 Å²	107	119.6 Å²	119.6	56%	0.56	65%	0.646	S	S	*	*	H	α-helix	trans	-66.3	-39.7	174.4	-110	139.5	0	0	0	112.4	L7 C8 L14 L15	L7-L11 PolarHBondContact O-N 2.83Å; C8-L11 PolarHBondContact O-N 3.4Å; L11-L14 PolarHBondContact O-N 3.02Å; L11-L15 WeakPolarHBondContact O-CG 2.9Å; L11-L15 PolarHBondContact O-N 3.4Å
12	L	72.9	Confident	58.9	Low	114 Å²	114	115.1 Å²	115.1	60%	0.597	63%	0.634	S	S	*	*	H	α-helix	trans	-65.9	-37.5	174.7	-77.8	162.4	0	0	0	112.1	C8 L9 L15 A16	C8-L12 WeakPolarHBondContact O-CG 3.19Å; C8-L12 PolarHBondContact O-N 2.78Å; L9-L12 PolarHBondContact O-N 3.23Å; L12-L15 PolarHBondContact O-N 3.28Å; L12-A16 WeakPolarHBondContact O-CB 3.46Å; L12-A16 PolarHBondContact O-N 3Å
13	L	63.2	Low	57.2	Low	117 Å²	117	112 Å²	112	61%	0.613	64%	0.635	S	S	*	*	H	α-helix	trans	-70.3	-33.4	175.3	-77.7	160.7	0	0	0	112.9	L9 L10 A16 S17	L9-L13 WeakPolarHBondContact O-CG 3.48Å; L9-L13 PolarHBondContact O-N 2.9Å; L10-L13 PolarHBondContact O-N 3.49Å; L13-A16 PolarHBondContact O-N 3.12Å; L13-S17 PolarHBondContact O-N 3.09Å; L13-S17 PolarHBondContact O-OG 3.24Å
14	L	55.7	Low	55.3	Low	107 Å²	107	111.1 Å²	111.1	56%	0.56	64%	0.639	S	S	*	*	H	α-helix	trans	-71.1	-33.1	173.1	-81.2	160.8	0	0	0	112.4	L10 L11 S17	L10-L14 WeakPolarHBondContact O-CB 3.49Å; L10-L14 WeakPolarHBondContact O-CG 3.35Å; L10-L14 PolarHBondContact O-N 3.24Å; L11-L14 PolarHBondContact O-N 3.02Å; L14-S17 PolarHBondContact O-OG 3.07Å
15	L	53.5	Low	53.4	Low	122 Å²	122	109.6 Å²	109.6	64%	0.639	65%	0.645	S	S	*	*	H	α-helix	trans	-72.1	-34.7	172.2	-73.7	165.2	0	0	0	111.7	L11 L12	L11-L15 WeakPolarHBondContact O-CG 2.9Å; L11-L15 PolarHBondContact O-N 3.4Å; L12-L15 PolarHBondContact O-N 3.28Å
16	A	43.8	Very low	51.7	Low	62 Å²	62	112.8 Å²	112.8	51%	0.512	66%	0.659	S	S	.	*	H	α-helix	trans	-76.2	-18.7	179.5	0	0	0	0	0	114.4	L12 L13	L12-A16 WeakPolarHBondContact O-CB 3.46Å; L12-A16 PolarHBondContact O-N 3Å; L13-A16 PolarHBondContact O-N 3.12Å
17	S	38.6	Very low	50.3	Low	82 Å²	82	114 Å²	114	57%	0.573	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	0.8	-176	45.8	0	0	0	0	115	L13 L14	L13-S17 PolarHBondContact O-N 3.09Å; L13-S17 PolarHBondContact O-OG 3.24Å; L14-S17 PolarHBondContact O-OG 3.07Å
18	K	34.9	Very low	49.5	Very low	187 Å²	187	113 Å²	113	81%	0.813	66%	0.664	S	S	*	*	S	Bend	trans	-102.9	3	177.6	-81.9	-170.4	176.4	-176.6	0	115.9
19	T	34.4	Very low	49.3	Very low	117 Å²	117	111.3 Å²	111.3	72%	0.718	65%	0.652	S	S	*	*	S	Bend	trans	-117.5	30.7	179.7	50	0	0	0	0	113.6
20	L	30.2	Very low	49.4	Very low	147 Å²	147	106.5 Å²	106.5	77%	0.77	63%	0.628	S	S	*	*	S	Bend	trans	-131.5	68.6	171.1	-89.4	152.3	0	0	0	109
21	L	30.8	Very low	49.5	Very low	168 Å²	168	105.3 Å²	105.3	88%	0.88	63%	0.633	S	S	*	*	S	Bend	trans	-173.7	123.3	155.4	-96.1	144.7	0	0	0	109.4
22	S	29	Very low	49.8	Very low	107 Å²	107	107.3 Å²	107.3	75%	0.748	63%	0.634	S	S	*	*			trans	61.3	95.3	169.1	71.3	0	0	0	0	118.6
23	D	30.9	Very low	50.3	Low	168 Å²	168	103 Å²	103	90%	0.898	61%	0.612	S	S	*	*				-129.7	92.5	126.5	-92.2	-30.4	0	0	0	107	A25	D23-A25 PolarHBondContact O-N 3.24Å
24	A	32.2	Very low	51.3	Low	91 Å²	91	102.9 Å²	102.9	75%	0.752	61%	0.609	S	S	*	*			trans	-59.6	119	160	0	0	0	0	0	106.2	T26	A24-T26 PolarHBondContact O-N 3.07Å
25	A	35.3	Very low	52.6	Low	95 Å²	95	98.9 Å²	98.9	79%	0.785	59%	0.59	S	S	*	*			trans	-42.9	109.2	-177.6	0	0	0	0	0	110.7	D23	D23-A25 PolarHBondContact O-N 3.24Å
26	T	39.8	Very low	53.8	Low	122 Å²	122	97.9 Å²	97.9	75%	0.748	58%	0.584	S	S	*	*			trans	-56.7	129.3	159.5	38.7	0	0	0	0	106.2	A24 S28	A24-T26 PolarHBondContact O-N 3.07Å; T26-S28 PolarHBondContact O-N 2.95Å
27	P	48.8	Very low	55.2	Low	77 Å²	77	96.9 Å²	96.9	50%	0.5	57%	0.57	S	S	.	*			trans	-57.1	109	-178.8	19.5	-29.2	0	0	0	108.1	C29 P65	P27-C29 PolarHBondContact O-N 3.44Å; P27-P65 HydrophobicContact CB-CB 4.16Å; P27-P65 HydrophobicContact CB-CG 4.45Å; P27-P65 HydrophobicContact CG-CB 4.4Å
28	S	60.9	Low	56.3	Low	84 Å²	84	97.1 Å²	97.1	59%	0.587	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-72.1	120.5	-173.4	49	0	0	0	0	108.2	T26	T26-S28 PolarHBondContact O-N 2.95Å
29	C	74.1	Confident	57.3	Low	44 Å²	44	97.2 Å²	97.2	30%	0.297	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-57.6	130.8	167.5	-163.6	0	0	0	0	108.3	P27 C33 C35	P27-C29 PolarHBondContact O-N 3.44Å; C29-C33 VanDerWaalsContact SG-C 3.53Å; C29-C33 PolarHBondContact SG-O 2.9Å; C29-C33 VanDerWaalsContact SG-O 3.38Å; C29-C35 VanDerWaalsContact CA-SG 3.54Å; C29-C35 HydrophobicContact CB-CB 3.71Å; C29-C35 WeakPolarHBondContact CB-SG 3.19Å; C29-C35 WeakPolarHBondContact SG-CB 3.16Å; C29-C35 PolarHBondContact SG-N 3.06Å; C29-C35 CovalentContact SG-SG 2.04Å; C29-C35 PolarHBondContact SG-SG 2.91Å
30	P	77.8	Confident	58	Low	10 Å²	10	96 Å²	96	7%	0.065	57%	0.567	C	S	.	*	P	Polyproline II helix	trans	-57.4	154.2	-178.8	-24.9	33.1	0	0	0	112.4	R32 C33 W52 V60 A63 F64	P30-R32 PolarHBondContact O-N 2.96Å; P30-C33 HydrophobicContact CB-CB 4.43Å; P30-C33 VanDerWaalsContact O-CB 3.31Å; P30-C33 WeakPolarHBondContact O-CB 3.42Å; P30-C33 PolarHBondContact O-N 3.27Å; P30-W52 HydrophobicContact CB-CZ2 4.47Å; P30-V60 HydrophobicContact CB-CG1 4.26Å; P30-A63 HydrophobicContact CG-CB 4.36Å; P30-F64 HydrophobicContact CG-CD1 3.71Å; P30-F64 HydrophobicContact CG-CE1 3.69Å; P30-F64 HydrophobicContact CG-CG 4.46Å; P30-F64 HydrophobicContact CG-CZ 4.44Å
31	A	77.8	Confident	58.5	Low	83 Å²	83	91.2 Å²	91.2	69%	0.686	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.5	137	177.1	0	0	0	0	0	111.2	C33 W52	A31-C33 PolarHBondContact O-N 3.39Å; A31-W52 PolarHBondContact O-NE1 3.05Å; A31-W52 VanDerWaalsContact O-NE1 3.07Å
32	R	81.6	Confident	59.4	Low	150 Å²	150	94 Å²	94	57%	0.566	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	64.7	15.6	-171.8	-46.7	-174.2	176.3	178.2	2.8	115.5	P30 K51 E53	P30-R32 PolarHBondContact O-N 2.96Å; R32-K51 WeakPolarHBondContact CB-O 3.29Å; R32-K51 WeakPolarHBondContact CD-O 3.37Å; R32-K51 PolarHBondContact O-N 3.48Å; R32-E53 IonicContact CZ-OE1 3.75Å; R32-E53 IonicContact NH1-OE1 2.89Å; R32-E53 PolarHBondContact NH1-OE1 3.07Å; R32-E53 IonicContact NH2-OE1 3.7Å; R32-E53 PolarHBondContact NH2-OE1 3.23Å
33	C	83.4	Confident	60.6	Low	22 Å²	22	94.5 Å²	94.5	15%	0.149	55%	0.553	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.6	152.2	168	-57.2	0	0	0	0	111.9	C29 P30 A31 V48 T49 C50 W52	C29-C33 VanDerWaalsContact SG-C 3.53Å; C29-C33 PolarHBondContact SG-O 2.9Å; C29-C33 VanDerWaalsContact SG-O 3.38Å; P30-C33 HydrophobicContact CB-CB 4.43Å; P30-C33 VanDerWaalsContact O-CB 3.31Å; P30-C33 WeakPolarHBondContact O-CB 3.42Å; P30-C33 PolarHBondContact O-N 3.27Å; A31-C33 PolarHBondContact O-N 3.39Å; C33-V48 HydrophobicContact CB-CG1 4.22Å; C33-T49 CarbonylContact C-O 3.53Å; C33-T49 VanDerWaalsContact CA-O 3.22Å; C33-T49 WeakPolarHBondContact CA-O 3.45Å; C33-C50 HydrophobicContact CB-CB 4.1Å; C33-C50 WeakPolarHBondContact CB-SG 3.2Å; C33-C50 WeakPolarHBondContact SG-CB 3.37Å; C33-C50 CovalentContact SG-SG 2.04Å; C33-C50 PolarHBondContact SG-SG 2.94Å; C33-W52 WeakPolarHBondContact SG-CZ2 3.13Å
34	H	84.5	Confident	62.1	Low	116 Å²	116	92 Å²	92	54%	0.537	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	119.8	170.5	-168.4	-59.1	0	0	0	108.8	L36 V48 T49	H34-L36 VanDerWaalsContact CE1-CD2 3.42Å; H34-L36 WeakPolarHBondContact CE1-CD2 3.1Å; H34-V48 WeakPolarHBondContact O-CA 3.35Å; H34-T49 PolarHBondContact N-O 2.93Å; H34-T49 PolarHBondContact O-N 2.86Å
35	C	82.2	Confident	64.1	Low	23 Å²	23	92.8 Å²	92.8	16%	0.155	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	115.1	-177.5	-60.5	0	0	0	0	109.6	C29 W46 V48	C29-C35 VanDerWaalsContact CA-SG 3.54Å; C29-C35 HydrophobicContact CB-CB 3.71Å; C29-C35 WeakPolarHBondContact CB-SG 3.19Å; C29-C35 WeakPolarHBondContact SG-CB 3.16Å; C29-C35 PolarHBondContact SG-N 3.06Å; C29-C35 CovalentContact SG-SG 2.04Å; C29-C35 PolarHBondContact SG-SG 2.91Å; C35-W46 HydrophobicContact CB-CE3 3.96Å; C35-W46 HydrophobicContact CB-CZ3 4.03Å; C35-V48 HydrophobicContact CB-CG2 4.28Å
36	L	79.1	Confident	66.3	Low	100 Å²	100	90.3 Å²	90.3	52%	0.524	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	135.2	177.5	-72.1	167	0	0	0	109.7	H34 W46 H47	H34-L36 VanDerWaalsContact CE1-CD2 3.42Å; H34-L36 WeakPolarHBondContact CE1-CD2 3.1Å; L36-W46 WeakPolarHBondContact O-CA 3.34Å; L36-H47 HydrophobicContact CB-CB 4.39Å; L36-H47 PolarHBondContact N-O 3.11Å; L36-H47 PolarHBondContact O-N 3.32Å
37	N	72.7	Confident	68.4	Low	42 Å²	42	87.9 Å²	87.9	23%	0.225	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	120.6	175.8	-172.8	-5	0	0	0	109.4	K39 R45 W46	N37-K39 PolarHBondContact O-N 3.3Å; N37-K39 VanDerWaalsContact O-N 3.17Å; N37-R45 PolarHBondContact OD1-O 2.8Å; N37-W46 HydrophobicContact CB-CD2 4.04Å; N37-W46 HydrophobicContact CB-CE3 3.88Å; N37-W46 HydrophobicContact CB-CH2 3.92Å; N37-W46 HydrophobicContact CB-CZ2 4.05Å; N37-W46 HydrophobicContact CB-CZ3 3.83Å
38	D	61.6	Low	70.3	Confident	87 Å²	87	84.2 Å²	84.2	47%	0.465	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	95.9	175.7	-167.2	4.5	0	0	0	109.5	A40 R45	D38-A40 PolarHBondContact O-N 3.15Å; D38-R45 PolarHBondContact N-O 3.48Å
39	K	55.3	Low	71.7	Confident	189 Å²	189	83.2 Å²	83.2	82%	0.822	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	5.7	-175	-72.9	-170.9	176.6	-178.1	0	114.4	N37 G41	N37-K39 PolarHBondContact O-N 3.3Å; N37-K39 VanDerWaalsContact O-N 3.17Å; K39-G41 PolarHBondContact O-N 3.08Å
40	A	49.7	Very low	72.5	Confident	90 Å²	90	81.1 Å²	81.1	74%	0.744	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-8.9	-172.6	0	0	0	0	0	115.2	D38	D38-A40 PolarHBondContact O-N 3.15Å
41	G	40.6	Very low	72.9	Confident	48 Å²	48	85.2 Å²	85.2	50%	0.495	44%	0.439	S	S	.	.	S	Bend	trans	-130.3	154.5	179.6	0	0	0	0	0	113.7	K39 N43	K39-G41 PolarHBondContact O-N 3.08Å; G41-N43 PolarHBondContact O-N 2.85Å
42	K	50.5	Low	73.4	Confident	226 Å²	226	82.1 Å²	82.1	98%	0.983	41%	0.41	S	S	*	.	S	Bend	trans	-58.2	-8.9	174.4	-79.6	-177.3	175.3	179.4	0	114.7
43	N	53.5	Low	73.5	Confident	117 Å²	117	79.7 Å²	79.7	63%	0.626	41%	0.405	S	S	*	.	S	Bend	trans	-111.1	115.3	173.1	-69.9	-3.1	0	0	0	108.2	G41 R45	G41-N43 PolarHBondContact O-N 2.85Å; N43-R45 PolarHBondContact O-N 2.91Å; N43-R45 VanDerWaalsContact O-N 3.15Å
44	E	62	Low	73.6	Confident	115 Å²	115	85.7 Å²	85.7	54%	0.537	42%	0.424	S	S	.	.			trans	-58	116.3	171.8	-66	-174.4	157.2	0	0	109.3	N67	E44-N67 WeakPolarHBondContact O-CB 3.4Å; E44-N67 PolarHBondContact O-ND2 3.33Å
45	R	75.2	Confident	73.7	Confident	109 Å²	109	80.7 Å²	80.7	41%	0.411	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	124	177	-72.4	-175.8	177.9	173.3	-0.5	108.6	N37 D38 N43 T69	N37-R45 PolarHBondContact OD1-O 2.8Å; D38-R45 PolarHBondContact N-O 3.48Å; N43-R45 PolarHBondContact O-N 2.91Å; N43-R45 VanDerWaalsContact O-N 3.15Å; R45-T69 HydrophobicContact CB-CG2 4.07Å; R45-T69 HydrophobicContact CG-CG2 3.79Å
46	W	81.9	Confident	73.7	Confident	43 Å²	43	80.8 Å²	80.8	16%	0.163	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	131.2	-177.3	-66.8	88	0	0	0	111.7	C35 L36 N37 V48 P65 N67 V68 T69 S70	C35-W46 HydrophobicContact CB-CE3 3.96Å; C35-W46 HydrophobicContact CB-CZ3 4.03Å; L36-W46 WeakPolarHBondContact O-CA 3.34Å; N37-W46 HydrophobicContact CB-CD2 4.04Å; N37-W46 HydrophobicContact CB-CE3 3.88Å; N37-W46 HydrophobicContact CB-CH2 3.92Å; N37-W46 HydrophobicContact CB-CZ2 4.05Å; N37-W46 HydrophobicContact CB-CZ3 3.83Å; W46-V48 HydrophobicContact CB-CG2 4.44Å; W46-P65 HydrophobicContact CD2-CB 4.02Å; W46-P65 HydrophobicContact CD2-CG 4.18Å; W46-P65 HydrophobicContact CE3-CG 4.28Å; W46-P65 HydrophobicContact CG-CB 4.02Å; W46-P65 HydrophobicContact CG-CG 4.44Å; W46-N67 PolarHBondContact N-O 3.19Å; W46-V68 HydrophobicContact CB-CG2 4.05Å; W46-T69 PolarHBondContact O-N 3Å; W46-T69 PolarHBondContact O-OG1 3.07Å; W46-S70 PolarHBondContact O-N 3.44Å
47	H	83.7	Confident	73.5	Confident	70 Å²	70	82.7 Å²	82.7	32%	0.324	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	119.6	166.4	-64.9	-91.8	0	0	0	108.7	L36 S70	L36-H47 HydrophobicContact CB-CB 4.39Å; L36-H47 PolarHBondContact N-O 3.11Å; L36-H47 PolarHBondContact O-N 3.32Å; H47-S70 WeakPolarHBondContact ND1-CB 3.21Å
48	V	89.1	Confident	73.4	Confident	1 Å²	1	85 Å²	85	1%	0.006	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	128	-175.4	-175.1	0	0	0	0	110	C33 H34 C35 W46 F64 V68 S70 L71 T72	C33-V48 HydrophobicContact CB-CG1 4.22Å; H34-V48 WeakPolarHBondContact O-CA 3.35Å; C35-V48 HydrophobicContact CB-CG2 4.28Å; W46-V48 HydrophobicContact CB-CG2 4.44Å; V48-F64 HydrophobicContact CB-CE1 4.47Å; V48-F64 HydrophobicContact CG1-CD1 3.87Å; V48-F64 HydrophobicContact CG1-CE1 3.5Å; V48-F64 HydrophobicContact CG1-CZ 4.49Å; V48-F64 HydrophobicContact CG2-CD1 4.48Å; V48-V68 HydrophobicContact CB-CG1 4.37Å; V48-V68 HydrophobicContact CG2-CB 4.48Å; V48-V68 HydrophobicContact CG2-CG1 3.91Å; V48-V68 HydrophobicContact CG2-CG2 3.7Å; V48-S70 PolarHBondContact N-O 3.38Å; V48-L71 HydrophobicContact CB-CD1 3.98Å; V48-L71 HydrophobicContact CG1-CD1 4.03Å; V48-L71 CarbonylContact O-C 3.59Å; V48-L71 WeakPolarHBondContact O-CA 3.48Å; V48-T72 PolarHBondContact O-N 3.4Å
49	T	89.3	Confident	73.7	Confident	63 Å²	63	87 Å²	87	39%	0.387	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	124	174.7	-57	0	0	0	0	109.7	C33 H34 T72	C33-T49 CarbonylContact C-O 3.53Å; C33-T49 VanDerWaalsContact CA-O 3.22Å; C33-T49 WeakPolarHBondContact CA-O 3.45Å; H34-T49 PolarHBondContact N-O 2.93Å; H34-T49 PolarHBondContact O-N 2.86Å; T49-T72 CarbonylContact C-O 3.12Å; T49-T72 WeakPolarHBondContact CA-O 3.49Å; T49-T72 HydrophobicContact CG2-CG2 4.15Å
50	C	90.2	Very high	74.4	Confident	0 Å²	0	80.8 Å²	80.8	0%	0	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	134.5	-176.6	-64.1	0	0	0	0	111	C33 W52 T72 Q74	C33-C50 HydrophobicContact CB-CB 4.1Å; C33-C50 WeakPolarHBondContact CB-SG 3.2Å; C33-C50 WeakPolarHBondContact SG-CB 3.37Å; C33-C50 CovalentContact SG-SG 2.04Å; C33-C50 PolarHBondContact SG-SG 2.94Å; C50-W52 HydrophobicContact CB-CD2 4.02Å; C50-W52 HydrophobicContact CB-CE3 3.93Å; C50-W52 HydrophobicContact CB-CH2 3.87Å; C50-W52 HydrophobicContact CB-CZ2 3.91Å; C50-W52 HydrophobicContact CB-CZ3 3.86Å; C50-T72 PolarHBondContact N-O 3.31Å; C50-Q74 PolarHBondContact O-N 3.1Å
51	K	87.3	Confident	75.4	Confident	96 Å²	96	76.6 Å²	76.6	42%	0.417	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	109.9	171	-69.3	-172	177.8	-176.3	0	109.7	R32 Q74	R32-K51 WeakPolarHBondContact CB-O 3.29Å; R32-K51 WeakPolarHBondContact CD-O 3.37Å; R32-K51 PolarHBondContact O-N 3.48Å; K51-Q74 WeakPolarHBondContact CA-O 3.41Å; K51-Q74 HydrophobicContact CG-CB 4.48Å
52	W	88.9	Confident	76.8	Confident	18 Å²	18	78.1 Å²	78.1	7%	0.068	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	163.6	-179.1	-67.4	-45.3	0	0	0	111.2	P30 A31 C33 C50 R54 P56 V60 L61 F64 I73 Q74 C75 S76	P30-W52 HydrophobicContact CB-CZ2 4.47Å; A31-W52 PolarHBondContact O-NE1 3.05Å; A31-W52 VanDerWaalsContact O-NE1 3.07Å; C33-W52 WeakPolarHBondContact SG-CZ2 3.13Å; C50-W52 HydrophobicContact CB-CD2 4.02Å; C50-W52 HydrophobicContact CB-CE3 3.93Å; C50-W52 HydrophobicContact CB-CH2 3.87Å; C50-W52 HydrophobicContact CB-CZ2 3.91Å; C50-W52 HydrophobicContact CB-CZ3 3.86Å; W52-R54 VanDerWaalsContact CB-O 3.25Å; W52-R54 WeakPolarHBondContact CB-O 3.47Å; W52-P56 HydrophobicContact CD2-CG 3.85Å; W52-P56 HydrophobicContact CE3-CG 3.75Å; W52-P56 HydrophobicContact CH2-CG 3.66Å; W52-P56 HydrophobicContact CZ2-CG 3.79Å; W52-P56 HydrophobicContact CZ3-CG 3.66Å; W52-V60 HydrophobicContact CZ2-CG1 4.1Å; W52-L61 HydrophobicContact CH2-CD2 3.74Å; W52-L61 HydrophobicContact CZ3-CD2 3.91Å; W52-F64 AromaticContact CH2-CZ 3.87Å; W52-F64 HydrophobicContact CH2-CZ 3.87Å; W52-I73 HydrophobicContact CE3-CG2 3.83Å; W52-I73 HydrophobicContact CZ3-CD1 4.21Å; W52-I73 HydrophobicContact CZ3-CG1 4.2Å; W52-I73 HydrophobicContact CZ3-CG2 4.12Å; W52-Q74 PolarHBondContact N-O 3.49Å; W52-C75 CarbonylContact O-C 3.59Å; W52-C75 WeakPolarHBondContact O-CA 3.43Å; W52-S76 PolarHBondContact O-N 3.21Å; W52-S76 PolarHBondContact O-OG 3.44Å
53	E	83.9	Confident	77.9	Confident	98 Å²	98	69.5 Å²	69.5	46%	0.458	35%	0.351	S	S	.	.	S	Bend	trans	-69.6	-39.9	170.3	-76.4	152.6	-140.9	0	0	110.5	R32 S76	R32-E53 IonicContact CZ-OE1 3.75Å; R32-E53 IonicContact NH1-OE1 2.89Å; R32-E53 PolarHBondContact NH1-OE1 3.07Å; R32-E53 IonicContact NH2-OE1 3.7Å; R32-E53 PolarHBondContact NH2-OE1 3.23Å; E53-S76 WeakPolarHBondContact CA-OG 3.26Å
54	R	85.7	Confident	79.1	Confident	148 Å²	148	64.8 Å²	64.8	56%	0.558	33%	0.325	S	S	*	.	S	Bend	trans	-147.9	164.1	173.6	57.2	-178.4	177	175.5	-1.1	109.7	W52 P56 A80	W52-R54 VanDerWaalsContact CB-O 3.25Å; W52-R54 WeakPolarHBondContact CB-O 3.47Å; R54-P56 WeakPolarHBondContact O-CD 3.35Å; R54-A80 HydrophobicContact CB-CB 4.05Å
55	I	86.5	Confident	79.6	Confident	11 Å²	11	59.4 Å²	59.4	6%	0.056	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-61.1	122.9	175.3	-56.5	178.8	0	0	0	109	L61 I73 S82 Y84 M88 I101 C104	I55-L61 HydrophobicContact CG2-CD1 4.44Å; I55-I73 HydrophobicContact CG1-CG2 4.24Å; I55-S82 PolarHBondContact N-OG 3.04Å; I55-Y84 HydrophobicContact CD1-CD1 4.43Å; I55-Y84 HydrophobicContact CD1-CE1 3.63Å; I55-M88 HydrophobicContact CG2-CE 3.7Å; I55-M88 HydrophobicContact CG2-SD 3.77Å; I55-I101 HydrophobicContact CD1-CD1 4.47Å; I55-I101 HydrophobicContact CD1-CG2 4.2Å; I55-C104 HydrophobicContact CD1-CB 4.01Å; I55-C104 HydrophobicContact CG1-CB 4.01Å
56	P	81.2	Confident	79.4	Confident	25 Å²	25	59.7 Å²	59.7	16%	0.162	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-71.7	165.2	-178.4	29.7	-34.9	0	0	0	112	W52 R54 V60 L61	W52-P56 HydrophobicContact CD2-CG 3.85Å; W52-P56 HydrophobicContact CE3-CG 3.75Å; W52-P56 HydrophobicContact CH2-CG 3.66Å; W52-P56 HydrophobicContact CZ2-CG 3.79Å; W52-P56 HydrophobicContact CZ3-CG 3.66Å; R54-P56 WeakPolarHBondContact O-CD 3.35Å; P56-V60 HydrophobicContact CB-CB 3.86Å; P56-V60 HydrophobicContact CB-CG1 4.15Å; P56-V60 HydrophobicContact CB-CG2 3.94Å; P56-V60 HydrophobicContact CG-CB 3.92Å; P56-V60 HydrophobicContact CG-CG1 3.88Å; P56-L61 HydrophobicContact CG-CD2 4.36Å
57	L	75.9	Confident	79.3	Confident	141 Å²	141	60.1 Å²	60.1	74%	0.738	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-63.1	160.8	175.1	-70.6	159.2	0	0	0	111.7	D59 V60	L57-D59 PolarHBondContact O-N 3.32Å; L57-V60 PolarHBondContact O-N 2.95Å; L57-V60 VanDerWaalsContact O-N 3.1Å
58	L	70.2	Confident	79.5	Confident	90 Å²	90	56.8 Å²	56.8	47%	0.471	30%	0.304	S	S	.	.	H	α-helix	trans	-50	-34.1	-170.5	-154.5	77.1	0	0	0	114.3	V60 L61 S62	L58-V60 VanDerWaalsContact C-N 3.33Å; L58-V60 PolarHBondContact O-N 3.13Å; L58-L61 PolarHBondContact O-N 3.29Å; L58-S62 PolarHBondContact O-N 3.34Å; L58-S62 VanDerWaalsContact O-N 3.12Å
59	D	67	Low	79.4	Confident	129 Å²	129	57.5 Å²	57.5	69%	0.69	31%	0.308	S	S	*	.	H	α-helix	trans	-61.1	-39.5	-177.4	-57.5	-24	0	0	0	112.4	L57 L61 S62	L57-D59 PolarHBondContact O-N 3.32Å; D59-L61 VanDerWaalsContact C-N 3.34Å; D59-L61 PolarHBondContact O-N 3.25Å; D59-S62 PolarHBondContact O-N 3.26Å; D59-S62 PolarHBondContact O-OG 3.42Å
60	V	70.4	Confident	79.5	Confident	59 Å²	59	55.2 Å²	55.2	36%	0.358	30%	0.295	S	S	.	.	H	α-helix	trans	-70.5	-34.2	179.3	-177.6	0	0	0	0	111.1	P30 W52 P56 L57 L58 S62 A63	P30-V60 HydrophobicContact CB-CG1 4.26Å; W52-V60 HydrophobicContact CZ2-CG1 4.1Å; P56-V60 HydrophobicContact CB-CB 3.86Å; P56-V60 HydrophobicContact CB-CG1 4.15Å; P56-V60 HydrophobicContact CB-CG2 3.94Å; P56-V60 HydrophobicContact CG-CB 3.92Å; P56-V60 HydrophobicContact CG-CG1 3.88Å; L57-V60 PolarHBondContact O-N 2.95Å; L57-V60 VanDerWaalsContact O-N 3.1Å; L58-V60 VanDerWaalsContact C-N 3.33Å; L58-V60 PolarHBondContact O-N 3.13Å; V60-S62 VanDerWaalsContact C-N 3.27Å; V60-S62 PolarHBondContact O-N 3.08Å; V60-A63 PolarHBondContact O-N 3.11Å
61	L	70	Confident	79.6	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-75.3	-17	178.6	-59	172.6	0	0	0	112.5	W52 I55 P56 L58 D59 A63 F64 M88 F89 S91	W52-L61 HydrophobicContact CH2-CD2 3.74Å; W52-L61 HydrophobicContact CZ3-CD2 3.91Å; I55-L61 HydrophobicContact CG2-CD1 4.44Å; P56-L61 HydrophobicContact CG-CD2 4.36Å; L58-L61 PolarHBondContact O-N 3.29Å; D59-L61 VanDerWaalsContact C-N 3.34Å; D59-L61 PolarHBondContact O-N 3.25Å; L61-A63 VanDerWaalsContact C-N 3.3Å; L61-F64 HydrophobicContact CB-CE2 4.3Å; L61-F64 HydrophobicContact CD2-CE2 3.65Å; L61-F64 HydrophobicContact CD2-CZ 4.16Å; L61-F64 WeakPolarHBondContact O-CD2 3.36Å; L61-M88 HydrophobicContact CD1-CE 4.16Å; L61-M88 HydrophobicContact CD1-CG 3.27Å; L61-M88 HydrophobicContact CD1-SD 3.85Å; L61-F89 HydrophobicContact CD1-CE1 4.47Å; L61-F89 HydrophobicContact CD2-CE1 4.35Å; L61-S91 PolarHBondContact O-OG 2.89Å
62	S	70.7	Confident	79.8	Confident	81 Å²	81	52.4 Å²	52.4	57%	0.566	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-16.3	173.6	77	0	0	0	0	113.5	L58 D59 V60 F64	L58-S62 PolarHBondContact O-N 3.34Å; L58-S62 VanDerWaalsContact O-N 3.12Å; D59-S62 PolarHBondContact O-N 3.26Å; D59-S62 PolarHBondContact O-OG 3.42Å; V60-S62 VanDerWaalsContact C-N 3.27Å; V60-S62 PolarHBondContact O-N 3.08Å; S62-F64 VanDerWaalsContact C-N 3.34Å; S62-F64 PolarHBondContact O-N 3.02Å
63	A	73.3	Confident	80	Confident	45 Å²	45	51.5 Å²	51.5	37%	0.372	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	0.8	-176.8	0	0	0	0	0	114.6	P30 V60 L61	P30-A63 HydrophobicContact CG-CB 4.36Å; V60-A63 PolarHBondContact O-N 3.11Å; L61-A63 VanDerWaalsContact C-N 3.3Å
64	F	79.6	Confident	80.4	Confident	17 Å²	17	50 Å²	50	8%	0.075	28%	0.275	C	S	.	.	S	Bend	trans	-64.2	150.9	177.8	-73.7	-57.4	0	0	0	112.3	P30 V48 W52 L61 S62 V68 L71 L92	P30-F64 HydrophobicContact CG-CD1 3.71Å; P30-F64 HydrophobicContact CG-CE1 3.69Å; P30-F64 HydrophobicContact CG-CG 4.46Å; P30-F64 HydrophobicContact CG-CZ 4.44Å; V48-F64 HydrophobicContact CB-CE1 4.47Å; V48-F64 HydrophobicContact CG1-CD1 3.87Å; V48-F64 HydrophobicContact CG1-CE1 3.5Å; V48-F64 HydrophobicContact CG1-CZ 4.49Å; V48-F64 HydrophobicContact CG2-CD1 4.48Å; W52-F64 AromaticContact CH2-CZ 3.87Å; W52-F64 HydrophobicContact CH2-CZ 3.87Å; L61-F64 HydrophobicContact CB-CE2 4.3Å; L61-F64 HydrophobicContact CD2-CE2 3.65Å; L61-F64 HydrophobicContact CD2-CZ 4.16Å; L61-F64 WeakPolarHBondContact O-CD2 3.36Å; S62-F64 VanDerWaalsContact C-N 3.34Å; S62-F64 PolarHBondContact O-N 3.02Å; F64-V68 HydrophobicContact CB-CG2 4.14Å; F64-L71 HydrophobicContact CE1-CD1 4.07Å; F64-L71 HydrophobicContact CE2-CD1 4.21Å; F64-L71 HydrophobicContact CE2-CD2 4.16Å; F64-L71 HydrophobicContact CZ-CD1 3.7Å; F64-L71 HydrophobicContact CZ-CD2 4.44Å; F64-L92 HydrophobicContact CB-CD2 4.29Å; F64-L92 HydrophobicContact CD2-CD1 4.22Å
65	P	72	Confident	80.6	Confident	3 Å²	3	43 Å²	43	2%	0.019	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-54.7	151.2	173.8	-22.4	31.5	0	0	0	112.6	P27 W46 V68	P27-P65 HydrophobicContact CB-CB 4.16Å; P27-P65 HydrophobicContact CB-CG 4.45Å; P27-P65 HydrophobicContact CG-CB 4.4Å; W46-P65 HydrophobicContact CD2-CB 4.02Å; W46-P65 HydrophobicContact CD2-CG 4.18Å; W46-P65 HydrophobicContact CE3-CG 4.28Å; W46-P65 HydrophobicContact CG-CB 4.02Å; W46-P65 HydrophobicContact CG-CG 4.44Å; P65-V68 WeakPolarHBondContact O-CG2 3.36Å
66	V	72	Confident	80.3	Confident	114 Å²	114	46.3 Å²	46.3	69%	0.691	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	135	168.2	-164.6	0	0	0	0	107.6
67	N	79.4	Confident	80.1	Confident	52 Å²	52	48.4 Å²	48.4	28%	0.278	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.8	34.9	-177	-48.5	-15.8	0	0	0	117.9	E44 W46 T69 Q95	E44-N67 WeakPolarHBondContact O-CB 3.4Å; E44-N67 PolarHBondContact O-ND2 3.33Å; W46-N67 PolarHBondContact N-O 3.19Å; N67-T69 PolarHBondContact O-N 3.08Å; N67-Q95 VanDerWaalsContact OD1-CD 3.26Å; N67-Q95 PolarHBondContact OD1-NE2 3.31Å; N67-Q95 PolarHBondContact OD1-OE1 3.19Å
68	V	86.2	Confident	79.5	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	115.2	165.8	-179	0	0	0	0	110.8	W46 V48 F64 P65 S70 L71 L92 Q95 L96	W46-V68 HydrophobicContact CB-CG2 4.05Å; V48-V68 HydrophobicContact CB-CG1 4.37Å; V48-V68 HydrophobicContact CG2-CB 4.48Å; V48-V68 HydrophobicContact CG2-CG1 3.91Å; V48-V68 HydrophobicContact CG2-CG2 3.7Å; F64-V68 HydrophobicContact CB-CG2 4.14Å; P65-V68 WeakPolarHBondContact O-CG2 3.36Å; V68-S70 WeakPolarHBondContact CG1-O 3.35Å; V68-L71 HydrophobicContact CG1-CB 4.33Å; V68-L92 HydrophobicContact CB-CD2 4Å; V68-L92 HydrophobicContact CG2-CD2 4.26Å; V68-Q95 CarbonylContact O-C 3.13Å; V68-L96 HydrophobicContact CG1-CD1 4.03Å
69	T	88.3	Confident	79.5	Confident	17 Å²	17	49.3 Å²	49.3	10%	0.104	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	-22.5	175.3	50.7	0	0	0	0	112.9	R45 W46 N67 W97 N98	R45-T69 HydrophobicContact CB-CG2 4.07Å; R45-T69 HydrophobicContact CG-CG2 3.79Å; W46-T69 PolarHBondContact O-N 3Å; W46-T69 PolarHBondContact O-OG1 3.07Å; N67-T69 PolarHBondContact O-N 3.08Å; T69-W97 PolarHBondContact O-N 3.19Å; T69-N98 PolarHBondContact O-N 3Å
70	S	90.7	Very high	79.9	Confident	14 Å²	14	44 Å²	44	10%	0.098	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	127.7	179.2	-170.5	0	0	0	0	110.8	W46 H47 V48 V68 N98	W46-S70 PolarHBondContact O-N 3.44Å; H47-S70 WeakPolarHBondContact ND1-CB 3.21Å; V48-S70 PolarHBondContact N-O 3.38Å; V68-S70 WeakPolarHBondContact CG1-O 3.35Å; S70-N98 CarbonylContact C-O 3.47Å; S70-N98 WeakPolarHBondContact CA-O 3.38Å
71	L	91.9	Very high	80.6	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	124.4	177.8	179.1	60.6	0	0	0	110.5	V48 F64 V68 I73 F89 L92 L96 N98 L99 T100	V48-L71 HydrophobicContact CB-CD1 3.98Å; V48-L71 HydrophobicContact CG1-CD1 4.03Å; V48-L71 CarbonylContact O-C 3.59Å; V48-L71 WeakPolarHBondContact O-CA 3.48Å; F64-L71 HydrophobicContact CE1-CD1 4.07Å; F64-L71 HydrophobicContact CE2-CD1 4.21Å; F64-L71 HydrophobicContact CE2-CD2 4.16Å; F64-L71 HydrophobicContact CZ-CD1 3.7Å; F64-L71 HydrophobicContact CZ-CD2 4.44Å; V68-L71 HydrophobicContact CG1-CB 4.33Å; L71-I73 HydrophobicContact CD1-CG1 4.29Å; L71-I73 HydrophobicContact CD2-CD1 4.14Å; L71-I73 HydrophobicContact CD2-CG1 4.46Å; L71-I73 HydrophobicContact CG-CD1 4.34Å; L71-I73 HydrophobicContact CG-CG1 4.13Å; L71-F89 HydrophobicContact CD2-CD1 3.81Å; L71-F89 HydrophobicContact CD2-CE1 3.49Å; L71-F89 VanDerWaalsContact CD2-CE1 3.49Å; L71-F89 HydrophobicContact CD2-CZ 4.36Å; L71-L92 HydrophobicContact CD2-CD1 3.96Å; L71-L96 HydrophobicContact CB-CD1 3.73Å; L71-N98 PolarHBondContact N-O 3.25Å; L71-L99 HydrophobicContact CB-CD1 4.14Å; L71-L99 HydrophobicContact CD2-CD1 4.07Å; L71-L99 HydrophobicContact CG-CD1 4.16Å; L71-L99 WeakPolarHBondContact O-CA 3.43Å; L71-T100 PolarHBondContact O-N 3.39Å
72	T	93.3	Very high	81.4	Confident	37 Å²	37	43.6 Å²	43.6	23%	0.227	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	125.7	174.5	-59.4	0	0	0	0	109.4	V48 T49 C50 T100	V48-T72 PolarHBondContact O-N 3.4Å; T49-T72 CarbonylContact C-O 3.12Å; T49-T72 WeakPolarHBondContact CA-O 3.49Å; T49-T72 HydrophobicContact CG2-CG2 4.15Å; C50-T72 PolarHBondContact N-O 3.31Å; T72-T100 CarbonylContact C-O 3.39Å; T72-T100 WeakPolarHBondContact CA-O 3.45Å; T72-T100 HydrophobicContact CG2-CG2 4.11Å
73	I	92.8	Very high	82.1	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	123.6	177.7	-57.8	173.2	0	0	0	108.5	W52 I55 L71 F89 T100 I101 S102	W52-I73 HydrophobicContact CE3-CG2 3.83Å; W52-I73 HydrophobicContact CZ3-CD1 4.21Å; W52-I73 HydrophobicContact CZ3-CG1 4.2Å; W52-I73 HydrophobicContact CZ3-CG2 4.12Å; I55-I73 HydrophobicContact CG1-CG2 4.24Å; L71-I73 HydrophobicContact CD1-CG1 4.29Å; L71-I73 HydrophobicContact CD2-CD1 4.14Å; L71-I73 HydrophobicContact CD2-CG1 4.46Å; L71-I73 HydrophobicContact CG-CD1 4.34Å; L71-I73 HydrophobicContact CG-CG1 4.13Å; I73-F89 HydrophobicContact CD1-CE1 3.88Å; I73-F89 HydrophobicContact CD1-CZ 3.78Å; I73-T100 PolarHBondContact N-O 3.2Å; I73-I101 HydrophobicContact CB-CG1 4.41Å; I73-I101 HydrophobicContact CD1-CG1 4.47Å; I73-I101 CarbonylContact O-C 3.59Å; I73-I101 WeakPolarHBondContact O-CA 3.36Å; I73-S102 PolarHBondContact O-N 2.87Å
74	Q	91.5	Very high	82.7	Confident	65 Å²	65	44 Å²	44	30%	0.304	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	124.6	175	-176.9	177.4	13.9	0	0	109.9	C50 K51 W52	C50-Q74 PolarHBondContact O-N 3.1Å; K51-Q74 WeakPolarHBondContact CA-O 3.41Å; K51-Q74 HydrophobicContact CG-CB 4.48Å; W52-Q74 PolarHBondContact N-O 3.49Å
75	C	90.5	Very high	82.7	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.007	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	134.5	172.5	-66.7	0	0	0	0	111.2	W52 S102 N103 C104	W52-C75 CarbonylContact O-C 3.59Å; W52-C75 WeakPolarHBondContact O-CA 3.43Å; C75-S102 PolarHBondContact N-O 3.19Å; C75-N103 HydrophobicContact CB-CB 4.36Å; C75-N103 WeakPolarHBondContact CB-O 3.42Å; C75-N103 VanDerWaalsContact O-CB 3.29Å; C75-N103 WeakPolarHBondContact O-CB 3.4Å; C75-C104 HydrophobicContact CB-CB 3.98Å; C75-C104 WeakPolarHBondContact CB-SG 3.26Å; C75-C104 PolarHBondContact N-SG 3.25Å; C75-C104 WeakPolarHBondContact SG-CA 3.47Å; C75-C104 WeakPolarHBondContact SG-CB 3.5Å; C75-C104 CovalentContact SG-SG 2.04Å; C75-C104 PolarHBondContact SG-SG 2.82Å
76	S	80.5	Confident	82.9	Confident	82 Å²	82	49.1 Å²	49.1	57%	0.573	28%	0.281	S	S	*	.	S	Bend	trans	-90	-21.7	-179.1	62.2	0	0	0	0	113.4	W52 E53	W52-S76 PolarHBondContact O-N 3.21Å; W52-S76 PolarHBondContact O-OG 3.44Å; E53-S76 WeakPolarHBondContact CA-OG 3.26Å
77	D	76.6	Confident	83	Confident	69 Å²	69	44.7 Å²	44.7	37%	0.369	26%	0.258	S	S	.	.			trans	-107.9	115.6	178.5	-178	-4.4	0	0	0	109.9	M79 A80	D77-M79 VanDerWaalsContact C-N 3.28Å; D77-M79 PolarHBondContact O-N 3.18Å; D77-M79 WeakPolarHBondContact OD1-CA 3.2Å; D77-M79 WeakPolarHBondContact OD1-CB 3.49Å; D77-M79 PolarHBondContact OD1-N 2.72Å; D77-A80 HydrophobicContact CB-CB 3.76Å; D77-A80 PolarHBondContact O-N 2.93Å; D77-A80 PolarHBondContact OD1-N 2.88Å; D77-A80 WeakPolarHBondContact OD2-CB 3.42Å
78	N	62.9	Low	82.9	Confident	108 Å²	108	42.8 Å²	42.8	58%	0.578	25%	0.248	S	C	*	.	S	Bend	trans	-74.6	-17.2	179.6	-69	-13.2	0	0	0	113.1
79	M	69.6	Low	82.6	Confident	141 Å²	141	43 Å²	43	70%	0.695	25%	0.249	S	C	*	.	S	Bend	trans	-88.5	-27.8	175.6	-62.3	-132	-167.4	0	0	112	D77 T81	D77-M79 VanDerWaalsContact C-N 3.28Å; D77-M79 PolarHBondContact O-N 3.18Å; D77-M79 WeakPolarHBondContact OD1-CA 3.2Å; D77-M79 WeakPolarHBondContact OD1-CB 3.49Å; D77-M79 PolarHBondContact OD1-N 2.72Å; M79-T81 PolarHBondContact O-N 3.08Å
80	A	76.7	Confident	81.8	Confident	18 Å²	18	45.6 Å²	45.6	15%	0.149	27%	0.265	C	S	.	.			trans	-67.1	126.8	-179.6	0	0	0	0	0	111.4	R54 D77	R54-A80 HydrophobicContact CB-CB 4.05Å; D77-A80 HydrophobicContact CB-CB 3.76Å; D77-A80 PolarHBondContact O-N 2.93Å; D77-A80 PolarHBondContact OD1-N 2.88Å; D77-A80 WeakPolarHBondContact OD2-CB 3.42Å
81	T	84	Confident	80.9	Confident	51 Å²	51	48.2 Å²	48.2	31%	0.313	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	145.8	176.6	55.5	0	0	0	0	112.2	M79 R105 A107	M79-T81 PolarHBondContact O-N 3.08Å; T81-R105 CarbonylContact C-O 3.33Å; T81-R105 WeakPolarHBondContact CA-O 3.42Å; T81-A107 VanDerWaalsContact CB-CA 3.5Å
82	S	87.5	Confident	80.2	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.007	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	142.4	-179.9	-64.4	0	0	0	0	110.1	I55 R105 P106 A107	I55-S82 PolarHBondContact N-OG 3.04Å; S82-R105 PolarHBondContact N-O 2.96Å; S82-P106 CarbonylContact O-C 3.34Å; S82-P106 WeakPolarHBondContact O-CA 3.49Å; S82-A107 PolarHBondContact O-N 3.21Å
83	H	84.8	Confident	78.9	Confident	119 Å²	119	52.8 Å²	52.8	55%	0.551	30%	0.296	S	S	*	.			trans	-93.5	127.3	176.4	-69.2	-71.1	0	0	0	110.2	M88	H83-M88 WeakPolarHBondContact O-CE 3.28Å
84	Y	85.2	Confident	77.7	Confident	14 Å²	14	55.1 Å²	55.1	6%	0.055	32%	0.32	C	S	.	.			trans	-107.3	126.8	177.3	-67.9	-88	0	0	0	110.2	I55 I101 C104 P106 P113 I116	I55-Y84 HydrophobicContact CD1-CD1 4.43Å; I55-Y84 HydrophobicContact CD1-CE1 3.63Å; Y84-I101 HydrophobicContact CE1-CD1 4.25Å; Y84-C104 VanDerWaalsContact OH-CB 3.3Å; Y84-C104 WeakPolarHBondContact OH-CB 3.28Å; Y84-C104 PolarHBondContact OH-O 3.06Å; Y84-P106 HydrophobicContact CD2-CB 3.75Å; Y84-P106 HydrophobicContact CE2-CB 3.8Å; Y84-P113 HydrophobicContact CD1-CB 3.83Å; Y84-P113 HydrophobicContact CD1-CG 4.46Å; Y84-P113 HydrophobicContact CD2-CB 4.31Å; Y84-P113 HydrophobicContact CD2-CG 4.06Å; Y84-P113 HydrophobicContact CE1-CB 3.71Å; Y84-P113 HydrophobicContact CE1-CG 4.31Å; Y84-P113 HydrophobicContact CE2-CB 4.21Å; Y84-P113 HydrophobicContact CE2-CG 3.9Å; Y84-P113 HydrophobicContact CG-CB 4.12Å; Y84-P113 HydrophobicContact CG-CG 4.33Å; Y84-I116 HydrophobicContact CD1-CG2 3.78Å
85	S	81.3	Confident	77.1	Confident	55 Å²	55	55.3 Å²	55.3	39%	0.385	32%	0.321	S	S	.	.			trans	-135.1	148.9	-179.9	68	0	0	0	0	112.6	G87 M88	S85-G87 PolarHBondContact O-N 3.27Å; S85-G87 VanDerWaalsContact O-N 3.15Å; S85-M88 PolarHBondContact O-N 2.91Å
86	S	75.2	Confident	76.9	Confident	74 Å²	74	55.6 Å²	55.6	52%	0.517	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	113.4	170.8	56.5	0	0	0	0	108.9
87	G	73.9	Confident	77.3	Confident	21 Å²	21	56 Å²	56	22%	0.216	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	103	5.4	-179.9	0	0	0	0	0	115.7	S85 F89 T90	S85-G87 PolarHBondContact O-N 3.27Å; S85-G87 VanDerWaalsContact O-N 3.15Å; G87-F89 PolarHBondContact O-N 3.06Å; G87-T90 VanDerWaalsContact CA-CG2 3.44Å; G87-T90 WeakPolarHBondContact O-CB 3.3Å; G87-T90 VanDerWaalsContact O-CG2 3.22Å; G87-T90 WeakPolarHBondContact O-CG2 3.38Å; G87-T90 PolarHBondContact O-N 2.95Å; G87-T90 PolarHBondContact O-OG1 2.76Å
88	M	78.3	Confident	78	Confident	12 Å²	12	55.2 Å²	55.2	6%	0.059	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	-32.8	173.8	173.9	173.5	-91.4	0	0	113.9	I55 L61 H83 S85	I55-M88 HydrophobicContact CG2-CE 3.7Å; I55-M88 HydrophobicContact CG2-SD 3.77Å; L61-M88 HydrophobicContact CD1-CE 4.16Å; L61-M88 HydrophobicContact CD1-CG 3.27Å; L61-M88 HydrophobicContact CD1-SD 3.85Å; H83-M88 WeakPolarHBondContact O-CE 3.28Å; S85-M88 PolarHBondContact O-N 2.91Å
89	F	79.2	Confident	79.5	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.018	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	29	179.1	-56.5	-72	0	0	0	112.7	L61 L71 I73 G87 S91 L92 L99 I101 I116 M120	L61-F89 HydrophobicContact CD1-CE1 4.47Å; L61-F89 HydrophobicContact CD2-CE1 4.35Å; L71-F89 HydrophobicContact CD2-CD1 3.81Å; L71-F89 HydrophobicContact CD2-CE1 3.49Å; L71-F89 VanDerWaalsContact CD2-CE1 3.49Å; L71-F89 HydrophobicContact CD2-CZ 4.36Å; I73-F89 HydrophobicContact CD1-CE1 3.88Å; I73-F89 HydrophobicContact CD1-CZ 3.78Å; G87-F89 PolarHBondContact O-N 3.06Å; F89-S91 PolarHBondContact O-N 3.27Å; F89-L92 HydrophobicContact CD1-CD1 4.31Å; F89-L92 PolarHBondContact O-N 3.11Å; F89-L99 HydrophobicContact CD2-CD2 4.36Å; F89-L99 HydrophobicContact CE2-CD1 4.48Å; F89-L99 HydrophobicContact CE2-CD2 4.1Å; F89-L99 HydrophobicContact CZ-CD1 4.27Å; F89-I101 HydrophobicContact CE2-CD1 4.44Å; F89-I101 HydrophobicContact CZ-CD1 4.33Å; F89-I116 HydrophobicContact CD2-CB 4.07Å; F89-I116 HydrophobicContact CE2-CB 3.95Å; F89-I116 HydrophobicContact CE2-CD1 4.09Å; F89-I116 HydrophobicContact CE2-CG1 4.39Å; F89-I116 HydrophobicContact CE2-CG2 4.13Å; F89-M120 HydrophobicContact CB-CE 3.34Å; F89-M120 HydrophobicContact CD2-CE 3.63Å; F89-M120 HydrophobicContact CG-CE 3.83Å
90	T	72.4	Confident	80.6	Confident	72 Å²	72	44.2 Å²	44.2	44%	0.442	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-59	-27.1	-180	42.8	0	0	0	0	113.8	G87 L92 R93	G87-T90 VanDerWaalsContact CA-CG2 3.44Å; G87-T90 WeakPolarHBondContact O-CB 3.3Å; G87-T90 VanDerWaalsContact O-CG2 3.22Å; G87-T90 WeakPolarHBondContact O-CG2 3.38Å; G87-T90 PolarHBondContact O-N 2.95Å; G87-T90 PolarHBondContact O-OG1 2.76Å; T90-L92 PolarHBondContact O-N 3.43Å; T90-R93 WeakPolarHBondContact O-CB 3.47Å; T90-R93 PolarHBondContact O-N 3.29Å
91	S	71.7	Confident	81.4	Confident	68 Å²	68	43.3 Å²	43.3	48%	0.476	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-62.3	-23.6	172.8	50.9	0	0	0	0	112.9	L61 F89	L61-S91 PolarHBondContact O-OG 2.89Å; F89-S91 PolarHBondContact O-N 3.27Å
92	L	76.5	Confident	81.8	Confident	6 Å²	6	41.8 Å²	41.8	3%	0.031	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-106.5	7	-175.4	-54.3	-179.5	0	0	0	113.4	F64 V68 L71 F89 T90 G94 Q95 L96	F64-L92 HydrophobicContact CB-CD2 4.29Å; F64-L92 HydrophobicContact CD2-CD1 4.22Å; V68-L92 HydrophobicContact CB-CD2 4Å; V68-L92 HydrophobicContact CG2-CD2 4.26Å; L71-L92 HydrophobicContact CD2-CD1 3.96Å; F89-L92 HydrophobicContact CD1-CD1 4.31Å; F89-L92 PolarHBondContact O-N 3.11Å; T90-L92 PolarHBondContact O-N 3.43Å; L92-G94 PolarHBondContact O-N 3.41Å; L92-Q95 PolarHBondContact O-N 3.42Å; L92-L96 HydrophobicContact CB-CB 4.33Å; L92-L96 HydrophobicContact CD1-CD2 4.48Å; L92-L96 PolarHBondContact O-N 3.06Å
93	R	65.2	Low	82	Confident	127 Å²	127	43.6 Å²	43.6	48%	0.479	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-5.7	-161.4	-166	172.9	178	-175.1	-2.1	117.3	T90 N119	T90-R93 WeakPolarHBondContact O-CB 3.47Å; T90-R93 PolarHBondContact O-N 3.29Å; R93-N119 WeakPolarHBondContact CG-O 3.15Å; R93-N119 VanDerWaalsContact NH2-CB 3.31Å; R93-N119 PolarHBondContact NH2-ND2 3.12Å; R93-N119 PolarHBondContact NH2-OD1 2.89Å
94	G	69.1	Low	82.3	Confident	49 Å²	49	38 Å²	38	51%	0.505	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.2	-11.2	179.3	0	0	0	0	0	116.3	L92 S122	L92-G94 PolarHBondContact O-N 3.41Å; G94-S122 PolarHBondContact O-OG 2.86Å
95	Q	77.1	Confident	82.4	Confident	70 Å²	70	44 Å²	44	33%	0.327	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.8	-22.4	-165.2	-66.6	168	-16.1	0	0	113.5	N67 V68 L92 W97	N67-Q95 VanDerWaalsContact OD1-CD 3.26Å; N67-Q95 PolarHBondContact OD1-NE2 3.31Å; N67-Q95 PolarHBondContact OD1-OE1 3.19Å; V68-Q95 CarbonylContact O-C 3.13Å; L92-Q95 PolarHBondContact O-N 3.42Å; Q95-W97 PolarHBondContact O-N 2.99Å
96	L	86.4	Confident	82.6	Confident	6 Å²	6	41.8 Å²	41.8	3%	0.031	23%	0.227	C	C	.	.			trans	-70.4	116.2	-177.6	-166.4	68.2	0	0	0	110.7	V68 L71 L92 N98 L99 M120 S122 L123	V68-L96 HydrophobicContact CG1-CD1 4.03Å; L71-L96 HydrophobicContact CB-CD1 3.73Å; L92-L96 HydrophobicContact CB-CB 4.33Å; L92-L96 HydrophobicContact CD1-CD2 4.48Å; L92-L96 PolarHBondContact O-N 3.06Å; L96-N98 WeakPolarHBondContact CD1-O 3.28Å; L96-L99 HydrophobicContact CD2-CB 4.1Å; L96-L99 HydrophobicContact CD2-CD1 4.25Å; L96-L99 HydrophobicContact CD2-CD2 4.45Å; L96-L99 HydrophobicContact CD2-CG 4.5Å; L96-M120 HydrophobicContact CD2-CE 4.38Å; L96-S122 CarbonylContact O-C 3.59Å; L96-L123 HydrophobicContact CD2-CD1 4.47Å; L96-L123 HydrophobicContact CG-CD1 4.37Å
97	W	89.6	Confident	83	Confident	90 Å²	90	39.6 Å²	39.6	34%	0.341	21%	0.214	S	C	.	.			trans	-99.8	-36.1	177.9	-71.4	15.5	0	0	0	111.2	T69 Q95 R124 Y125	T69-W97 PolarHBondContact O-N 3.19Å; Q95-W97 PolarHBondContact O-N 2.99Å; W97-R124 PolarHBondContact O-N 3.3Å; W97-Y125 PolarHBondContact O-N 2.84Å
98	N	92.1	Very high	82.9	Confident	54 Å²	54	43.3 Å²	43.3	29%	0.289	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	125.7	-177	-56.3	-17.1	0	0	0	110.5	T69 S70 L71 L96 Y125	T69-N98 PolarHBondContact O-N 3Å; S70-N98 CarbonylContact C-O 3.47Å; S70-N98 WeakPolarHBondContact CA-O 3.38Å; L71-N98 PolarHBondContact N-O 3.25Å; L96-N98 WeakPolarHBondContact CD1-O 3.28Å; N98-Y125 WeakPolarHBondContact CA-O 3.12Å; N98-Y125 HydrophobicContact CB-CD1 4.14Å; N98-Y125 VanDerWaalsContact OD1-CB 3.32Å; N98-Y125 WeakPolarHBondContact OD1-CB 3.3Å
99	L	92.8	Very high	82.2	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	123.2	173.8	179.2	59.6	0	0	0	110.2	L71 F89 L96 I101 I116 L123 Y125 L126 Q127	L71-L99 HydrophobicContact CB-CD1 4.14Å; L71-L99 HydrophobicContact CD2-CD1 4.07Å; L71-L99 HydrophobicContact CG-CD1 4.16Å; L71-L99 WeakPolarHBondContact O-CA 3.43Å; F89-L99 HydrophobicContact CD2-CD2 4.36Å; F89-L99 HydrophobicContact CE2-CD1 4.48Å; F89-L99 HydrophobicContact CE2-CD2 4.1Å; F89-L99 HydrophobicContact CZ-CD1 4.27Å; L96-L99 HydrophobicContact CD2-CB 4.1Å; L96-L99 HydrophobicContact CD2-CD1 4.25Å; L96-L99 HydrophobicContact CD2-CD2 4.45Å; L96-L99 HydrophobicContact CD2-CG 4.5Å; L99-I101 HydrophobicContact CD1-CD1 4.46Å; L99-I101 HydrophobicContact CD1-CG1 4.21Å; L99-I101 HydrophobicContact CG-CG1 4.4Å; L99-I116 HydrophobicContact CD2-CD1 3.8Å; L99-I116 HydrophobicContact CD2-CG1 4.26Å; L99-L123 HydrophobicContact CB-CD1 3.88Å; L99-Y125 PolarHBondContact N-O 3.31Å; L99-L126 HydrophobicContact CB-CD1 4.19Å; L99-L126 HydrophobicContact CD2-CD1 4.12Å; L99-L126 HydrophobicContact CG-CD1 4.23Å; L99-L126 WeakPolarHBondContact O-CA 3.24Å; L99-Q127 PolarHBondContact O-N 3.27Å
100	T	94.4	Very high	81.4	Confident	17 Å²	17	51.1 Å²	51.1	10%	0.104	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	128	175.6	-59.7	0	0	0	0	109.8	L71 T72 I73 Q127	L71-T100 PolarHBondContact O-N 3.39Å; T72-T100 CarbonylContact C-O 3.39Å; T72-T100 WeakPolarHBondContact CA-O 3.45Å; T72-T100 HydrophobicContact CG2-CG2 4.11Å; I73-T100 PolarHBondContact N-O 3.2Å; T100-Q127 CarbonylContact C-O 3.42Å; T100-Q127 WeakPolarHBondContact CA-O 3.36Å; T100-Q127 HydrophobicContact CG2-CB 4.05Å; T100-Q127 HydrophobicContact CG2-CG 3.92Å
101	I	93.5	Very high	81.1	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	124.9	173.1	-55.2	-177.4	0	0	0	108.6	I55 I73 Y84 F89 L99 C104 I116 Q127 L128 D129 L131	I55-I101 HydrophobicContact CD1-CD1 4.47Å; I55-I101 HydrophobicContact CD1-CG2 4.2Å; I73-I101 HydrophobicContact CB-CG1 4.41Å; I73-I101 HydrophobicContact CD1-CG1 4.47Å; I73-I101 CarbonylContact O-C 3.59Å; I73-I101 WeakPolarHBondContact O-CA 3.36Å; Y84-I101 HydrophobicContact CE1-CD1 4.25Å; F89-I101 HydrophobicContact CE2-CD1 4.44Å; F89-I101 HydrophobicContact CZ-CD1 4.33Å; L99-I101 HydrophobicContact CD1-CD1 4.46Å; L99-I101 HydrophobicContact CD1-CG1 4.21Å; L99-I101 HydrophobicContact CG-CG1 4.4Å; I101-C104 HydrophobicContact CG2-CB 3.81Å; I101-I116 HydrophobicContact CD1-CD1 3.49Å; I101-I116 VanDerWaalsContact CD1-CD1 3.49Å; I101-Q127 PolarHBondContact N-O 3.01Å; I101-L128 HydrophobicContact CB-CD2 3.94Å; I101-L128 HydrophobicContact CD1-CD2 4.18Å; I101-L128 HydrophobicContact CG1-CD2 4.19Å; I101-D129 PolarHBondContact O-N 2.95Å; I101-L131 HydrophobicContact CG2-CD2 4.07Å
102	S	92.6	Very high	81.4	Confident	19 Å²	19	47.2 Å²	47.2	13%	0.133	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	145.8	178.8	60.1	0	0	0	0	113.5	I73 C75 C104 D129	I73-S102 PolarHBondContact O-N 2.87Å; C75-S102 PolarHBondContact N-O 3.19Å; S102-C104 PolarHBondContact O-N 3.33Å; S102-C104 PolarHBondContact O-SG 2.91Å; S102-D129 VanDerWaalsContact CA-O 3.28Å; S102-D129 WeakPolarHBondContact CA-O 3.24Å
103	N	91.2	Very high	81.7	Confident	39 Å²	39	46.9 Å²	46.9	21%	0.209	26%	0.259	C	S	.	.	S	Bend	trans	60.2	11.1	177.8	-64.3	-1.9	0	0	0	115.6	C75 R105 D129 H130	C75-N103 HydrophobicContact CB-CB 4.36Å; C75-N103 WeakPolarHBondContact CB-O 3.42Å; C75-N103 VanDerWaalsContact O-CB 3.29Å; C75-N103 WeakPolarHBondContact O-CB 3.4Å; N103-R105 PolarHBondContact O-N 3.28Å; N103-D129 PolarHBondContact N-O 2.99Å; N103-H130 WeakPolarHBondContact CA-O 3.48Å; N103-H130 WeakPolarHBondContact OD1-CB 3.28Å
104	C	90.3	Very high	82.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.238	C	C	.	.			trans	-95.2	90.7	-177.4	-60.8	0	0	0	0	110.3	I55 C75 Y84 I101 S102 L131	I55-C104 HydrophobicContact CD1-CB 4.01Å; I55-C104 HydrophobicContact CG1-CB 4.01Å; C75-C104 HydrophobicContact CB-CB 3.98Å; C75-C104 WeakPolarHBondContact CB-SG 3.26Å; C75-C104 PolarHBondContact N-SG 3.25Å; C75-C104 WeakPolarHBondContact SG-CA 3.47Å; C75-C104 WeakPolarHBondContact SG-CB 3.5Å; C75-C104 CovalentContact SG-SG 2.04Å; C75-C104 PolarHBondContact SG-SG 2.82Å; Y84-C104 VanDerWaalsContact OH-CB 3.3Å; Y84-C104 WeakPolarHBondContact OH-CB 3.28Å; Y84-C104 PolarHBondContact OH-O 3.06Å; I101-C104 HydrophobicContact CG2-CB 3.81Å; S102-C104 PolarHBondContact O-N 3.33Å; S102-C104 PolarHBondContact O-SG 2.91Å; C104-L131 HydrophobicContact CB-CD2 4.21Å; C104-L131 WeakPolarHBondContact O-CD2 3.28Å
105	R	87.8	Confident	83.1	Confident	140 Å²	140	40.4 Å²	40.4	53%	0.528	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	136.2	-177.5	-171	178.6	177.6	167.7	0.2	111.4	T81 S82 N103	T81-R105 CarbonylContact C-O 3.33Å; T81-R105 WeakPolarHBondContact CA-O 3.42Å; S82-R105 PolarHBondContact N-O 2.96Å; N103-R105 PolarHBondContact O-N 3.28Å
106	P	86.3	Confident	83.3	Confident	10 Å²	10	37.1 Å²	37.1	7%	0.065	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	146.5	173.5	23.5	-25.6	0	0	0	111.8	S82 Y84 P113 L131 W134	S82-P106 CarbonylContact O-C 3.34Å; S82-P106 WeakPolarHBondContact O-CA 3.49Å; Y84-P106 HydrophobicContact CD2-CB 3.75Å; Y84-P106 HydrophobicContact CE2-CB 3.8Å; P106-P113 HydrophobicContact CB-CG 4.39Å; P106-P113 HydrophobicContact CG-CG 4.18Å; P106-L131 WeakPolarHBondContact CD-O 3.46Å; P106-W134 HydrophobicContact CG-CB 3.49Å; P106-W134 VanDerWaalsContact CG-CB 3.49Å; P106-W134 HydrophobicContact CG-CG 4.33Å
107	A	82.1	Confident	83	Confident	28 Å²	28	37 Å²	37	23%	0.231	21%	0.207	C	C	.	.	S	Bend	trans	-64	-42.4	177.1	0	0	0	0	0	113.3	T81 S82	T81-A107 VanDerWaalsContact CB-CA 3.5Å; S82-A107 PolarHBondContact O-N 3.21Å
108	D	72.9	Confident	82.3	Confident	98 Å²	98	37.5 Å²	37.5	52%	0.524	21%	0.209	S	C	.	.	S	Bend	trans	-128.8	142.7	-179.5	-66.5	-43.1	0	0	0	110.8	S110 S111	D108-S110 WeakPolarHBondContact CB-OG 3.48Å; D108-S110 PolarHBondContact O-N 3.49Å; D108-S111 PolarHBondContact O-N 2.74Å; D108-S111 PolarHBondContact O-OG 3.35Å
109	S	63.9	Low	81.3	Confident	78 Å²	78	38.9 Å²	38.9	55%	0.545	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-14	173.6	63.8	0	0	0	0	114.1
110	S	61.4	Low	80.7	Confident	103 Å²	103	39.5 Å²	39.5	72%	0.72	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82	-22.6	174.3	54.3	0	0	0	0	113.3	D108 S112	D108-S110 WeakPolarHBondContact CB-OG 3.48Å; D108-S110 PolarHBondContact O-N 3.49Å; S110-S112 PolarHBondContact O-N 3.01Å
111	S	66.5	Low	80.1	Confident	24 Å²	24	42.7 Å²	42.7	17%	0.168	24%	0.241	C	C	.	.	S	Bend	trans	-91.8	82.2	-179.9	62.3	0	0	0	0	110.9	D108 P113	D108-S111 PolarHBondContact O-N 2.74Å; D108-S111 PolarHBondContact O-OG 3.35Å; S111-P113 WeakPolarHBondContact O-CD 3.38Å
112	S	77.2	Confident	79.7	Confident	33 Å²	33	44.6 Å²	44.6	23%	0.231	25%	0.254	C	S	.	.			trans	-58.7	125	174.9	176.9	0	0	0	0	110.2	S110 V114 V115 W134	S110-S112 PolarHBondContact O-N 3.01Å; S112-V114 PolarHBondContact O-N 3.21Å; S112-V114 PolarHBondContact OG-N 2.99Å; S112-V115 VanDerWaalsContact O-CB 3.27Å; S112-V115 WeakPolarHBondContact O-CB 3.38Å; S112-V115 WeakPolarHBondContact O-CG1 3.32Å; S112-V115 PolarHBondContact O-N 3.13Å; S112-W134 WeakPolarHBondContact OG-CZ3 3.3Å
113	P	84.5	Confident	79.6	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-53.8	-26.2	173.4	-28.8	37.1	0	0	0	113.5	Y84 P106 S111 V115 I116 L128 L131 W134	Y84-P113 HydrophobicContact CD1-CB 3.83Å; Y84-P113 HydrophobicContact CD1-CG 4.46Å; Y84-P113 HydrophobicContact CD2-CB 4.31Å; Y84-P113 HydrophobicContact CD2-CG 4.06Å; Y84-P113 HydrophobicContact CE1-CB 3.71Å; Y84-P113 HydrophobicContact CE1-CG 4.31Å; Y84-P113 HydrophobicContact CE2-CB 4.21Å; Y84-P113 HydrophobicContact CE2-CG 3.9Å; Y84-P113 HydrophobicContact CG-CB 4.12Å; Y84-P113 HydrophobicContact CG-CG 4.33Å; P106-P113 HydrophobicContact CB-CG 4.39Å; P106-P113 HydrophobicContact CG-CG 4.18Å; S111-P113 WeakPolarHBondContact O-CD 3.38Å; P113-V115 PolarHBondContact O-N 2.97Å; P113-I116 VanDerWaalsContact O-CD1 3.3Å; P113-I116 WeakPolarHBondContact O-CD1 3.23Å; P113-I116 WeakPolarHBondContact O-CG1 3.16Å; P113-I116 WeakPolarHBondContact O-CG2 3.36Å; P113-I116 PolarHBondContact O-N 3.01Å; P113-L128 HydrophobicContact CB-CD1 4.46Å; P113-L131 HydrophobicContact CB-CD1 3.75Å; P113-L131 HydrophobicContact CG-CD1 3.83Å; P113-W134 VanDerWaalsContact CD-CD2 3.43Å; P113-W134 VanDerWaalsContact CD-CE3 3.46Å; P113-W134 HydrophobicContact CG-CB 4.4Å; P113-W134 HydrophobicContact CG-CD2 3.96Å; P113-W134 HydrophobicContact CG-CE3 4.43Å; P113-W134 HydrophobicContact CG-CG 3.93Å
114	V	81.4	Confident	79.6	Confident	7 Å²	7	47 Å²	47	4%	0.042	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-64.6	-19.5	178.2	-176.7	0	0	0	0	112.3	S112 I116 T117 L128 W134 L144 L145	S112-V114 PolarHBondContact O-N 3.21Å; S112-V114 PolarHBondContact OG-N 2.99Å; V114-I116 PolarHBondContact O-N 3.34Å; V114-T117 HydrophobicContact CG1-CG2 4.47Å; V114-T117 WeakPolarHBondContact O-CB 3.33Å; V114-T117 PolarHBondContact O-N 3.26Å; V114-T117 PolarHBondContact O-OG1 2.85Å; V114-L128 HydrophobicContact CG2-CD1 3.91Å; V114-W134 HydrophobicContact CG2-CH2 3.44Å; V114-W134 VanDerWaalsContact CG2-CH2 3.44Å; V114-W134 HydrophobicContact CG2-CZ2 4.34Å; V114-W134 HydrophobicContact CG2-CZ3 3.83Å; V114-L144 HydrophobicContact CB-CD2 3.73Å; V114-L144 HydrophobicContact CG1-CD2 3.65Å; V114-L144 HydrophobicContact CG2-CD2 3.7Å; V114-L145 HydrophobicContact CG1-CD2 3.76Å; V114-L145 HydrophobicContact CG1-CG 3.69Å
115	V	81.9	Confident	79.8	Confident	32 Å²	32	49.2 Å²	49.2	19%	0.194	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-55.4	-25.4	177.5	78	0	0	0	0	113.2	S112 P113 T117 R118	S112-V115 VanDerWaalsContact O-CB 3.27Å; S112-V115 WeakPolarHBondContact O-CB 3.38Å; S112-V115 WeakPolarHBondContact O-CG1 3.32Å; S112-V115 PolarHBondContact O-N 3.13Å; P113-V115 PolarHBondContact O-N 2.97Å; V115-T117 PolarHBondContact O-N 3.27Å; V115-R118 PolarHBondContact O-N 3.14Å
116	I	81.5	Confident	80.1	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.01	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-63.1	-22.9	177.5	69.7	-167.3	0	0	0	113.2	Y84 F89 L99 I101 P113 V114 R118 M120 L128	Y84-I116 HydrophobicContact CD1-CG2 3.78Å; F89-I116 HydrophobicContact CD2-CB 4.07Å; F89-I116 HydrophobicContact CE2-CB 3.95Å; F89-I116 HydrophobicContact CE2-CD1 4.09Å; F89-I116 HydrophobicContact CE2-CG1 4.39Å; F89-I116 HydrophobicContact CE2-CG2 4.13Å; L99-I116 HydrophobicContact CD2-CD1 3.8Å; L99-I116 HydrophobicContact CD2-CG1 4.26Å; I101-I116 HydrophobicContact CD1-CD1 3.49Å; I101-I116 VanDerWaalsContact CD1-CD1 3.49Å; P113-I116 VanDerWaalsContact O-CD1 3.3Å; P113-I116 WeakPolarHBondContact O-CD1 3.23Å; P113-I116 WeakPolarHBondContact O-CG1 3.16Å; P113-I116 WeakPolarHBondContact O-CG2 3.36Å; P113-I116 PolarHBondContact O-N 3.01Å; V114-I116 PolarHBondContact O-N 3.34Å; I116-R118 VanDerWaalsContact C-N 3.34Å; I116-M120 VanDerWaalsContact O-CE 3.31Å; I116-M120 WeakPolarHBondContact O-CE 3.26Å; I116-L128 HydrophobicContact CD1-CD2 4.22Å
117	T	78.4	Confident	80.4	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.018	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-82.1	-12.6	-176.7	64.7	0	0	0	0	113.2	V114 V115 N119 M120 L123 L126 L145	V114-T117 HydrophobicContact CG1-CG2 4.47Å; V114-T117 WeakPolarHBondContact O-CB 3.33Å; V114-T117 PolarHBondContact O-N 3.26Å; V114-T117 PolarHBondContact O-OG1 2.85Å; V115-T117 PolarHBondContact O-N 3.27Å; T117-N119 PolarHBondContact O-N 2.98Å; T117-M120 WeakPolarHBondContact O-CB 3.28Å; T117-M120 PolarHBondContact O-N 2.95Å; T117-M120 VanDerWaalsContact O-N 3.08Å; T117-L123 HydrophobicContact CG2-CD2 4.3Å; T117-L126 HydrophobicContact CG2-CD1 4.26Å; T117-L126 HydrophobicContact CG2-CD2 3.59Å; T117-L145 HydrophobicContact CG2-CD2 3.79Å
118	R	76.3	Confident	81	Confident	101 Å²	101	42.9 Å²	42.9	38%	0.381	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	131.8	176.4	-75.9	-170.2	177.7	-176.1	1.9	110.1	V115 I116 M120	V115-R118 PolarHBondContact O-N 3.14Å; I116-R118 VanDerWaalsContact C-N 3.34Å; R118-M120 VanDerWaalsContact C-N 3.34Å; R118-M120 PolarHBondContact O-N 2.82Å
119	N	71.1	Confident	81.7	Confident	83 Å²	83	39 Å²	39	44%	0.444	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	31.2	-175.1	-58.5	-70.2	0	0	0	116.3	R93 T117 P121 D147	R93-N119 WeakPolarHBondContact CG-O 3.15Å; R93-N119 VanDerWaalsContact NH2-CB 3.31Å; R93-N119 PolarHBondContact NH2-ND2 3.12Å; R93-N119 PolarHBondContact NH2-OD1 2.89Å; T117-N119 PolarHBondContact O-N 2.98Å; N119-P121 VanDerWaalsContact C-CD 3.41Å; N119-P121 WeakPolarHBondContact O-CD 3.25Å; N119-D147 PolarHBondContact N-OD2 3.22Å
120	M	80.3	Confident	82.9	Confident	12 Å²	12	39.4 Å²	39.4	6%	0.059	21%	0.209	C	C	.	.			trans	-107.3	77.1	169.3	-68.3	-172	171.5	0	0	112.3	F89 L96 I116 T117 R118 S122 L123	F89-M120 HydrophobicContact CB-CE 3.34Å; F89-M120 HydrophobicContact CD2-CE 3.63Å; F89-M120 HydrophobicContact CG-CE 3.83Å; L96-M120 HydrophobicContact CD2-CE 4.38Å; I116-M120 VanDerWaalsContact O-CE 3.31Å; I116-M120 WeakPolarHBondContact O-CE 3.26Å; T117-M120 WeakPolarHBondContact O-CB 3.28Å; T117-M120 PolarHBondContact O-N 2.95Å; T117-M120 VanDerWaalsContact O-N 3.08Å; R118-M120 VanDerWaalsContact C-N 3.34Å; R118-M120 PolarHBondContact O-N 2.82Å; M120-S122 VanDerWaalsContact C-N 3.29Å; M120-S122 PolarHBondContact O-N 2.8Å; M120-L123 HydrophobicContact CB-CB 4.21Å; M120-L123 PolarHBondContact O-N 2.95Å; M120-L123 HydrophobicContact SD-CD2 4.31Å
121	P	80.9	Confident	84.2	Confident	85 Å²	85	34.5 Å²	34.5	55%	0.552	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-20.6	-175.5	29.3	-36.2	0	0	0	114	N119	N119-P121 VanDerWaalsContact C-CD 3.41Å; N119-P121 WeakPolarHBondContact O-CD 3.25Å
122	S	86	Confident	84.9	Confident	39 Å²	39	34.8 Å²	34.8	27%	0.273	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-8.8	-178	-58.5	0	0	0	0	114.3	G94 L96 M120 R124	G94-S122 PolarHBondContact O-OG 2.86Å; L96-S122 CarbonylContact O-C 3.59Å; M120-S122 VanDerWaalsContact C-N 3.29Å; M120-S122 PolarHBondContact O-N 2.8Å; S122-R124 PolarHBondContact O-N 3.35Å
123	L	89.3	Confident	84.8	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.005	20%	0.198	C	C	.	.			trans	-70.7	125.6	-172.1	-164.6	74	0	0	0	110.8	L96 L99 T117 M120 L126 L151	L96-L123 HydrophobicContact CD2-CD1 4.47Å; L96-L123 HydrophobicContact CG-CD1 4.37Å; L99-L123 HydrophobicContact CB-CD1 3.88Å; T117-L123 HydrophobicContact CG2-CD2 4.3Å; M120-L123 HydrophobicContact CB-CB 4.21Å; M120-L123 PolarHBondContact O-N 2.95Å; M120-L123 HydrophobicContact SD-CD2 4.31Å; L123-L126 HydrophobicContact CD2-CB 4.06Å; L123-L126 HydrophobicContact CD2-CD1 4.2Å; L123-L126 HydrophobicContact CD2-CG 4.5Å; L123-L151 HydrophobicContact CD2-CD1 4.11Å; L123-L151 HydrophobicContact CG-CD1 4.07Å
124	R	91.7	Very high	84.4	Confident	107 Å²	107	39.7 Å²	39.7	40%	0.404	20%	0.2	S	C	.	.			trans	-114.5	-29.7	-179.1	-64.4	-173.2	-178	-139.7	7.4	113.3	W97 S122 E152 R153	W97-R124 PolarHBondContact O-N 3.3Å; S122-R124 PolarHBondContact O-N 3.35Å; R124-E152 IonicContact CZ-OE1 2.69Å; R124-E152 IonicContact NE-OE1 3.97Å; R124-E152 IonicContact NH1-OE1 3.88Å; R124-E152 PolarHBondContact NH1-OE1 2.9Å; R124-E152 PolarHBondContact O-N 3.05Å; R124-R153 PolarHBondContact O-N 2.98Å
125	Y	94.3	Very high	83.8	Confident	48 Å²	48	41.1 Å²	41.1	19%	0.188	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	122.7	177.2	-179.1	-100.4	0	0	0	110.3	W97 N98 L99 Q127 R153 V155	W97-Y125 PolarHBondContact O-N 2.84Å; N98-Y125 WeakPolarHBondContact CA-O 3.12Å; N98-Y125 HydrophobicContact CB-CD1 4.14Å; N98-Y125 VanDerWaalsContact OD1-CB 3.32Å; N98-Y125 WeakPolarHBondContact OD1-CB 3.3Å; L99-Y125 PolarHBondContact N-O 3.31Å; Y125-Q127 HydrophobicContact CE1-CB 3.75Å; Y125-Q127 PolarHBondContact OH-OE1 3.03Å; Y125-R153 WeakPolarHBondContact CA-O 3.27Å; Y125-R153 HydrophobicContact CD2-CB 3.41Å; Y125-R153 VanDerWaalsContact CD2-CB 3.41Å; Y125-R153 HydrophobicContact CD2-CG 4.15Å; Y125-R153 HydrophobicContact CE2-CB 4.05Å; Y125-R153 HydrophobicContact CG-CB 4.39Å; Y125-V155 HydrophobicContact CE2-CG2 4.13Å
126	L	93.5	Very high	83	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	123.4	173.7	178.9	64.4	0	0	0	109.9	L99 T117 L123 L128 L145 L151 R153 L154 V155	L99-L126 HydrophobicContact CB-CD1 4.19Å; L99-L126 HydrophobicContact CD2-CD1 4.12Å; L99-L126 HydrophobicContact CG-CD1 4.23Å; L99-L126 WeakPolarHBondContact O-CA 3.24Å; T117-L126 HydrophobicContact CG2-CD1 4.26Å; T117-L126 HydrophobicContact CG2-CD2 3.59Å; L123-L126 HydrophobicContact CD2-CB 4.06Å; L123-L126 HydrophobicContact CD2-CD1 4.2Å; L123-L126 HydrophobicContact CD2-CG 4.5Å; L126-L128 HydrophobicContact CD1-CD1 4.47Å; L126-L128 HydrophobicContact CD1-CD2 4.05Å; L126-L128 HydrophobicContact CD1-CG 4.05Å; L126-L128 HydrophobicContact CD2-CD1 4.31Å; L126-L128 HydrophobicContact CG-CD1 4.47Å; L126-L128 HydrophobicContact CG-CG 4.17Å; L126-L145 HydrophobicContact CD2-CD2 3.73Å; L126-L151 HydrophobicContact CB-CD1 3.82Å; L126-L151 HydrophobicContact CB-CD2 4.26Å; L126-R153 PolarHBondContact N-O 2.99Å; L126-L154 HydrophobicContact CB-CD1 4.17Å; L126-L154 HydrophobicContact CD2-CD1 3.91Å; L126-L154 HydrophobicContact CG-CD1 4.19Å; L126-L154 CarbonylContact O-C 3.49Å; L126-L154 WeakPolarHBondContact O-CA 3.17Å; L126-V155 PolarHBondContact O-N 2.95Å
127	Q	94.6	Very high	81.9	Confident	44 Å²	44	50 Å²	50	21%	0.206	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	120.9	172.5	174.7	175.6	-14.5	0	0	110.6	L99 T100 I101 Y125 D129 V155	L99-Q127 PolarHBondContact O-N 3.27Å; T100-Q127 CarbonylContact C-O 3.42Å; T100-Q127 WeakPolarHBondContact CA-O 3.36Å; T100-Q127 HydrophobicContact CG2-CB 4.05Å; T100-Q127 HydrophobicContact CG2-CG 3.92Å; I101-Q127 PolarHBondContact N-O 3.01Å; Y125-Q127 HydrophobicContact CE1-CB 3.75Å; Y125-Q127 PolarHBondContact OH-OE1 3.03Å; Q127-D129 HydrophobicContact CG-CB 4.35Å; Q127-V155 WeakPolarHBondContact CA-O 3.47Å; Q127-V155 HydrophobicContact CB-CB 3.92Å; Q127-V155 HydrophobicContact CB-CG1 4.5Å; Q127-V155 HydrophobicContact CB-CG2 4.42Å; Q127-V155 HydrophobicContact CG-CB 3.84Å; Q127-V155 HydrophobicContact CG-CG1 3.86Å
128	L	92.6	Very high	80.8	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	106.2	175.9	-60.6	179.2	0	0	0	107.9	I101 P113 V114 I116 L126 L131 V155 L156 N159	I101-L128 HydrophobicContact CB-CD2 3.94Å; I101-L128 HydrophobicContact CD1-CD2 4.18Å; I101-L128 HydrophobicContact CG1-CD2 4.19Å; P113-L128 HydrophobicContact CB-CD1 4.46Å; V114-L128 HydrophobicContact CG2-CD1 3.91Å; I116-L128 HydrophobicContact CD1-CD2 4.22Å; L126-L128 HydrophobicContact CD1-CD1 4.47Å; L126-L128 HydrophobicContact CD1-CD2 4.05Å; L126-L128 HydrophobicContact CD1-CG 4.05Å; L126-L128 HydrophobicContact CD2-CD1 4.31Å; L126-L128 HydrophobicContact CG-CD1 4.47Å; L126-L128 HydrophobicContact CG-CG 4.17Å; L128-L131 HydrophobicContact CB-CD1 3.79Å; L128-L131 HydrophobicContact CD2-CD1 4.24Å; L128-L131 HydrophobicContact CG-CD1 4.46Å; L128-V155 PolarHBondContact N-O 3Å; L128-L156 HydrophobicContact CB-CD2 3.91Å; L128-L156 HydrophobicContact CD1-CD2 4.06Å; L128-L156 HydrophobicContact CG-CD2 4.31Å; L128-L156 WeakPolarHBondContact O-CA 3.41Å; L128-N159 PolarHBondContact O-ND2 3Å
129	D	89.5	Confident	79.4	Confident	16 Å²	16	57.7 Å²	57.7	9%	0.086	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	143.8	-167.4	-174.1	32	0	0	0	112	I101 S102 N103 Q127 L131 S157 S158	I101-D129 PolarHBondContact O-N 2.95Å; S102-D129 VanDerWaalsContact CA-O 3.28Å; S102-D129 WeakPolarHBondContact CA-O 3.24Å; N103-D129 PolarHBondContact N-O 2.99Å; Q127-D129 HydrophobicContact CG-CB 4.35Å; D129-L131 VanDerWaalsContact C-N 3.26Å; D129-L131 VanDerWaalsContact O-CD2 3.29Å; D129-L131 WeakPolarHBondContact O-CD2 3.23Å; D129-L131 PolarHBondContact O-N 3.08Å; D129-S157 WeakPolarHBondContact CA-O 3.18Å; D129-S157 VanDerWaalsContact OD1-C 3.26Å; D129-S157 WeakPolarHBondContact OD1-CB 3.45Å; D129-S157 PolarHBondContact OD1-OG 3.07Å; D129-S158 WeakPolarHBondContact OD1-CB 3.28Å
130	H	88.8	Confident	78.5	Confident	87 Å²	87	58.3 Å²	58.3	40%	0.403	30%	0.303	S	S	.	.	S	Bend	trans	52.9	37.4	179	-61.9	90.2	0	0	0	114.3	N103 G132 S157 S158	N103-H130 WeakPolarHBondContact CA-O 3.48Å; N103-H130 WeakPolarHBondContact OD1-CB 3.28Å; H130-G132 VanDerWaalsContact C-N 3.32Å; H130-S157 PolarHBondContact N-O 2.98Å; H130-S158 WeakPolarHBondContact CA-O 3.43Å; H130-S158 VanDerWaalsContact CD2-CB 3.5Å; H130-S158 WeakPolarHBondContact CD2-CB 3.47Å; H130-S158 PolarHBondContact CE1-OG 3.17Å; H130-S158 PolarHBondContact NE2-OG 2.74Å
131	L	87.2	Confident	77.2	Confident	1 Å²	1	61 Å²	61	1%	0.005	32%	0.318	C	S	.	.			trans	-89.8	2.6	-179.5	-49.6	-176.3	0	0	0	112.9	I101 C104 P106 P113 L128 D129 N159	I101-L131 HydrophobicContact CG2-CD2 4.07Å; C104-L131 HydrophobicContact CB-CD2 4.21Å; C104-L131 WeakPolarHBondContact O-CD2 3.28Å; P106-L131 WeakPolarHBondContact CD-O 3.46Å; P113-L131 HydrophobicContact CB-CD1 3.75Å; P113-L131 HydrophobicContact CG-CD1 3.83Å; L128-L131 HydrophobicContact CB-CD1 3.79Å; L128-L131 HydrophobicContact CD2-CD1 4.24Å; L128-L131 HydrophobicContact CG-CD1 4.46Å; D129-L131 VanDerWaalsContact C-N 3.26Å; D129-L131 VanDerWaalsContact O-CD2 3.29Å; D129-L131 WeakPolarHBondContact O-CD2 3.23Å; D129-L131 PolarHBondContact O-N 3.08Å; L131-N159 WeakPolarHBondContact CB-OD1 3.45Å; L131-N159 PolarHBondContact N-OD1 3.29Å
132	G	81.8	Confident	75.6	Confident	29 Å²	29	60 Å²	60	30%	0.299	31%	0.313	S	S	.	.			trans	76.2	-171	-176.3	0	0	0	0	0	113.7	H130 W134 N159	H130-G132 VanDerWaalsContact C-N 3.32Å; G132-W134 PolarHBondContact O-N 2.75Å; G132-W134 VanDerWaalsContact O-N 3.09Å; G132-N159 CarbonylContact O-C 3.36Å; G132-N159 VanDerWaalsContact O-O 3.04Å
133	E	76.2	Confident	74	Confident	127 Å²	127	62.1 Å²	62.1	59%	0.593	32%	0.321	S	S	*	.	S	Bend	trans	-76.2	94	176.7	-68.4	-177.2	-169.1	0	0	110.6	R182	E133-R182 IonicContact OE1-CZ 3.72Å; E133-R182 IonicContact OE1-NH1 3.95Å; E133-R182 PolarHBondContact OE1-NH1 3.41Å; E133-R182 IonicContact OE1-NH2 3.85Å; E133-R182 PolarHBondContact OE1-NH2 2.8Å
134	W	74.8	Confident	72.5	Confident	9 Å²	9	64.1 Å²	64.1	3%	0.034	33%	0.331	C	S	.	.			trans	-113.3	-11.9	177.5	58.4	-99.3	0	0	0	113.9	P106 S112 P113 V114 G132 N159	P106-W134 HydrophobicContact CG-CB 3.49Å; P106-W134 VanDerWaalsContact CG-CB 3.49Å; P106-W134 HydrophobicContact CG-CG 4.33Å; S112-W134 WeakPolarHBondContact OG-CZ3 3.3Å; P113-W134 VanDerWaalsContact CD-CD2 3.43Å; P113-W134 VanDerWaalsContact CD-CE3 3.46Å; P113-W134 HydrophobicContact CG-CB 4.4Å; P113-W134 HydrophobicContact CG-CD2 3.96Å; P113-W134 HydrophobicContact CG-CE3 4.43Å; P113-W134 HydrophobicContact CG-CG 3.93Å; V114-W134 HydrophobicContact CG2-CH2 3.44Å; V114-W134 VanDerWaalsContact CG2-CH2 3.44Å; V114-W134 HydrophobicContact CG2-CZ2 4.34Å; V114-W134 HydrophobicContact CG2-CZ3 3.83Å; G132-W134 PolarHBondContact O-N 2.75Å; G132-W134 VanDerWaalsContact O-N 3.09Å; W134-N159 PolarHBondContact NE1-OD1 3.26Å
135	W	69.7	Low	71.4	Confident	38 Å²	38	59.5 Å²	59.5	14%	0.144	32%	0.315	C	S	.	.			trans	-106.5	122.9	-177.2	-176.3	66.2	0	0	0	111.3	P137 L161 K163	W135-P137 HydrophobicContact CH2-CB 3.99Å; W135-P137 HydrophobicContact CH2-CG 4.25Å; W135-P137 HydrophobicContact CZ2-CB 3.94Å; W135-P137 HydrophobicContact CZ3-CG 4.49Å; W135-L161 HydrophobicContact CB-CD2 3.66Å; W135-L161 HydrophobicContact CD2-CD2 4Å; W135-L161 HydrophobicContact CE3-CD2 3.67Å; W135-L161 HydrophobicContact CG-CD2 4.05Å; W135-K163 HydrophobicContact CH2-CB 3.56Å; W135-K163 WeakPolarHBondContact CH2-O 3.36Å; W135-K163 HydrophobicContact CZ3-CB 3.78Å; W135-K163 WeakPolarHBondContact CZ3-O 3.19Å
136	K	65.1	Low	70	Confident	146 Å²	146	60.8 Å²	60.8	64%	0.635	33%	0.325	S	S	*	.			trans	-117.7	128.9	164.1	-68.3	-179.6	179.6	175.1	0	107.3	T138	K136-T138 PolarHBondContact O-N 3.01Å
137	P	58.7	Low	68.8	Low	73 Å²	73	64.2 Å²	64.2	47%	0.474	34%	0.343	S	S	.	.			trans	-61.2	113.4	170	23.3	-29.4	0	0	0	108.4	W135	W135-P137 HydrophobicContact CH2-CB 3.99Å; W135-P137 HydrophobicContact CH2-CG 4.25Å; W135-P137 HydrophobicContact CZ2-CB 3.94Å; W135-P137 HydrophobicContact CZ3-CG 4.49Å
138	T	55.1	Low	68	Low	90 Å²	90	62.1 Å²	62.1	55%	0.552	33%	0.333	S	S	*	.			trans	-111.7	152.7	170.3	50.3	0	0	0	0	107.8	K136 D140 D141	K136-T138 PolarHBondContact O-N 3.01Å; T138-D140 PolarHBondContact O-N 3.03Å; T138-D141 PolarHBondContact O-N 3.19Å; T138-D141 VanDerWaalsContact O-N 3.15Å
139	D	46.1	Very low	67.4	Low	176 Å²	176	65.2 Å²	65.2	94%	0.941	36%	0.355	S	S	*	.	S	Bend	trans	-53.2	-20.2	-178.4	-71.3	-35.5	0	0	0	114.2	D141	D139-D141 VanDerWaalsContact C-N 3.26Å; D139-D141 PolarHBondContact O-N 3.32Å
140	D	53	Low	67.3	Low	96 Å²	96	66 Å²	66	51%	0.513	36%	0.364	S	S	.	.			trans	-88.6	45.5	174	-147.9	1	0	0	0	113.5	T138 S142	T138-D140 PolarHBondContact O-N 3.03Å; D140-S142 PolarHBondContact O-N 2.94Å; D140-S142 PolarHBondContact OD1-OG 3.48Å
141	D	51.5	Low	67.3	Low	68 Å²	68	61.9 Å²	61.9	36%	0.364	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-57.6	-12.3	172.4	-85.4	-26.2	0	0	0	112.6	T138 D139 L143	T138-D141 PolarHBondContact O-N 3.19Å; T138-D141 VanDerWaalsContact O-N 3.15Å; D139-D141 VanDerWaalsContact C-N 3.26Å; D139-D141 PolarHBondContact O-N 3.32Å; D141-L143 PolarHBondContact O-N 3.19Å
142	S	48.4	Very low	67.6	Low	64 Å²	64	63.8 Å²	63.8	45%	0.448	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-59.6	-9.6	-179.7	-10.6	0	0	0	0	115.4	D140 N146	D140-S142 PolarHBondContact O-N 2.94Å; D140-S142 PolarHBondContact OD1-OG 3.48Å; S142-N146 VanDerWaalsContact O-CG 3.31Å; S142-N146 PolarHBondContact O-ND2 2.91Å; S142-N146 PolarHBondContact O-OD1 2.99Å
143	L	51.5	Low	68.2	Low	84 Å²	84	67.8 Å²	67.8	44%	0.44	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-108.2	-4.6	-167.4	-71.4	170	0	0	0	115.3	D141 L145	D141-L143 PolarHBondContact O-N 3.19Å; L143-L145 PolarHBondContact O-N 3.23Å
144	L	58.8	Low	69	Low	43 Å²	43	61.7 Å²	61.7	23%	0.225	33%	0.331	C	S	.	.	S	Bend	trans	-76.6	112.5	-179.2	-85.5	158.4	0	0	0	111.3	V114 N146 P165	V114-L144 HydrophobicContact CB-CD2 3.73Å; V114-L144 HydrophobicContact CG1-CD2 3.65Å; V114-L144 HydrophobicContact CG2-CD2 3.7Å; L144-N146 VanDerWaalsContact C-N 3.29Å; L144-N146 PolarHBondContact O-N 3.28Å; L144-P165 HydrophobicContact CD1-CB 4.09Å; L144-P165 HydrophobicContact CD1-CG 3.62Å
145	L	67.7	Low	69.9	Low	11 Å²	11	61.7 Å²	61.7	6%	0.058	33%	0.332	C	S	.	.	S	Bend	trans	61.3	18.9	171.4	-60.5	160.1	0	0	0	116.7	V114 T117 L126 L143 D147 S148 L154 L170	V114-L145 HydrophobicContact CG1-CD2 3.76Å; V114-L145 HydrophobicContact CG1-CG 3.69Å; T117-L145 HydrophobicContact CG2-CD2 3.79Å; L126-L145 HydrophobicContact CD2-CD2 3.73Å; L143-L145 PolarHBondContact O-N 3.23Å; L145-D147 PolarHBondContact O-N 3.29Å; L145-S148 PolarHBondContact O-N 3.13Å; L145-L154 HydrophobicContact CD1-CD1 4.36Å; L145-L154 HydrophobicContact CD1-CD2 3.95Å; L145-L170 HydrophobicContact CB-CD2 3.98Å; L145-L170 HydrophobicContact CD1-CD1 3.9Å
146	N	66.1	Low	70.9	Confident	75 Å²	75	60.4 Å²	60.4	40%	0.401	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-33.2	-177.3	-88.8	0.5	0	0	0	115	S142 L144 S148 H169	S142-N146 VanDerWaalsContact O-CG 3.31Å; S142-N146 PolarHBondContact O-ND2 2.91Å; S142-N146 PolarHBondContact O-OD1 2.99Å; L144-N146 VanDerWaalsContact C-N 3.29Å; L144-N146 PolarHBondContact O-N 3.28Å; N146-S148 VanDerWaalsContact C-N 3.33Å; N146-H169 PolarHBondContact OD1-CD2 2.94Å
147	D	67.3	Low	72.2	Confident	71 Å²	71	53.7 Å²	53.7	38%	0.38	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	0.2	-178.7	-60.5	-28.8	0	0	0	113.6	N119 L145	N119-D147 PolarHBondContact N-OD2 3.22Å; L145-D147 PolarHBondContact O-N 3.29Å
148	S	77.3	Confident	73.8	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.286	C	S	.	.			trans	-111	40.5	-172.8	-56	0	0	0	0	112.7	L145 N146 A150 L151 L170	L145-S148 PolarHBondContact O-N 3.13Å; N146-S148 VanDerWaalsContact C-N 3.33Å; S148-A150 PolarHBondContact O-N 2.91Å; S148-L151 VanDerWaalsContact O-CB 3.25Å; S148-L151 WeakPolarHBondContact O-CB 3.46Å; S148-L151 PolarHBondContact O-N 3.24Å; S148-L170 VanDerWaalsContact O-CD2 3.28Å; S148-L170 WeakPolarHBondContact O-CD2 3.3Å
149	S	80	Confident	75.3	Confident	65 Å²	65	47.3 Å²	47.3	46%	0.455	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-21.2	-179.1	62.3	0	0	0	0	114.3	L151	S149-L151 VanDerWaalsContact C-N 3.32Å
150	A	87.5	Confident	77.3	Confident	34 Å²	34	40 Å²	40	28%	0.281	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-1.6	177.4	0	0	0	0	0	114.4	S148 E152	S148-A150 PolarHBondContact O-N 2.91Å; A150-E152 PolarHBondContact O-N 3.01Å
151	L	90.2	Very high	79	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.203	C	C	.	.			trans	-65.6	119.3	-176	-164.7	75.6	0	0	0	111.1	L123 L126 S148 S149 L154 L170 E172 L173	L123-L151 HydrophobicContact CD2-CD1 4.11Å; L123-L151 HydrophobicContact CG-CD1 4.07Å; L126-L151 HydrophobicContact CB-CD1 3.82Å; L126-L151 HydrophobicContact CB-CD2 4.26Å; S148-L151 VanDerWaalsContact O-CB 3.25Å; S148-L151 WeakPolarHBondContact O-CB 3.46Å; S148-L151 PolarHBondContact O-N 3.24Å; S149-L151 VanDerWaalsContact C-N 3.32Å; L151-L154 HydrophobicContact CD2-CB 3.94Å; L151-L154 HydrophobicContact CD2-CD1 4Å; L151-L154 HydrophobicContact CD2-CD2 4.49Å; L151-L154 HydrophobicContact CD2-CG 4.36Å; L151-L170 HydrophobicContact CB-CD2 4.28Å; L151-L170 HydrophobicContact CD2-CD1 4.36Å; L151-E172 CarbonylContact O-C 3.05Å; L151-L173 WeakPolarHBondContact O-CA 3.39Å; L151-L173 PolarHBondContact O-N 3.36Å
152	E	92.8	Very high	80.7	Confident	40 Å²	40	37.6 Å²	37.6	19%	0.187	21%	0.21	C	C	.	.			trans	-94.8	-26.2	-178.8	-62.1	-172.5	-141.9	0	0	112.3	R124 A150 K174 L175	R124-E152 IonicContact CZ-OE1 2.69Å; R124-E152 IonicContact NE-OE1 3.97Å; R124-E152 IonicContact NH1-OE1 3.88Å; R124-E152 PolarHBondContact NH1-OE1 2.9Å; R124-E152 PolarHBondContact O-N 3.05Å; A150-E152 PolarHBondContact O-N 3.01Å; E152-K174 WeakPolarHBondContact O-CA 3.21Å; E152-K174 PolarHBondContact O-N 3.42Å; E152-K174 IonicContact OE2-NZ 3.09Å; E152-K174 PolarHBondContact OE2-NZ 2.85Å; E152-L175 PolarHBondContact O-N 2.82Å
153	R	94	Very high	82.3	Confident	113 Å²	113	41.2 Å²	41.2	43%	0.426	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	125.5	-173.1	-62.4	-176.2	177.9	-175.5	-1.2	110.4	R124 Y125 L126 L175	R124-R153 PolarHBondContact O-N 2.98Å; Y125-R153 WeakPolarHBondContact CA-O 3.27Å; Y125-R153 HydrophobicContact CD2-CB 3.41Å; Y125-R153 VanDerWaalsContact CD2-CB 3.41Å; Y125-R153 HydrophobicContact CD2-CG 4.15Å; Y125-R153 HydrophobicContact CE2-CB 4.05Å; Y125-R153 HydrophobicContact CG-CB 4.39Å; L126-R153 PolarHBondContact N-O 2.99Å; R153-L175 WeakPolarHBondContact CA-O 3.19Å; R153-L175 HydrophobicContact CB-CB 4.3Å; R153-L175 HydrophobicContact CG-CB 4Å
154	L	93	Very high	83.9	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	123.8	-179.5	179.5	59.9	0	0	0	110.2	L126 L145 L151 L156 L170 L173 L175 L176 N177	L126-L154 HydrophobicContact CB-CD1 4.17Å; L126-L154 HydrophobicContact CD2-CD1 3.91Å; L126-L154 HydrophobicContact CG-CD1 4.19Å; L126-L154 CarbonylContact O-C 3.49Å; L126-L154 WeakPolarHBondContact O-CA 3.17Å; L145-L154 HydrophobicContact CD1-CD1 4.36Å; L145-L154 HydrophobicContact CD1-CD2 3.95Å; L151-L154 HydrophobicContact CD2-CB 3.94Å; L151-L154 HydrophobicContact CD2-CD1 4Å; L151-L154 HydrophobicContact CD2-CD2 4.49Å; L151-L154 HydrophobicContact CD2-CG 4.36Å; L154-L156 HydrophobicContact CD1-CD1 4.45Å; L154-L156 HydrophobicContact CD1-CD2 3.9Å; L154-L156 HydrophobicContact CD1-CG 3.96Å; L154-L156 HydrophobicContact CD2-CD1 4.27Å; L154-L156 HydrophobicContact CD2-CG 4.49Å; L154-L156 HydrophobicContact CG-CD1 4.39Å; L154-L156 HydrophobicContact CG-CG 4.07Å; L154-L170 HydrophobicContact CD2-CD1 4.09Å; L154-L173 HydrophobicContact CB-CD1 3.74Å; L154-L175 PolarHBondContact N-O 3.2Å; L154-L176 HydrophobicContact CB-CD1 4.1Å; L154-L176 HydrophobicContact CD2-CD1 3.94Å; L154-L176 HydrophobicContact CG-CD1 4.08Å; L154-L176 WeakPolarHBondContact O-CA 3.44Å; L154-N177 PolarHBondContact O-N 3.32Å
155	V	93.7	Very high	84.8	Confident	8 Å²	8	36.8 Å²	36.8	5%	0.048	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	117.6	175.9	-178	0	0	0	0	108.7	Y125 L126 Q127 L128 L175 N177	Y125-V155 HydrophobicContact CE2-CG2 4.13Å; L126-V155 PolarHBondContact O-N 2.95Å; Q127-V155 WeakPolarHBondContact CA-O 3.47Å; Q127-V155 HydrophobicContact CB-CB 3.92Å; Q127-V155 HydrophobicContact CB-CG1 4.5Å; Q127-V155 HydrophobicContact CB-CG2 4.42Å; Q127-V155 HydrophobicContact CG-CB 3.84Å; Q127-V155 HydrophobicContact CG-CG1 3.86Å; L128-V155 PolarHBondContact N-O 3Å; V155-L175 HydrophobicContact CG2-CD2 4.26Å; V155-N177 WeakPolarHBondContact CA-O 3.41Å; V155-N177 HydrophobicContact CB-CB 4.31Å; V155-N177 HydrophobicContact CG1-CB 4.07Å; V155-N177 HydrophobicContact CG2-CB 4.05Å
156	L	92.1	Very high	85.2	Confident	11 Å²	11	39.6 Å²	39.6	6%	0.058	22%	0.215	C	C	.	.			trans	-126.1	46.5	177.4	-58.2	178.9	0	0	0	110.9	L128 L154 N159 L161 M164 N177 L178 N181	L128-L156 HydrophobicContact CB-CD2 3.91Å; L128-L156 HydrophobicContact CD1-CD2 4.06Å; L128-L156 HydrophobicContact CG-CD2 4.31Å; L128-L156 WeakPolarHBondContact O-CA 3.41Å; L154-L156 HydrophobicContact CD1-CD1 4.45Å; L154-L156 HydrophobicContact CD1-CD2 3.9Å; L154-L156 HydrophobicContact CD1-CG 3.96Å; L154-L156 HydrophobicContact CD2-CD1 4.27Å; L154-L156 HydrophobicContact CD2-CG 4.49Å; L154-L156 HydrophobicContact CG-CD1 4.39Å; L154-L156 HydrophobicContact CG-CG 4.07Å; L156-N159 PolarHBondContact O-ND2 3.24Å; L156-L161 HydrophobicContact CB-CD1 3.98Å; L156-L161 HydrophobicContact CD1-CD1 4.27Å; L156-M164 HydrophobicContact CD1-CE 3.75Å; L156-N177 PolarHBondContact N-O 2.9Å; L156-L178 HydrophobicContact CB-CD2 3.94Å; L156-L178 HydrophobicContact CD1-CD2 4.2Å; L156-L178 HydrophobicContact CG-CD2 4.43Å; L156-N181 PolarHBondContact O-ND2 2.73Å
157	S	91.6	Very high	85.9	Confident	5 Å²	5	36.6 Å²	36.6	4%	0.035	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	156	-177.1	49.8	0	0	0	0	113	D129 H130 N159 S179	D129-S157 WeakPolarHBondContact CA-O 3.18Å; D129-S157 VanDerWaalsContact OD1-C 3.26Å; D129-S157 WeakPolarHBondContact OD1-CB 3.45Å; D129-S157 PolarHBondContact OD1-OG 3.07Å; H130-S157 PolarHBondContact N-O 2.98Å; S157-N159 VanDerWaalsContact C-N 3.29Å; S157-N159 VanDerWaalsContact O-CG 3.29Å; S157-N159 PolarHBondContact O-N 3Å; S157-N159 VanDerWaalsContact O-N 3.12Å; S157-N159 PolarHBondContact O-ND2 3.3Å; S157-N159 VanDerWaalsContact O-ND2 3.11Å; S157-S179 WeakPolarHBondContact CA-O 3.28Å; S157-S179 WeakPolarHBondContact CB-O 3.14Å; S157-S179 WeakPolarHBondContact CB-OG 3.25Å
158	S	91.9	Very high	86.4	Confident	28 Å²	28	34.9 Å²	34.9	20%	0.196	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	36	170.5	-59.7	0	0	0	0	115.8	D129 H130 S179 S180	D129-S158 WeakPolarHBondContact OD1-CB 3.28Å; H130-S158 WeakPolarHBondContact CA-O 3.43Å; H130-S158 VanDerWaalsContact CD2-CB 3.5Å; H130-S158 WeakPolarHBondContact CD2-CB 3.47Å; H130-S158 PolarHBondContact CE1-OG 3.17Å; H130-S158 PolarHBondContact NE2-OG 2.74Å; S158-S179 PolarHBondContact N-O 3.06Å; S158-S179 VanDerWaalsContact N-O 3.13Å; S158-S180 VanDerWaalsContact CA-O 3.31Å; S158-S180 WeakPolarHBondContact CA-O 3.43Å; S158-S180 PolarHBondContact N-O 3.45Å; S158-S180 WeakPolarHBondContact OG-CB 3.47Å
159	N	87.5	Confident	86.5	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.011	22%	0.216	C	C	.	.	S	Bend	trans	-111.2	5.8	-178.4	-69.4	-48.9	0	0	0	113.6	L128 L131 G132 W134 L156 S157 L161 N181	L128-N159 PolarHBondContact O-ND2 3Å; L131-N159 WeakPolarHBondContact CB-OD1 3.45Å; L131-N159 PolarHBondContact N-OD1 3.29Å; G132-N159 CarbonylContact O-C 3.36Å; G132-N159 VanDerWaalsContact O-O 3.04Å; W134-N159 PolarHBondContact NE1-OD1 3.26Å; L156-N159 PolarHBondContact O-ND2 3.24Å; S157-N159 VanDerWaalsContact C-N 3.29Å; S157-N159 VanDerWaalsContact O-CG 3.29Å; S157-N159 PolarHBondContact O-N 3Å; S157-N159 VanDerWaalsContact O-N 3.12Å; S157-N159 PolarHBondContact O-ND2 3.3Å; S157-N159 VanDerWaalsContact O-ND2 3.11Å; N159-L161 VanDerWaalsContact C-N 3.29Å; N159-L161 HydrophobicContact CB-CD2 4.36Å; N159-L161 HydrophobicContact CB-CG 4.07Å; N159-L161 PolarHBondContact O-N 2.93Å; N159-N181 PolarHBondContact N-OD1 2.9Å; N159-N181 VanDerWaalsContact N-OD1 3.1Å
160	G	87.7	Confident	86.8	Confident	22 Å²	22	37.1 Å²	37.1	23%	0.227	20%	0.196	C	C	.	.			trans	68.7	20.9	179.7	0	0	0	0	0	114.9	E162 N181	G160-E162 PolarHBondContact O-N 3.05Å; G160-N181 PolarHBondContact N-OD1 2.82Å
161	L	87.7	Confident	86.7	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.021	21%	0.205	C	C	.	.			trans	-63.4	123.7	-175.9	-57.4	173.9	0	0	0	111.9	W135 L156 N159 M164 L178 N181 R182 L183	W135-L161 HydrophobicContact CB-CD2 3.66Å; W135-L161 HydrophobicContact CD2-CD2 4Å; W135-L161 HydrophobicContact CE3-CD2 3.67Å; W135-L161 HydrophobicContact CG-CD2 4.05Å; L156-L161 HydrophobicContact CB-CD1 3.98Å; L156-L161 HydrophobicContact CD1-CD1 4.27Å; N159-L161 VanDerWaalsContact C-N 3.29Å; N159-L161 HydrophobicContact CB-CD2 4.36Å; N159-L161 HydrophobicContact CB-CG 4.07Å; N159-L161 PolarHBondContact O-N 2.93Å; L161-M164 HydrophobicContact CD1-SD 4.49Å; L161-L178 HydrophobicContact CD1-CD2 4.43Å; L161-N181 HydrophobicContact CB-CB 4.01Å; L161-N181 WeakPolarHBondContact CG-OD1 3.19Å; L161-N181 PolarHBondContact N-OD1 3.24Å; L161-R182 CarbonylContact O-C 3.46Å; L161-R182 WeakPolarHBondContact O-CA 3.43Å; L161-R182 PolarHBondContact O-N 3Å; L161-L183 PolarHBondContact O-N 3.43Å
162	E	87.4	Confident	86.6	Confident	110 Å²	110	42.3 Å²	42.3	51%	0.514	22%	0.22	S	C	.	.	S	Bend	trans	-95.1	-24.1	178.2	-67.1	-173	176.7	0	0	113.6	G160 R182	G160-E162 PolarHBondContact O-N 3.05Å; E162-R182 HydrophobicContact CG-CB 3.79Å; E162-R182 IonicContact OE1-NH1 3.84Å
163	K	83.7	Confident	86.6	Confident	140 Å²	140	40.6 Å²	40.6	61%	0.609	21%	0.211	S	C	*	.	S	Bend	trans	-140.3	174	179.7	-71.2	-176.7	-177.6	179	0	108.8	W135	W135-K163 HydrophobicContact CH2-CB 3.56Å; W135-K163 WeakPolarHBondContact CH2-O 3.36Å; W135-K163 HydrophobicContact CZ3-CB 3.78Å; W135-K163 WeakPolarHBondContact CZ3-O 3.19Å
164	M	83.5	Confident	86.5	Confident	22 Å²	22	37.6 Å²	37.6	11%	0.108	20%	0.202	C	C	.	.			trans	-134.1	137.4	174.7	-163.1	68.1	-174.7	0	0	109	L156 L161 L167 L178 W188	L156-M164 HydrophobicContact CD1-CE 3.75Å; L161-M164 HydrophobicContact CD1-SD 4.49Å; M164-L167 HydrophobicContact CE-CD1 4.05Å; M164-L167 HydrophobicContact CE-CD2 3.76Å; M164-L167 HydrophobicContact CE-CG 4.23Å; M164-L178 HydrophobicContact CE-CD2 3.95Å; M164-L178 HydrophobicContact CG-CD1 4.35Å; M164-L178 HydrophobicContact SD-CD1 4.09Å; M164-L178 HydrophobicContact SD-CD2 3.93Å; M164-W188 HydrophobicContact CB-CB 3.96Å; M164-W188 HydrophobicContact CB-CD2 3.58Å; M164-W188 HydrophobicContact CB-CE3 3.75Å; M164-W188 HydrophobicContact CB-CG 3.65Å; M164-W188 HydrophobicContact CB-CZ3 4.49Å; M164-W188 HydrophobicContact CG-CD2 4.15Å; M164-W188 HydrophobicContact CG-CE3 3.81Å; M164-W188 HydrophobicContact CG-CZ3 4.18Å
165	P	77.3	Confident	86.6	Confident	12 Å²	12	39.3 Å²	39.3	8%	0.078	21%	0.21	C	C	.	.			trans	-69.4	171.2	171.3	35.6	-43	0	0	0	111.1	L144 L167	L144-P165 HydrophobicContact CD1-CB 4.09Å; L144-P165 HydrophobicContact CD1-CG 3.62Å; P165-L167 PolarHBondContact O-N 3.15Å
166	S	76.8	Confident	86.6	Confident	69 Å²	69	39 Å²	39	48%	0.483	21%	0.208	S	C	.	.			trans	-65.7	122.2	172.3	-175.1	0	0	0	0	111.3	C168	S166-C168 VanDerWaalsContact C-N 3.26Å; S166-C168 PolarHBondContact O-N 3.16Å; S166-C168 PolarHBondContact OG-N 2.98Å; S166-C168 PolarHBondContact OG-SG 3.39Å
167	L	81.2	Confident	86.8	Confident	12 Å²	12	39.8 Å²	39.8	6%	0.063	21%	0.213	C	C	.	.			trans	-88.7	17.3	174.7	-60.9	-178.6	0	0	0	113.3	M164 P165 H169 L170 L173 L176	M164-L167 HydrophobicContact CE-CD1 4.05Å; M164-L167 HydrophobicContact CE-CD2 3.76Å; M164-L167 HydrophobicContact CE-CG 4.23Å; P165-L167 PolarHBondContact O-N 3.15Å; L167-H169 PolarHBondContact O-N 2.85Å; L167-H169 VanDerWaalsContact O-N 3.07Å; L167-L170 HydrophobicContact CB-CD1 4.5Å; L167-L170 HydrophobicContact CD2-CD1 3.97Å; L167-L170 PolarHBondContact O-N 2.93Å; L167-L173 HydrophobicContact CD1-CD2 4.04Å; L167-L176 HydrophobicContact CD1-CD1 4.15Å; L167-L176 HydrophobicContact CD1-CD2 3.55Å
168	C	78.3	Confident	86.9	Confident	36 Å²	36	39.5 Å²	39.5	24%	0.243	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-26.1	-173	-79.5	0	0	0	0	114.6	S166 L170 S190 C192	S166-C168 VanDerWaalsContact C-N 3.26Å; S166-C168 PolarHBondContact O-N 3.16Å; S166-C168 PolarHBondContact OG-N 2.98Å; S166-C168 PolarHBondContact OG-SG 3.39Å; C168-L170 VanDerWaalsContact C-N 3.31Å; C168-S190 PolarHBondContact SG-OG 2.77Å; C168-S190 VanDerWaalsContact SG-OG 3.34Å; C168-C192 VanDerWaalsContact CA-CB 3.44Å; C168-C192 HydrophobicContact CB-CB 3.51Å; C168-C192 WeakPolarHBondContact CB-SG 3.31Å; C168-C192 WeakPolarHBondContact SG-CB 3.27Å; C168-C192 CovalentContact SG-SG 2.04Å; C168-C192 PolarHBondContact SG-SG 2.83Å
169	H	79.7	Confident	87.1	Confident	105 Å²	105	38.4 Å²	38.4	49%	0.486	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-20.8	178.6	-59.2	-66.4	0	0	0	113.4	N146 L167 T171	N146-H169 PolarHBondContact OD1-CD2 2.94Å; L167-H169 PolarHBondContact O-N 2.85Å; L167-H169 VanDerWaalsContact O-N 3.07Å; H169-T171 VanDerWaalsContact C-N 3.33Å; H169-T171 PolarHBondContact O-N 2.83Å; H169-T171 VanDerWaalsContact O-N 3.1Å
170	L	85.8	Confident	87.4	Confident	7 Å²	7	40.2 Å²	40.2	4%	0.037	22%	0.216	C	C	.	.			trans	-88.5	68.6	-178.5	-55.4	-178.8	0	0	0	110.8	L145 S148 L151 L154 L167 C168 E172 L173	L145-L170 HydrophobicContact CB-CD2 3.98Å; L145-L170 HydrophobicContact CD1-CD1 3.9Å; S148-L170 VanDerWaalsContact O-CD2 3.28Å; S148-L170 WeakPolarHBondContact O-CD2 3.3Å; L151-L170 HydrophobicContact CB-CD2 4.28Å; L151-L170 HydrophobicContact CD2-CD1 4.36Å; L154-L170 HydrophobicContact CD2-CD1 4.09Å; L167-L170 HydrophobicContact CB-CD1 4.5Å; L167-L170 HydrophobicContact CD2-CD1 3.97Å; L167-L170 PolarHBondContact O-N 2.93Å; C168-L170 VanDerWaalsContact C-N 3.31Å; L170-E172 PolarHBondContact O-N 2.97Å; L170-L173 HydrophobicContact CB-CB 4.06Å; L170-L173 HydrophobicContact CD1-CD2 4.32Å; L170-L173 WeakPolarHBondContact O-CB 3.5Å; L170-L173 PolarHBondContact O-N 2.66Å
171	T	84.2	Confident	87.7	Confident	78 Å²	78	39.6 Å²	39.6	48%	0.479	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-21	-172.3	55.1	0	0	0	0	114.2	H169 K195	H169-T171 VanDerWaalsContact C-N 3.33Å; H169-T171 PolarHBondContact O-N 2.83Å; H169-T171 VanDerWaalsContact O-N 3.1Å; T171-K195 WeakPolarHBondContact O-CD 3.43Å
172	E	89.5	Confident	87.9	Confident	65 Å²	65	43.3 Å²	43.3	30%	0.304	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	2.2	179.3	-63.1	-52.6	126.9	0	0	114.5	L151 L170 K174 K195	L151-E172 CarbonylContact O-C 3.05Å; L170-E172 PolarHBondContact O-N 2.97Å; E172-K174 PolarHBondContact O-N 3.47Å; E172-K195 IonicContact OE1-NZ 3.42Å; E172-K195 PolarHBondContact OE1-NZ 3.05Å; E172-K195 IonicContact OE2-NZ 3.21Å; E172-K195 PolarHBondContact OE2-NZ 3.42Å
173	L	91.3	Very high	88.1	Confident	3 Å²	3	38.1 Å²	38.1	2%	0.016	20%	0.197	C	C	.	.			trans	-65.9	119.3	-173.7	-167.9	70.4	0	0	0	112.1	L151 L154 L167 L170 L175 L176 K195 L196	L151-L173 WeakPolarHBondContact O-CA 3.39Å; L151-L173 PolarHBondContact O-N 3.36Å; L154-L173 HydrophobicContact CB-CD1 3.74Å; L167-L173 HydrophobicContact CD1-CD2 4.04Å; L170-L173 HydrophobicContact CB-CB 4.06Å; L170-L173 HydrophobicContact CD1-CD2 4.32Å; L170-L173 WeakPolarHBondContact O-CB 3.5Å; L170-L173 PolarHBondContact O-N 2.66Å; L173-L175 WeakPolarHBondContact CD1-O 3.43Å; L173-L176 HydrophobicContact CD2-CB 4.26Å; L173-L176 HydrophobicContact CD2-CD1 4.43Å; L173-K195 CarbonylContact O-C 3.46Å; L173-K195 VanDerWaalsContact O-C 3.24Å; L173-L196 HydrophobicContact CD2-CD1 4.27Å; L173-L196 HydrophobicContact CG-CD1 4.17Å; L173-L196 WeakPolarHBondContact O-CA 3.09Å; L173-L196 PolarHBondContact O-N 3.29Å
174	K	93.2	Very high	88.5	Confident	51 Å²	51	35.1 Å²	35.1	22%	0.222	19%	0.194	C	C	.	.			trans	-108.3	-33.7	179.3	-65.6	171.3	-171.3	164.7	0	112.9	E152 E172 V197 T198	E152-K174 WeakPolarHBondContact O-CA 3.21Å; E152-K174 PolarHBondContact O-N 3.42Å; E152-K174 IonicContact OE2-NZ 3.09Å; E152-K174 PolarHBondContact OE2-NZ 2.85Å; E172-K174 PolarHBondContact O-N 3.47Å; K174-V197 HydrophobicContact CB-CG2 4.49Å; K174-V197 PolarHBondContact O-N 3.35Å; K174-T198 PolarHBondContact O-N 3.38Å
175	L	94.9	Very high	88.7	Confident	35 Å²	35	35.8 Å²	35.8	18%	0.183	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	128.2	179	-176.1	153.2	0	0	0	110.2	E152 R153 L154 V155 L173 N177 T198	E152-L175 PolarHBondContact O-N 2.82Å; R153-L175 WeakPolarHBondContact CA-O 3.19Å; R153-L175 HydrophobicContact CB-CB 4.3Å; R153-L175 HydrophobicContact CG-CB 4Å; L154-L175 PolarHBondContact N-O 3.2Å; V155-L175 HydrophobicContact CG2-CD2 4.26Å; L173-L175 WeakPolarHBondContact CD1-O 3.43Å; L175-N177 HydrophobicContact CD2-CB 4.22Å; L175-T198 WeakPolarHBondContact CA-O 3.11Å; L175-T198 HydrophobicContact CD1-CG2 4.31Å; L175-T198 HydrophobicContact CG-CG2 4.26Å
176	L	94.4	Very high	89.3	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	116.6	173.2	-179.8	59.7	0	0	0	109.5	L154 L167 L173 L178 W188 L196 T198 L199 D200	L154-L176 HydrophobicContact CB-CD1 4.1Å; L154-L176 HydrophobicContact CD2-CD1 3.94Å; L154-L176 HydrophobicContact CG-CD1 4.08Å; L154-L176 WeakPolarHBondContact O-CA 3.44Å; L167-L176 HydrophobicContact CD1-CD1 4.15Å; L167-L176 HydrophobicContact CD1-CD2 3.55Å; L173-L176 HydrophobicContact CD2-CB 4.26Å; L173-L176 HydrophobicContact CD2-CD1 4.43Å; L176-L178 HydrophobicContact CD1-CD1 4.49Å; L176-L178 HydrophobicContact CD1-CD2 3.94Å; L176-L178 HydrophobicContact CD1-CG 4.05Å; L176-L178 HydrophobicContact CD2-CD1 4.12Å; L176-L178 HydrophobicContact CD2-CG 4.43Å; L176-L178 HydrophobicContact CG-CD1 4.24Å; L176-L178 HydrophobicContact CG-CD2 4.45Å; L176-L178 HydrophobicContact CG-CG 4Å; L176-W188 HydrophobicContact CD2-CH2 3.81Å; L176-W188 HydrophobicContact CD2-CZ3 3.78Å; L176-L196 HydrophobicContact CB-CD1 3.7Å; L176-T198 PolarHBondContact N-O 3.04Å; L176-L199 HydrophobicContact CB-CD1 4.16Å; L176-L199 HydrophobicContact CD2-CD1 3.99Å; L176-L199 HydrophobicContact CG-CD1 4.13Å; L176-L199 WeakPolarHBondContact O-CA 3.48Å; L176-D200 PolarHBondContact O-N 3.25Å
177	N	95	Very high	89.5	Confident	28 Å²	28	39.4 Å²	39.4	15%	0.15	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	113.3	174.9	-176.5	-16.1	0	0	0	109.9	L154 V155 L156 L175 S179 D200	L154-N177 PolarHBondContact O-N 3.32Å; V155-N177 WeakPolarHBondContact CA-O 3.41Å; V155-N177 HydrophobicContact CB-CB 4.31Å; V155-N177 HydrophobicContact CG1-CB 4.07Å; V155-N177 HydrophobicContact CG2-CB 4.05Å; L156-N177 PolarHBondContact N-O 2.9Å; L175-N177 HydrophobicContact CD2-CB 4.22Å; N177-S179 WeakPolarHBondContact OD1-CB 3.2Å; N177-S179 PolarHBondContact OD1-N 2.83Å; N177-S179 PolarHBondContact OD1-OG 3.15Å; N177-D200 HydrophobicContact CB-CB 4.21Å
178	L	94.6	Very high	89.5	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.212	C	C	.	.			trans	-117.2	25	177	-59	177.7	0	0	0	111.1	L156 L161 M164 L176 N181 L183 W188 D200 N204	L156-L178 HydrophobicContact CB-CD2 3.94Å; L156-L178 HydrophobicContact CD1-CD2 4.2Å; L156-L178 HydrophobicContact CG-CD2 4.43Å; L161-L178 HydrophobicContact CD1-CD2 4.43Å; M164-L178 HydrophobicContact CE-CD2 3.95Å; M164-L178 HydrophobicContact CG-CD1 4.35Å; M164-L178 HydrophobicContact SD-CD1 4.09Å; M164-L178 HydrophobicContact SD-CD2 3.93Å; L176-L178 HydrophobicContact CD1-CD1 4.49Å; L176-L178 HydrophobicContact CD1-CD2 3.94Å; L176-L178 HydrophobicContact CD1-CG 4.05Å; L176-L178 HydrophobicContact CD2-CD1 4.12Å; L176-L178 HydrophobicContact CD2-CG 4.43Å; L176-L178 HydrophobicContact CG-CD1 4.24Å; L176-L178 HydrophobicContact CG-CD2 4.45Å; L176-L178 HydrophobicContact CG-CG 4Å; L178-N181 PolarHBondContact O-ND2 3.45Å; L178-L183 HydrophobicContact CB-CD1 3.86Å; L178-L183 HydrophobicContact CD1-CD1 3.79Å; L178-L183 HydrophobicContact CG-CD1 4.46Å; L178-W188 HydrophobicContact CD1-CH2 3.3Å; L178-W188 HydrophobicContact CD1-CZ2 3.49Å; L178-W188 VanDerWaalsContact CD1-CZ2 3.49Å; L178-W188 HydrophobicContact CD1-CZ3 4.01Å; L178-D200 PolarHBondContact N-O 3.01Å; L178-N204 PolarHBondContact O-ND2 2.94Å
179	S	95.1	Very high	89.7	Confident	4 Å²	4	39.6 Å²	39.6	3%	0.028	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	154.9	-177.5	60.6	0	0	0	0	112.8	S157 S158 N177 N181 S202	S157-S179 WeakPolarHBondContact CA-O 3.28Å; S157-S179 WeakPolarHBondContact CB-O 3.14Å; S157-S179 WeakPolarHBondContact CB-OG 3.25Å; S158-S179 PolarHBondContact N-O 3.06Å; S158-S179 VanDerWaalsContact N-O 3.13Å; N177-S179 WeakPolarHBondContact OD1-CB 3.2Å; N177-S179 PolarHBondContact OD1-N 2.83Å; N177-S179 PolarHBondContact OD1-OG 3.15Å; S179-N181 VanDerWaalsContact C-N 3.32Å; S179-N181 PolarHBondContact O-N 3.11Å; S179-N181 PolarHBondContact O-ND2 3.06Å; S179-S202 CarbonylContact C-O 3.55Å; S179-S202 WeakPolarHBondContact CA-O 3.48Å; S179-S202 WeakPolarHBondContact CB-OG 3.43Å
180	S	95	Very high	89.3	Confident	41 Å²	41	36 Å²	36	29%	0.287	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	38	176	-57.6	0	0	0	0	114.2	S158 S202 R203	S158-S180 VanDerWaalsContact CA-O 3.31Å; S158-S180 WeakPolarHBondContact CA-O 3.43Å; S158-S180 PolarHBondContact N-O 3.45Å; S158-S180 WeakPolarHBondContact OG-CB 3.47Å; S180-S202 PolarHBondContact N-O 3.4Å; S180-R203 WeakPolarHBondContact CA-O 3.1Å; S180-R203 WeakPolarHBondContact OG-CD 3.37Å
181	N	93.1	Very high	88.2	Confident	9 Å²	9	39 Å²	39	5%	0.048	22%	0.217	C	C	.	.	S	Bend	trans	-112	-163.6	174	-76.9	-63.8	0	0	0	110.9	L156 N159 G160 L161 L178 S179 L183 N204	L156-N181 PolarHBondContact O-ND2 2.73Å; N159-N181 PolarHBondContact N-OD1 2.9Å; N159-N181 VanDerWaalsContact N-OD1 3.1Å; G160-N181 PolarHBondContact N-OD1 2.82Å; L161-N181 HydrophobicContact CB-CB 4.01Å; L161-N181 WeakPolarHBondContact CG-OD1 3.19Å; L161-N181 PolarHBondContact N-OD1 3.24Å; L178-N181 PolarHBondContact O-ND2 3.45Å; S179-N181 VanDerWaalsContact C-N 3.32Å; S179-N181 PolarHBondContact O-N 3.11Å; S179-N181 PolarHBondContact O-ND2 3.06Å; N181-L183 HydrophobicContact CB-CG 4.35Å; N181-N204 VanDerWaalsContact CA-OD1 3.29Å; N181-N204 WeakPolarHBondContact CA-OD1 3.42Å; N181-N204 WeakPolarHBondContact CB-OD1 3.27Å; N181-N204 PolarHBondContact N-OD1 2.85Å; N181-N204 PolarHBondContact O-OD1 3.26Å
182	R	92.2	Very high	87.4	Confident	82 Å²	82	37.9 Å²	37.9	31%	0.309	21%	0.212	S	C	.	.			trans	-114.6	20.7	-178.6	-64.3	-178.9	-178.3	164.1	10.8	112.7	E133 L161 E162 S184 N204	E133-R182 IonicContact OE1-CZ 3.72Å; E133-R182 IonicContact OE1-NH1 3.95Å; E133-R182 PolarHBondContact OE1-NH1 3.41Å; E133-R182 IonicContact OE1-NH2 3.85Å; E133-R182 PolarHBondContact OE1-NH2 2.8Å; L161-R182 CarbonylContact O-C 3.46Å; L161-R182 WeakPolarHBondContact O-CA 3.43Å; L161-R182 PolarHBondContact O-N 3Å; E162-R182 HydrophobicContact CG-CB 3.79Å; E162-R182 IonicContact OE1-NH1 3.84Å; R182-S184 PolarHBondContact O-N 3.06Å; R182-N204 PolarHBondContact N-OD1 3.26Å
183	L	92.2	Very high	86.7	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.005	20%	0.2	C	C	.	.			trans	-63.4	124.5	-176.5	-58.6	171.9	0	0	0	110.5	L161 L178 N181 W188 N204 R205 V206	L161-L183 PolarHBondContact O-N 3.43Å; L178-L183 HydrophobicContact CB-CD1 3.86Å; L178-L183 HydrophobicContact CD1-CD1 3.79Å; L178-L183 HydrophobicContact CG-CD1 4.46Å; N181-L183 HydrophobicContact CB-CG 4.35Å; L183-W188 HydrophobicContact CD1-CZ2 4.3Å; L183-N204 HydrophobicContact CB-CB 4.22Å; L183-N204 VanDerWaalsContact CB-OD1 3.27Å; L183-N204 WeakPolarHBondContact CB-OD1 3.19Å; L183-N204 WeakPolarHBondContact CG-OD1 3.11Å; L183-N204 PolarHBondContact N-OD1 2.93Å; L183-R205 CarbonylContact O-C 3.14Å; L183-R205 VanDerWaalsContact O-C 3.25Å; L183-R205 WeakPolarHBondContact O-CA 3.11Å; L183-R205 PolarHBondContact O-N 3.15Å; L183-V206 PolarHBondContact O-N 3.08Å
184	S	91.4	Very high	86.2	Confident	76 Å²	76	44.4 Å²	44.4	53%	0.531	24%	0.235	S	C	.	.			trans	-96.5	-17.1	-179.2	56.4	0	0	0	0	113.9	R182 V206	R182-S184 PolarHBondContact O-N 3.06Å; S184-V206 WeakPolarHBondContact O-CA 3.34Å
185	S	88.7	Confident	86	Confident	36 Å²	36	46.4 Å²	46.4	25%	0.252	24%	0.243	S	C	.	.			trans	-149.5	166.6	178.9	78.5	0	0	0	0	112.1	W188	S185-W188 VanDerWaalsContact O-CD1 3.22Å; S185-W188 PolarHBondContact O-NE1 3.31Å
186	L	88.2	Confident	85.9	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	24%	0.235	C	C	.	.	S	Bend	trans	-101.3	12.9	175.3	-58.9	-179.2	0	0	0	113.2	W188 L189 V201 V206 I209 L214	L186-W188 HydrophobicContact CD2-CZ2 4.12Å; L186-W188 PolarHBondContact O-N 3.3Å; L186-W188 VanDerWaalsContact O-N 3.14Å; L186-L189 HydrophobicContact CB-CD1 4Å; L186-L189 WeakPolarHBondContact O-CB 3.33Å; L186-L189 WeakPolarHBondContact O-CG 3.07Å; L186-L189 PolarHBondContact O-N 3.33Å; L186-L189 VanDerWaalsContact O-N 3.13Å; L186-V201 HydrophobicContact CD2-CB 4.29Å; L186-V201 HydrophobicContact CD2-CG1 3.87Å; L186-V201 HydrophobicContact CD2-CG2 4.15Å; L186-V206 HydrophobicContact CD2-CG2 4.29Å; L186-V206 HydrophobicContact CG-CG1 4.3Å; L186-I209 HydrophobicContact CD1-CG1 4.47Å; L186-L214 HydrophobicContact CD1-CD2 4.2Å
187	Q	82.3	Confident	85.9	Confident	157 Å²	157	46.2 Å²	46.2	73%	0.734	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	-19.8	-175.7	-71	-175.5	-23.4	0	0	114.2	L189	Q187-L189 PolarHBondContact O-N 3.46Å
188	W	81.3	Confident	86	Confident	36 Å²	36	45.9 Å²	45.9	14%	0.136	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-11.4	177.2	54.7	-96.3	0	0	0	113.3	M164 L176 L178 L183 S185 L186 S190 L199 V201	M164-W188 HydrophobicContact CB-CB 3.96Å; M164-W188 HydrophobicContact CB-CD2 3.58Å; M164-W188 HydrophobicContact CB-CE3 3.75Å; M164-W188 HydrophobicContact CB-CG 3.65Å; M164-W188 HydrophobicContact CB-CZ3 4.49Å; M164-W188 HydrophobicContact CG-CD2 4.15Å; M164-W188 HydrophobicContact CG-CE3 3.81Å; M164-W188 HydrophobicContact CG-CZ3 4.18Å; L176-W188 HydrophobicContact CD2-CH2 3.81Å; L176-W188 HydrophobicContact CD2-CZ3 3.78Å; L178-W188 HydrophobicContact CD1-CH2 3.3Å; L178-W188 HydrophobicContact CD1-CZ2 3.49Å; L178-W188 VanDerWaalsContact CD1-CZ2 3.49Å; L178-W188 HydrophobicContact CD1-CZ3 4.01Å; L183-W188 HydrophobicContact CD1-CZ2 4.3Å; S185-W188 VanDerWaalsContact O-CD1 3.22Å; S185-W188 PolarHBondContact O-NE1 3.31Å; L186-W188 HydrophobicContact CD2-CZ2 4.12Å; L186-W188 PolarHBondContact O-N 3.3Å; L186-W188 VanDerWaalsContact O-N 3.14Å; W188-S190 PolarHBondContact O-N 2.99Å; W188-L199 HydrophobicContact CH2-CD1 4.12Å; W188-V201 HydrophobicContact CZ2-CG1 4.21Å
189	L	81	Confident	86	Confident	16 Å²	16	45.9 Å²	45.9	8%	0.084	24%	0.243	C	C	.	.			trans	-65.6	101.3	173.1	-70.7	171.4	0	0	0	110.1	L186 Q187 L199 L214 A216 V217	L186-L189 HydrophobicContact CB-CD1 4Å; L186-L189 WeakPolarHBondContact O-CB 3.33Å; L186-L189 WeakPolarHBondContact O-CG 3.07Å; L186-L189 PolarHBondContact O-N 3.33Å; L186-L189 VanDerWaalsContact O-N 3.13Å; Q187-L189 PolarHBondContact O-N 3.46Å; L189-L199 HydrophobicContact CD1-CD2 3.98Å; L189-L199 HydrophobicContact CD2-CD2 4.18Å; L189-L214 HydrophobicContact CD1-CD2 3.81Å; L189-A216 HydrophobicContact CB-CB 4.45Å; L189-V217 HydrophobicContact CD1-CG2 4.46Å; L189-V217 HydrophobicContact CD2-CG1 4.11Å
190	S	71.4	Confident	86.1	Confident	29 Å²	29	47 Å²	47	20%	0.203	25%	0.248	C	C	.	.			trans	-89.6	152.4	-179	60.4	0	0	0	0	112.1	C168 W188 C192 S193 A216	C168-S190 PolarHBondContact SG-OG 2.77Å; C168-S190 VanDerWaalsContact SG-OG 3.34Å; W188-S190 PolarHBondContact O-N 2.99Å; S190-C192 PolarHBondContact O-N 3.44Å; S190-S193 PolarHBondContact O-N 3.16Å; S190-A216 VanDerWaalsContact C-CB 3.41Å; S190-A216 WeakPolarHBondContact O-CB 3.45Å
191	A	63	Low	86.1	Confident	71 Å²	71	45 Å²	45	59%	0.587	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	4	-173.7	0	0	0	0	0	116.6	R194	A191-R194 PolarHBondContact O-NE 3.19Å
192	C	67.8	Low	86.2	Confident	53 Å²	53	45.2 Å²	45.2	36%	0.358	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-22.1	-176.5	-54.5	0	0	0	0	113.7	C168 S190 R194	C168-C192 VanDerWaalsContact CA-CB 3.44Å; C168-C192 HydrophobicContact CB-CB 3.51Å; C168-C192 WeakPolarHBondContact CB-SG 3.31Å; C168-C192 WeakPolarHBondContact SG-CB 3.27Å; C168-C192 CovalentContact SG-SG 2.04Å; C168-C192 PolarHBondContact SG-SG 2.83Å; S190-C192 PolarHBondContact O-N 3.44Å; C192-R194 PolarHBondContact O-N 2.04Å
193	S	75.1	Confident	86.5	Confident	8 Å²	8	45.6 Å²	45.6	6%	0.056	24%	0.238	C	C	.	.			trans	-78.1	50.5	-175.2	-57.4	0	0	0	0	113.8	S190 K195 L196	S190-S193 PolarHBondContact O-N 3.16Å; S193-K195 VanDerWaalsContact C-N 3.3Å; S193-K195 PolarHBondContact O-N 3.24Å; S193-L196 WeakPolarHBondContact O-CB 3.49Å; S193-L196 PolarHBondContact O-N 2.96Å
194	R	80.4	Confident	86.6	Confident	197 Å²	197	45.7 Å²	45.7	74%	0.743	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-11.7	-170.6	-60.9	-177.1	-175.8	-178.5	1.8	115.3	A191 C192 S219	A191-R194 PolarHBondContact O-NE 3.19Å; C192-R194 PolarHBondContact O-N 2.04Å; R194-S219 VanDerWaalsContact O-CB 3.22Å; R194-S219 WeakPolarHBondContact O-CB 3.48Å; R194-S219 PolarHBondContact O-OG 3.34Å
195	K	89.2	Confident	86.7	Confident	93 Å²	93	47.8 Å²	47.8	40%	0.404	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	0.2	177.5	-68.9	-170	179.7	173	0	113	T171 E172 L173 S193 V197	T171-K195 WeakPolarHBondContact O-CD 3.43Å; E172-K195 IonicContact OE1-NZ 3.42Å; E172-K195 PolarHBondContact OE1-NZ 3.05Å; E172-K195 IonicContact OE2-NZ 3.21Å; E172-K195 PolarHBondContact OE2-NZ 3.42Å; L173-K195 CarbonylContact O-C 3.46Å; L173-K195 VanDerWaalsContact O-C 3.24Å; S193-K195 VanDerWaalsContact C-N 3.3Å; S193-K195 PolarHBondContact O-N 3.24Å; K195-V197 WeakPolarHBondContact O-CG2 3.24Å; K195-V197 PolarHBondContact O-N 3.46Å
196	L	92.3	Very high	87	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.223	C	C	.	.			trans	-67.3	118.7	-176.8	-166.4	72.1	0	0	0	110.3	L173 L176 S193 L199 V217 S219 L220	L173-L196 HydrophobicContact CD2-CD1 4.27Å; L173-L196 HydrophobicContact CG-CD1 4.17Å; L173-L196 WeakPolarHBondContact O-CA 3.09Å; L173-L196 PolarHBondContact O-N 3.29Å; L176-L196 HydrophobicContact CB-CD1 3.7Å; S193-L196 WeakPolarHBondContact O-CB 3.49Å; S193-L196 PolarHBondContact O-N 2.96Å; L196-L199 HydrophobicContact CD2-CB 4.12Å; L196-L199 HydrophobicContact CD2-CD1 4.37Å; L196-V217 HydrophobicContact CB-CG1 4.3Å; L196-V217 HydrophobicContact CD2-CG1 3.79Å; L196-S219 PolarHBondContact N-OG 3.21Å; L196-S219 CarbonylContact O-C 3.57Å; L196-S219 VanDerWaalsContact O-C 3.24Å; L196-S219 WeakPolarHBondContact O-CB 3.46Å; L196-S219 PolarHBondContact O-OG 3.49Å; L196-L220 HydrophobicContact CD2-CD1 4.31Å; L196-L220 HydrophobicContact CG-CD1 4.31Å; L196-L220 WeakPolarHBondContact O-CA 3.25Å; L196-L220 PolarHBondContact O-N 3.32Å
197	V	94.7	Very high	87.2	Confident	32 Å²	32	48.4 Å²	48.4	19%	0.194	24%	0.242	C	C	.	.			trans	-101.3	-39.9	-178.9	179.9	0	0	0	0	110.8	K174 K195 R221 V222	K174-V197 HydrophobicContact CB-CG2 4.49Å; K174-V197 PolarHBondContact O-N 3.35Å; K195-V197 WeakPolarHBondContact O-CG2 3.24Å; K195-V197 PolarHBondContact O-N 3.46Å; V197-R221 HydrophobicContact CG1-CB 3.89Å; V197-R221 HydrophobicContact CG1-CG 3.98Å; V197-R221 PolarHBondContact O-N 2.63Å; V197-V222 PolarHBondContact O-N 3.17Å
198	T	96	Very high	87.6	Confident	21 Å²	21	43.7 Å²	43.7	13%	0.129	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	127	-177.6	-58.2	0	0	0	0	110.3	K174 L175 L176 V222	K174-T198 PolarHBondContact O-N 3.38Å; L175-T198 WeakPolarHBondContact CA-O 3.11Å; L175-T198 HydrophobicContact CD1-CG2 4.31Å; L175-T198 HydrophobicContact CG-CG2 4.26Å; L176-T198 PolarHBondContact N-O 3.04Å; T198-V222 WeakPolarHBondContact CA-O 3.04Å; T198-V222 HydrophobicContact CG2-CB 4.1Å; T198-V222 HydrophobicContact CG2-CG1 4.18Å
199	L	95.5	Very high	88	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	118.2	173.3	177.5	60	0	0	0	109.2	L176 W188 L189 L196 V201 L220 V222 L223 V224	L176-L199 HydrophobicContact CB-CD1 4.16Å; L176-L199 HydrophobicContact CD2-CD1 3.99Å; L176-L199 HydrophobicContact CG-CD1 4.13Å; L176-L199 WeakPolarHBondContact O-CA 3.48Å; W188-L199 HydrophobicContact CH2-CD1 4.12Å; L189-L199 HydrophobicContact CD1-CD2 3.98Å; L189-L199 HydrophobicContact CD2-CD2 4.18Å; L196-L199 HydrophobicContact CD2-CB 4.12Å; L196-L199 HydrophobicContact CD2-CD1 4.37Å; L199-V201 HydrophobicContact CD1-CG1 3.85Å; L199-V201 HydrophobicContact CD2-CG1 4.43Å; L199-V201 HydrophobicContact CG-CG1 4.03Å; L199-L220 HydrophobicContact CB-CD1 3.62Å; L199-L220 HydrophobicContact CB-CD2 4.39Å; L199-V222 PolarHBondContact N-O 3.45Å; L199-L223 HydrophobicContact CB-CD1 4.15Å; L199-L223 HydrophobicContact CD2-CD1 3.99Å; L199-L223 HydrophobicContact CG-CD1 4.07Å; L199-L223 WeakPolarHBondContact O-CA 3.41Å; L199-V224 PolarHBondContact O-N 3.22Å
200	D	96.5	Very high	88.2	Confident	28 Å²	28	42.1 Å²	42.1	15%	0.15	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	115.2	172.1	-173.3	-10.4	0	0	0	109.8	L176 N177 L178 S202 V224	L176-D200 PolarHBondContact O-N 3.25Å; N177-D200 HydrophobicContact CB-CB 4.21Å; L178-D200 PolarHBondContact N-O 3.01Å; D200-S202 WeakPolarHBondContact OD1-CB 3.27Å; D200-S202 PolarHBondContact OD1-N 3Å; D200-S202 PolarHBondContact OD1-OG 3.22Å; D200-V224 HydrophobicContact CB-CB 4.18Å
201	V	95.8	Very high	88.7	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.245	C	C	.	.			trans	-123.5	23.9	175.6	-66.7	0	0	0	0	110.3	L186 W188 L199 N204 L223 V224 A225 N228	L186-V201 HydrophobicContact CD2-CB 4.29Å; L186-V201 HydrophobicContact CD2-CG1 3.87Å; L186-V201 HydrophobicContact CD2-CG2 4.15Å; W188-V201 HydrophobicContact CZ2-CG1 4.21Å; L199-V201 HydrophobicContact CD1-CG1 3.85Å; L199-V201 HydrophobicContact CD2-CG1 4.43Å; L199-V201 HydrophobicContact CG-CG1 4.03Å; V201-N204 WeakPolarHBondContact O-CB 3.33Å; V201-N204 PolarHBondContact O-ND2 2.99Å; V201-N204 VanDerWaalsContact O-ND2 3.08Å; V201-L223 HydrophobicContact CG2-CD1 4.49Å; V201-V224 WeakPolarHBondContact CG2-O 3.45Å; V201-V224 PolarHBondContact N-O 3.46Å; V201-A225 HydrophobicContact CG2-CB 3.85Å; V201-N228 PolarHBondContact O-ND2 3Å
202	S	96	Very high	89.5	Confident	12 Å²	12	49.2 Å²	49.2	8%	0.084	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	159.1	-179.9	60.3	0	0	0	0	112.6	S179 S180 D200 N204 V224 A226	S179-S202 CarbonylContact C-O 3.55Å; S179-S202 WeakPolarHBondContact CA-O 3.48Å; S179-S202 WeakPolarHBondContact CB-OG 3.43Å; S180-S202 PolarHBondContact N-O 3.4Å; D200-S202 WeakPolarHBondContact OD1-CB 3.27Å; D200-S202 PolarHBondContact OD1-N 3Å; D200-S202 PolarHBondContact OD1-OG 3.22Å; S202-N204 PolarHBondContact O-N 2.82Å; S202-N204 PolarHBondContact O-ND2 2.9Å; S202-V224 PolarHBondContact N-O 3.32Å; S202-A226 CarbonylContact C-O 3Å; S202-A226 WeakPolarHBondContact CA-O 3.43Å; S202-A226 VanDerWaalsContact CB-O 3.23Å; S202-A226 WeakPolarHBondContact CB-O 3.36Å
203	R	97	Very high	90.3	Very high	91 Å²	91	48.5 Å²	48.5	34%	0.343	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	36.4	177.7	-60.9	174.9	179.3	-94.2	-0.8	113.3	S180 A226 H227	S180-R203 WeakPolarHBondContact CA-O 3.1Å; S180-R203 WeakPolarHBondContact OG-CD 3.37Å; R203-A226 PolarHBondContact N-O 2.82Å; R203-H227 WeakPolarHBondContact CA-O 3.34Å; R203-H227 HydrophobicContact CB-CB 4.31Å; R203-H227 HydrophobicContact CG-CB 3.64Å; R203-H227 PolarHBondContact N-O 2.96Å
204	N	94.5	Very high	90.9	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.011	23%	0.225	C	C	.	.	S	Bend	trans	-109.1	-158.2	174.9	-84.7	-83.1	0	0	0	110.3	L178 N181 R182 L183 V201 S202 V206 H227 N228	L178-N204 PolarHBondContact O-ND2 2.94Å; N181-N204 VanDerWaalsContact CA-OD1 3.29Å; N181-N204 WeakPolarHBondContact CA-OD1 3.42Å; N181-N204 WeakPolarHBondContact CB-OD1 3.27Å; N181-N204 PolarHBondContact N-OD1 2.85Å; N181-N204 PolarHBondContact O-OD1 3.26Å; R182-N204 PolarHBondContact N-OD1 3.26Å; L183-N204 HydrophobicContact CB-CB 4.22Å; L183-N204 VanDerWaalsContact CB-OD1 3.27Å; L183-N204 WeakPolarHBondContact CB-OD1 3.19Å; L183-N204 WeakPolarHBondContact CG-OD1 3.11Å; L183-N204 PolarHBondContact N-OD1 2.93Å; V201-N204 WeakPolarHBondContact O-CB 3.33Å; V201-N204 PolarHBondContact O-ND2 2.99Å; V201-N204 VanDerWaalsContact O-ND2 3.08Å; S202-N204 PolarHBondContact O-N 2.82Å; S202-N204 PolarHBondContact O-ND2 2.9Å; N204-V206 HydrophobicContact CB-CG2 4.27Å; N204-H227 PolarHBondContact N-O 2.78Å; N204-N228 VanDerWaalsContact CA-OD1 3.31Å; N204-N228 WeakPolarHBondContact CA-OD1 3.29Å; N204-N228 WeakPolarHBondContact CB-OD1 3.16Å; N204-N228 PolarHBondContact N-OD1 2.81Å; N204-N228 PolarHBondContact O-OD1 3.17Å
205	R	94.7	Very high	91.1	Very high	120 Å²	120	44.1 Å²	44.1	45%	0.453	21%	0.212	S	C	.	.			trans	-119.6	26.3	179.4	-54.9	-174.6	174.7	167.2	-2.4	112.1	L183 A207 N228 M229	L183-R205 CarbonylContact O-C 3.14Å; L183-R205 VanDerWaalsContact O-C 3.25Å; L183-R205 WeakPolarHBondContact O-CA 3.11Å; L183-R205 PolarHBondContact O-N 3.15Å; R205-A207 PolarHBondContact O-N 3.46Å; R205-N228 PolarHBondContact N-OD1 3.25Å; R205-M229 HydrophobicContact CB-CE 3.59Å; R205-M229 HydrophobicContact CB-SD 4.13Å; R205-M229 HydrophobicContact CG-CE 3.53Å
206	V	94	Very high	90.8	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.012	20%	0.199	C	C	.	.			trans	-67	119.9	-176	-175.4	0	0	0	0	109.3	L183 S184 L186 N204 N228 M229 L230	L183-V206 PolarHBondContact O-N 3.08Å; S184-V206 WeakPolarHBondContact O-CA 3.34Å; L186-V206 HydrophobicContact CD2-CG2 4.29Å; L186-V206 HydrophobicContact CG-CG1 4.3Å; N204-V206 HydrophobicContact CB-CG2 4.27Å; V206-N228 HydrophobicContact CB-CB 4.28Å; V206-N228 WeakPolarHBondContact CB-OD1 3.49Å; V206-N228 WeakPolarHBondContact CG2-OD1 3.44Å; V206-N228 PolarHBondContact N-OD1 2.9Å; V206-M229 CarbonylContact O-C 3.24Å; V206-M229 VanDerWaalsContact O-C 3.27Å; V206-M229 WeakPolarHBondContact O-CA 3.26Å; V206-M229 PolarHBondContact O-N 2.99Å; V206-L230 HydrophobicContact CB-CD2 4.39Å; V206-L230 HydrophobicContact CG1-CD2 3.87Å; V206-L230 WeakPolarHBondContact O-CD2 3.44Å; V206-L230 PolarHBondContact O-N 3.27Å
207	A	92.2	Very high	90.7	Very high	49 Å²	49	40.4 Å²	40.4	41%	0.405	20%	0.199	S	C	.	.			trans	-92.7	-24.1	-173.1	0	0	0	0	0	114.5	R205 M229 L230 Q231	R205-A207 PolarHBondContact O-N 3.46Å; A207-M229 WeakPolarHBondContact CA-O 3.32Å; A207-L230 WeakPolarHBondContact O-CA 3.47Å; A207-Q231 PolarHBondContact O-N 3.3Å
208	S	90.4	Very high	90.4	Very high	58 Å²	58	44.4 Å²	44.4	41%	0.406	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	148.8	-180	63.6	0	0	0	0	111.4	Q213	S208-Q213 PolarHBondContact O-OE1 2.69Å
209	I	91	Very high	90.2	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	106.3	162.9	-54.4	175.9	0	0	0	107.2	L186 L214 L223 L230 G234 A237 F238 L249	L186-I209 HydrophobicContact CD1-CG1 4.47Å; I209-L214 HydrophobicContact CG2-CD1 4.26Å; I209-L214 HydrophobicContact CG2-CG 4.49Å; I209-L223 HydrophobicContact CD1-CD2 4.42Å; I209-L230 HydrophobicContact CD1-CD1 4.13Å; I209-L230 HydrophobicContact CG1-CD1 4.38Å; I209-L230 HydrophobicContact CG1-CD2 3.9Å; I209-G234 PolarHBondContact O-N 3.17Å; I209-A237 HydrophobicContact CG2-CB 4.1Å; I209-A237 WeakPolarHBondContact O-CB 3.31Å; I209-F238 HydrophobicContact CD1-CE1 4.49Å; I209-F238 HydrophobicContact CD1-CZ 4.34Å; I209-F238 HydrophobicContact CG2-CE1 4.45Å; I209-L249 HydrophobicContact CD1-CD2 4.32Å
210	G	85.6	Confident	90.1	Very high	18 Å²	18	44.8 Å²	44.8	19%	0.186	22%	0.217	C	C	.	.			trans	-102.3	179.5	-175.5	0	0	0	0	0	113.7	H212 Q213	G210-H212 PolarHBondContact O-N 3.08Å; G210-Q213 PolarHBondContact O-N 2.85Å
211	R	81.7	Confident	90	Very high	162 Å²	162	48.7 Å²	48.7	61%	0.611	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	134.6	-180	-167.4	178.8	-152.6	-155.6	5.2	112.2	Q213 D236	R211-Q213 PolarHBondContact O-N 2.94Å; R211-D236 HydrophobicContact CG-CB 4.01Å; R211-D236 IonicContact CZ-OD2 3.22Å; R211-D236 VanDerWaalsContact CZ-OD2 3.22Å; R211-D236 IonicContact NE-OD2 2.83Å; R211-D236 PolarHBondContact NE-OD2 2.9Å; R211-D236 IonicContact NH2-OD2 2.86Å; R211-D236 PolarHBondContact NH2-OD2 2.99Å
212	H	78.8	Confident	90.1	Very high	86 Å²	86	49.6 Å²	49.6	40%	0.398	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	8.3	176.7	-57.7	-44.9	0	0	0	116.9	G210 L214 K215 D240	G210-H212 PolarHBondContact O-N 3.08Å; H212-L214 PolarHBondContact O-N 3.33Å; H212-K215 HydrophobicContact CB-CB 4.12Å; H212-K215 HydrophobicContact CB-CD 4.16Å; H212-K215 WeakPolarHBondContact O-CB 3.04Å; H212-K215 PolarHBondContact O-N 2.82Å; H212-D240 WeakPolarHBondContact CA-OD2 3.38Å; H212-D240 IonicContact CE1-OD2 2.74Å; H212-D240 IonicContact CG-OD2 3.93Å; H212-D240 IonicContact ND1-OD1 3.53Å; H212-D240 IonicContact ND1-OD2 3.34Å; H212-D240 PolarHBondContact ND1-OD2 3.07Å
213	Q	84.6	Confident	90.1	Very high	39 Å²	39	49 Å²	49	18%	0.182	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-28.1	175.7	-71.2	-175.2	-20.4	0	0	112.3	S208 G210 R211	S208-Q213 PolarHBondContact O-OE1 2.69Å; G210-Q213 PolarHBondContact O-N 2.85Å; R211-Q213 PolarHBondContact O-N 2.94Å
214	L	88.3	Confident	90.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	7.9	177.2	-58.4	177.4	0	0	0	113.2	L186 L189 I209 H212 A216 V217 L223 F238 V241	L186-L214 HydrophobicContact CD1-CD2 4.2Å; L189-L214 HydrophobicContact CD1-CD2 3.81Å; I209-L214 HydrophobicContact CG2-CD1 4.26Å; I209-L214 HydrophobicContact CG2-CG 4.49Å; H212-L214 PolarHBondContact O-N 3.33Å; L214-A216 PolarHBondContact O-N 2.7Å; L214-A216 VanDerWaalsContact O-N 3.08Å; L214-V217 HydrophobicContact CB-CG2 4.04Å; L214-V217 HydrophobicContact CD2-CG2 4.09Å; L214-V217 VanDerWaalsContact O-CG2 3.28Å; L214-V217 WeakPolarHBondContact O-CG2 3.06Å; L214-V217 PolarHBondContact O-N 2.8Å; L214-L223 HydrophobicContact CD1-CD2 4.01Å; L214-F238 HydrophobicContact CD1-CD1 3.83Å; L214-F238 HydrophobicContact CD1-CE1 3.96Å; L214-V241 HydrophobicContact CB-CG1 3.79Å; L214-V241 HydrophobicContact CD1-CG1 4.41Å; L214-V241 HydrophobicContact CD1-CG2 4.09Å
215	K	84.7	Confident	90.2	Very high	112 Å²	112	45.7 Å²	45.7	49%	0.487	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-30.6	-177	-173.7	171	-178	176.5	0	114.1	H212 K218 D240	H212-K215 HydrophobicContact CB-CB 4.12Å; H212-K215 HydrophobicContact CB-CD 4.16Å; H212-K215 WeakPolarHBondContact O-CB 3.04Å; H212-K215 PolarHBondContact O-N 2.82Å; K215-K218 WeakPolarHBondContact O-CE 3.44Å; K215-K218 WeakPolarHBondContact O-CG 3.22Å; K215-D240 HydrophobicContact CB-CB 4.33Å; K215-D240 WeakPolarHBondContact CB-OD2 2.98Å
216	A	83.1	Confident	90.3	Very high	15 Å²	15	40.5 Å²	40.5	12%	0.124	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-27.9	179	0	0	0	0	0	114.4	L189 S190 L214	L189-A216 HydrophobicContact CB-CB 4.45Å; S190-A216 VanDerWaalsContact C-CB 3.41Å; S190-A216 WeakPolarHBondContact O-CB 3.45Å; L214-A216 PolarHBondContact O-N 2.7Å; L214-A216 VanDerWaalsContact O-N 3.08Å
217	V	88.9	Confident	90.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.222	C	C	.	.			trans	-114.7	48.9	-166.5	-69.3	0	0	0	0	111.9	L189 L196 L214 S219 L220 V241	L189-V217 HydrophobicContact CD1-CG2 4.46Å; L189-V217 HydrophobicContact CD2-CG1 4.11Å; L196-V217 HydrophobicContact CB-CG1 4.3Å; L196-V217 HydrophobicContact CD2-CG1 3.79Å; L214-V217 HydrophobicContact CB-CG2 4.04Å; L214-V217 HydrophobicContact CD2-CG2 4.09Å; L214-V217 VanDerWaalsContact O-CG2 3.28Å; L214-V217 WeakPolarHBondContact O-CG2 3.06Å; L214-V217 PolarHBondContact O-N 2.8Å; V217-S219 PolarHBondContact O-N 3.36Å; V217-L220 HydrophobicContact CB-CB 4.44Å; V217-L220 HydrophobicContact CG2-CB 4.48Å; V217-L220 HydrophobicContact CG2-CD2 4.32Å; V217-L220 WeakPolarHBondContact O-CB 3.38Å; V217-L220 PolarHBondContact O-N 3.27Å; V217-V241 HydrophobicContact CG2-CG1 4.34Å; V217-V241 WeakPolarHBondContact O-CG1 3.27Å
218	K	88.5	Confident	90.6	Very high	117 Å²	117	42.7 Å²	42.7	51%	0.509	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-18.3	-176.3	-56.9	-169.7	173.1	-171.9	0	115.4	K215 L220 D240 H243	K215-K218 WeakPolarHBondContact O-CE 3.44Å; K215-K218 WeakPolarHBondContact O-CG 3.22Å; K218-L220 VanDerWaalsContact C-N 3.31Å; K218-D240 WeakPolarHBondContact CG-O 3.05Å; K218-H243 PolarHBondContact O-ND1 3.31Å
219	S	91.4	Very high	90.8	Very high	28 Å²	28	43.7 Å²	43.7	20%	0.196	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-7.5	177	52.2	0	0	0	0	113.9	R194 L196 V217 R221	R194-S219 VanDerWaalsContact O-CB 3.22Å; R194-S219 WeakPolarHBondContact O-CB 3.48Å; R194-S219 PolarHBondContact O-OG 3.34Å; L196-S219 PolarHBondContact N-OG 3.21Å; L196-S219 CarbonylContact O-C 3.57Å; L196-S219 VanDerWaalsContact O-C 3.24Å; L196-S219 WeakPolarHBondContact O-CB 3.46Å; L196-S219 PolarHBondContact O-OG 3.49Å; V217-S219 PolarHBondContact O-N 3.36Å; S219-R221 PolarHBondContact O-N 3.4Å
220	L	93.9	Very high	91	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.205	C	C	.	.			trans	-61.3	129.4	-172.4	-162.2	72.1	0	0	0	110.9	L196 L199 V217 K218 L223 V241 H243 L244	L196-L220 HydrophobicContact CD2-CD1 4.31Å; L196-L220 HydrophobicContact CG-CD1 4.31Å; L196-L220 WeakPolarHBondContact O-CA 3.25Å; L196-L220 PolarHBondContact O-N 3.32Å; L199-L220 HydrophobicContact CB-CD1 3.62Å; L199-L220 HydrophobicContact CB-CD2 4.39Å; V217-L220 HydrophobicContact CB-CB 4.44Å; V217-L220 HydrophobicContact CG2-CB 4.48Å; V217-L220 HydrophobicContact CG2-CD2 4.32Å; V217-L220 WeakPolarHBondContact O-CB 3.38Å; V217-L220 PolarHBondContact O-N 3.27Å; K218-L220 VanDerWaalsContact C-N 3.31Å; L220-L223 HydrophobicContact CD2-CB 3.94Å; L220-L223 HydrophobicContact CD2-CD1 4.26Å; L220-L223 HydrophobicContact CD2-CG 4.47Å; L220-V241 HydrophobicContact CB-CG1 4.14Å; L220-H243 CarbonylContact O-C 3.37Å; L220-L244 HydrophobicContact CB-CD1 4.41Å; L220-L244 HydrophobicContact CD2-CD1 4.02Å; L220-L244 HydrophobicContact CG-CD1 3.99Å; L220-L244 WeakPolarHBondContact O-CA 3.48Å; L220-L244 PolarHBondContact O-N 3.14Å
221	R	95.7	Very high	91.3	Very high	110 Å²	110	48.9 Å²	48.9	42%	0.415	23%	0.225	S	C	.	.			trans	-113.1	-30.8	176.2	-62.1	-171.5	-175.8	-173.7	1.6	112.2	V197 S219 H243 R245 E246	V197-R221 HydrophobicContact CG1-CB 3.89Å; V197-R221 HydrophobicContact CG1-CG 3.98Å; V197-R221 PolarHBondContact O-N 2.63Å; S219-R221 PolarHBondContact O-N 3.4Å; R221-H243 HydrophobicContact CG-CB 4.5Å; R221-R245 PolarHBondContact O-N 3.02Å; R221-E246 PolarHBondContact O-N 3.42Å
222	V	97.2	Very high	91.4	Very high	20 Å²	20	43.6 Å²	43.6	12%	0.121	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	121.8	-178.7	-175.6	0	0	0	0	109.3	V197 T198 L199 V224 E246	V197-V222 PolarHBondContact O-N 3.17Å; T198-V222 WeakPolarHBondContact CA-O 3.04Å; T198-V222 HydrophobicContact CG2-CB 4.1Å; T198-V222 HydrophobicContact CG2-CG1 4.18Å; L199-V222 PolarHBondContact N-O 3.45Å; V222-V224 HydrophobicContact CG1-CG2 4.07Å; V222-E246 WeakPolarHBondContact CA-O 3.3Å; V222-E246 HydrophobicContact CB-CB 4.44Å; V222-E246 HydrophobicContact CG1-CB 4.17Å; V222-E246 HydrophobicContact CG1-CG 4.13Å; V222-E246 HydrophobicContact CG2-CB 4.16Å
223	L	96.7	Very high	92	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	117.3	172.1	178.5	58.9	0	0	0	109.9	L199 V201 I209 L214 L220 F238 L244 E246 L247 R248	L199-L223 HydrophobicContact CB-CD1 4.15Å; L199-L223 HydrophobicContact CD2-CD1 3.99Å; L199-L223 HydrophobicContact CG-CD1 4.07Å; L199-L223 WeakPolarHBondContact O-CA 3.41Å; V201-L223 HydrophobicContact CG2-CD1 4.49Å; I209-L223 HydrophobicContact CD1-CD2 4.42Å; L214-L223 HydrophobicContact CD1-CD2 4.01Å; L220-L223 HydrophobicContact CD2-CB 3.94Å; L220-L223 HydrophobicContact CD2-CD1 4.26Å; L220-L223 HydrophobicContact CD2-CG 4.47Å; L223-F238 HydrophobicContact CD2-CE1 4.04Å; L223-L244 HydrophobicContact CB-CD1 3.93Å; L223-E246 PolarHBondContact N-O 2.87Å; L223-L247 HydrophobicContact CB-CD1 3.98Å; L223-L247 HydrophobicContact CD2-CD1 3.87Å; L223-L247 HydrophobicContact CG-CD1 4.03Å; L223-R248 PolarHBondContact O-N 2.64Å
224	V	97.4	Very high	92.1	Very high	21 Å²	21	39.5 Å²	39.5	13%	0.127	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	107.1	175.3	-175.5	0	0	0	0	108.7	L199 D200 V201 S202 V222 R248	L199-V224 PolarHBondContact O-N 3.22Å; D200-V224 HydrophobicContact CB-CB 4.18Å; V201-V224 WeakPolarHBondContact CG2-O 3.45Å; V201-V224 PolarHBondContact N-O 3.46Å; S202-V224 PolarHBondContact N-O 3.32Å; V222-V224 HydrophobicContact CG1-CG2 4.07Å; V224-R248 HydrophobicContact CG1-CB 4.23Å; V224-R248 HydrophobicContact CG2-CB 4.47Å; V224-R248 HydrophobicContact CG2-CG 4.44Å
225	A	96.2	Very high	91.8	Very high	2 Å²	2	45 Å²	45	2%	0.017	23%	0.234	C	C	.	.			trans	-126.4	28.3	179.6	0	0	0	0	0	111.7	V201 N228 L230 R248 L249 N252	V201-A225 HydrophobicContact CG2-CB 3.85Å; A225-N228 PolarHBondContact O-ND2 3.33Å; A225-L230 HydrophobicContact CB-CD1 4.43Å; A225-R248 CarbonylContact C-O 3.14Å; A225-R248 PolarHBondContact N-O 3.26Å; A225-L249 HydrophobicContact CB-CD2 4Å; A225-N252 PolarHBondContact O-ND2 2.75Å; A225-N252 VanDerWaalsContact O-ND2 3.13Å
226	A	95.6	Very high	91.9	Very high	11 Å²	11	42 Å²	42	9%	0.091	22%	0.224	C	C	.	.			trans	-64.3	157.7	176.6	0	0	0	0	0	112.7	S202 R203 N228 R248 A250	S202-A226 CarbonylContact C-O 3Å; S202-A226 WeakPolarHBondContact CA-O 3.43Å; S202-A226 VanDerWaalsContact CB-O 3.23Å; S202-A226 WeakPolarHBondContact CB-O 3.36Å; R203-A226 PolarHBondContact N-O 2.82Å; A226-N228 PolarHBondContact O-N 3.46Å; A226-N228 PolarHBondContact O-ND2 2.98Å; A226-R248 PolarHBondContact N-O 3.25Å; A226-A250 CarbonylContact C-O 3.05Å; A226-A250 WeakPolarHBondContact CA-O 3.45Å; A226-A250 HydrophobicContact CB-CB 4.1Å; A226-A250 WeakPolarHBondContact CB-O 3.49Å
227	H	97	Very high	92.1	Very high	84 Å²	84	41.3 Å²	41.3	39%	0.389	22%	0.218	S	C	.	.	S	Bend	trans	55.4	48	179.1	-61.2	-80.8	0	0	0	113.5	R203 N204 A250 A251	R203-H227 WeakPolarHBondContact CA-O 3.34Å; R203-H227 HydrophobicContact CB-CB 4.31Å; R203-H227 HydrophobicContact CG-CB 3.64Å; R203-H227 PolarHBondContact N-O 2.96Å; N204-H227 PolarHBondContact N-O 2.78Å; H227-A250 PolarHBondContact N-O 2.87Å; H227-A251 WeakPolarHBondContact CA-O 3.42Å; H227-A251 HydrophobicContact CB-CB 4.48Å; H227-A251 VanDerWaalsContact CE1-CB 3.48Å; H227-A251 WeakPolarHBondContact CE1-CB 3.45Å; H227-A251 PolarHBondContact N-O 2.65Å; H227-A251 VanDerWaalsContact ND1-CB 3.27Å; H227-A251 WeakPolarHBondContact ND1-CB 3.27Å
228	N	95.4	Very high	92.2	Very high	12 Å²	12	41.5 Å²	41.5	6%	0.064	22%	0.219	C	C	.	.	S	Bend	trans	-116.5	-165.4	175.4	-87.5	-74.9	0	0	0	110	V201 N204 R205 V206 A225 A226 L230 A251 N252	V201-N228 PolarHBondContact O-ND2 3Å; N204-N228 VanDerWaalsContact CA-OD1 3.31Å; N204-N228 WeakPolarHBondContact CA-OD1 3.29Å; N204-N228 WeakPolarHBondContact CB-OD1 3.16Å; N204-N228 PolarHBondContact N-OD1 2.81Å; N204-N228 PolarHBondContact O-OD1 3.17Å; R205-N228 PolarHBondContact N-OD1 3.25Å; V206-N228 HydrophobicContact CB-CB 4.28Å; V206-N228 WeakPolarHBondContact CB-OD1 3.49Å; V206-N228 WeakPolarHBondContact CG2-OD1 3.44Å; V206-N228 PolarHBondContact N-OD1 2.9Å; A225-N228 PolarHBondContact O-ND2 3.33Å; A226-N228 PolarHBondContact O-N 3.46Å; A226-N228 PolarHBondContact O-ND2 2.98Å; N228-L230 HydrophobicContact CB-CG 4.19Å; N228-A251 PolarHBondContact N-O 3.43Å; N228-N252 VanDerWaalsContact CA-OD1 3.25Å; N228-N252 WeakPolarHBondContact CA-OD1 3.15Å; N228-N252 WeakPolarHBondContact CB-OD1 3.45Å; N228-N252 PolarHBondContact N-OD1 2.84Å; N228-N252 PolarHBondContact O-OD1 3.2Å
229	M	94.9	Very high	92.2	Very high	80 Å²	80	40.4 Å²	40.4	39%	0.394	22%	0.218	S	C	.	.			trans	-110.7	29.1	178.7	-58.1	176.2	-165.9	0	0	111.1	R205 V206 A207 Q231 N252	R205-M229 HydrophobicContact CB-CE 3.59Å; R205-M229 HydrophobicContact CB-SD 4.13Å; R205-M229 HydrophobicContact CG-CE 3.53Å; V206-M229 CarbonylContact O-C 3.24Å; V206-M229 VanDerWaalsContact O-C 3.27Å; V206-M229 WeakPolarHBondContact O-CA 3.26Å; V206-M229 PolarHBondContact O-N 2.99Å; A207-M229 WeakPolarHBondContact CA-O 3.32Å; M229-Q231 PolarHBondContact O-N 3.43Å; M229-N252 PolarHBondContact N-OD1 2.97Å
230	L	94.8	Very high	91.9	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.215	C	C	.	.			trans	-66	111.6	-174.2	-61.3	174.3	0	0	0	110.1	V206 A207 I209 A225 N228 L249 N252 L253 L254	V206-L230 HydrophobicContact CB-CD2 4.39Å; V206-L230 HydrophobicContact CG1-CD2 3.87Å; V206-L230 WeakPolarHBondContact O-CD2 3.44Å; V206-L230 PolarHBondContact O-N 3.27Å; A207-L230 WeakPolarHBondContact O-CA 3.47Å; I209-L230 HydrophobicContact CD1-CD1 4.13Å; I209-L230 HydrophobicContact CG1-CD1 4.38Å; I209-L230 HydrophobicContact CG1-CD2 3.9Å; A225-L230 HydrophobicContact CB-CD1 4.43Å; N228-L230 HydrophobicContact CB-CG 4.19Å; L230-L249 HydrophobicContact CD1-CD2 3.64Å; L230-N252 HydrophobicContact CB-CB 4Å; L230-N252 VanDerWaalsContact CB-OD1 3.26Å; L230-N252 WeakPolarHBondContact CB-OD1 3.48Å; L230-N252 VanDerWaalsContact CG-OD1 3.28Å; L230-N252 WeakPolarHBondContact CG-OD1 3.43Å; L230-N252 PolarHBondContact N-OD1 3.04Å; L230-L253 CarbonylContact O-C 3.5Å; L230-L253 VanDerWaalsContact O-CA 3.32Å; L230-L253 WeakPolarHBondContact O-CA 3.27Å; L230-L253 PolarHBondContact O-N 3.46Å; L230-L254 HydrophobicContact CB-CD2 4.09Å; L230-L254 HydrophobicContact CB-CG 4.49Å; L230-L254 PolarHBondContact O-N 2.79Å
231	Q	91.6	Very high	91.8	Very high	128 Å²	128	40.2 Å²	40.2	60%	0.598	22%	0.215	S	C	*	.			trans	-93.1	-32.1	175.2	-65.5	179	12	0	0	111.9	A207 M229 L253	A207-Q231 PolarHBondContact O-N 3.3Å; M229-Q231 PolarHBondContact O-N 3.43Å; Q231-L253 HydrophobicContact CG-CB 4Å; Q231-L253 HydrophobicContact CG-CD1 4.05Å
232	A	85.6	Confident	91.4	Very high	51 Å²	51	39.4 Å²	39.4	42%	0.421	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	154.7	179.8	0	0	0	0	0	111.8
233	I	90.6	Very high	91.1	Very high	10 Å²	10	43.5 Å²	43.5	5%	0.051	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	125.9	171.5	-64.7	172.6	0	0	0	106.3	A237 F238 L249 L254 V257	I233-A237 HydrophobicContact CG2-CB 3.81Å; I233-F238 HydrophobicContact CD1-CE2 4.37Å; I233-F238 HydrophobicContact CG2-CD2 4.19Å; I233-F238 HydrophobicContact CG2-CE2 3.52Å; I233-F238 HydrophobicContact CG2-CZ 4.22Å; I233-L249 HydrophobicContact CD1-CD1 3.63Å; I233-L254 HydrophobicContact CD1-CD1 4.13Å; I233-L254 HydrophobicContact CD1-CD2 4.25Å; I233-L254 HydrophobicContact CG1-CD2 4.04Å; I233-V257 HydrophobicContact CD1-CG1 4.16Å; I233-V257 HydrophobicContact CD1-CG2 4.41Å
234	G	86.1	Confident	91.1	Very high	29 Å²	29	43.5 Å²	43.5	30%	0.299	24%	0.24	S	C	.	.			trans	-67	151.2	179	0	0	0	0	0	112.8	I209 D236 A237	I209-G234 PolarHBondContact O-N 3.17Å; G234-D236 VanDerWaalsContact C-N 3.25Å; G234-D236 PolarHBondContact O-N 3.28Å; G234-A237 WeakPolarHBondContact O-CB 3.16Å; G234-A237 PolarHBondContact O-N 2.64Å
235	D	83.7	Confident	91	Very high	114 Å²	114	46.4 Å²	46.4	61%	0.61	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-32.2	-174.6	-61.6	-30.7	0	0	0	114	A258 S259	D235-A258 WeakPolarHBondContact OD1-CB 3.41Å; D235-S259 WeakPolarHBondContact O-CB 3.2Å; D235-S259 PolarHBondContact O-OG 3.34Å
236	D	84.9	Confident	91.1	Very high	51 Å²	51	47.7 Å²	47.7	27%	0.273	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	19.3	178.7	-60.1	-7.4	0	0	0	111.8	R211 G234 F238 D239	R211-D236 HydrophobicContact CG-CB 4.01Å; R211-D236 IonicContact CZ-OD2 3.22Å; R211-D236 VanDerWaalsContact CZ-OD2 3.22Å; R211-D236 IonicContact NE-OD2 2.83Å; R211-D236 PolarHBondContact NE-OD2 2.9Å; R211-D236 IonicContact NH2-OD2 2.86Å; R211-D236 PolarHBondContact NH2-OD2 2.99Å; G234-D236 VanDerWaalsContact C-N 3.25Å; G234-D236 PolarHBondContact O-N 3.28Å; D236-F238 VanDerWaalsContact C-N 3.25Å; D236-F238 PolarHBondContact O-N 2.83Å; D236-D239 WeakPolarHBondContact CB-OD2 3.23Å
237	A	88.1	Confident	91.2	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-30.8	-170.2	0	0	0	0	0	113.6	I209 I233 G234	I209-A237 HydrophobicContact CG2-CB 4.1Å; I209-A237 WeakPolarHBondContact O-CB 3.31Å; I233-A237 HydrophobicContact CG2-CB 3.81Å; G234-A237 WeakPolarHBondContact O-CB 3.16Å; G234-A237 PolarHBondContact O-N 2.64Å
238	F	91.5	Very high	91.2	Very high	4 Å²	4	46.2 Å²	46.2	2%	0.018	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.6	2.4	-173.9	-60.3	-66	0	0	0	114.5	I209 L214 L223 I233 D236 D240 V241 L244 L247 L260 P261	I209-F238 HydrophobicContact CD1-CE1 4.49Å; I209-F238 HydrophobicContact CD1-CZ 4.34Å; I209-F238 HydrophobicContact CG2-CE1 4.45Å; L214-F238 HydrophobicContact CD1-CD1 3.83Å; L214-F238 HydrophobicContact CD1-CE1 3.96Å; L223-F238 HydrophobicContact CD2-CE1 4.04Å; I233-F238 HydrophobicContact CD1-CE2 4.37Å; I233-F238 HydrophobicContact CG2-CD2 4.19Å; I233-F238 HydrophobicContact CG2-CE2 3.52Å; I233-F238 HydrophobicContact CG2-CZ 4.22Å; D236-F238 VanDerWaalsContact C-N 3.25Å; D236-F238 PolarHBondContact O-N 2.83Å; F238-D240 PolarHBondContact O-N 3.23Å; F238-D240 VanDerWaalsContact O-N 3.12Å; F238-V241 HydrophobicContact CB-CG2 4Å; F238-V241 HydrophobicContact CD1-CG2 3.96Å; F238-V241 HydrophobicContact CG-CG2 4.49Å; F238-V241 VanDerWaalsContact O-CG2 3.28Å; F238-V241 WeakPolarHBondContact O-CG2 3.5Å; F238-V241 PolarHBondContact O-N 3Å; F238-L244 HydrophobicContact CD1-CD2 4.28Å; F238-L247 HydrophobicContact CE1-CD1 4.29Å; F238-L247 HydrophobicContact CE1-CD2 4.29Å; F238-L247 HydrophobicContact CE2-CD2 4.1Å; F238-L247 HydrophobicContact CZ-CD1 4.27Å; F238-L247 HydrophobicContact CZ-CD2 3.82Å; F238-L260 HydrophobicContact CE2-CD2 4.09Å; F238-P261 HydrophobicContact CB-CG 4Å; F238-P261 HydrophobicContact CG-CG 4.3Å
239	D	88.3	Confident	91.3	Very high	93 Å²	93	45.7 Å²	45.7	50%	0.497	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-31	-176.8	-72.6	6	0	0	0	113	D236 V242	D236-D239 WeakPolarHBondContact CB-OD2 3.23Å; D239-V242 WeakPolarHBondContact O-CG2 3.27Å
240	D	85.5	Confident	91.4	Very high	25 Å²	25	42.3 Å²	42.3	13%	0.134	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-17.1	-179.7	-70	-62.3	0	0	0	113.8	H212 K215 K218 F238	H212-D240 WeakPolarHBondContact CA-OD2 3.38Å; H212-D240 IonicContact CE1-OD2 2.74Å; H212-D240 IonicContact CG-OD2 3.93Å; H212-D240 IonicContact ND1-OD1 3.53Å; H212-D240 IonicContact ND1-OD2 3.34Å; H212-D240 PolarHBondContact ND1-OD2 3.07Å; K215-D240 HydrophobicContact CB-CB 4.33Å; K215-D240 WeakPolarHBondContact CB-OD2 2.98Å; K218-D240 WeakPolarHBondContact CG-O 3.05Å; F238-D240 PolarHBondContact O-N 3.23Å; F238-D240 VanDerWaalsContact O-N 3.12Å
241	V	90.3	Very high	91.5	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.235	C	C	.	.			trans	-112	58.5	-174.9	-69.4	0	0	0	0	112.2	L214 V217 L220 F238 H243 L244	L214-V241 HydrophobicContact CB-CG1 3.79Å; L214-V241 HydrophobicContact CD1-CG1 4.41Å; L214-V241 HydrophobicContact CD1-CG2 4.09Å; V217-V241 HydrophobicContact CG2-CG1 4.34Å; V217-V241 WeakPolarHBondContact O-CG1 3.27Å; L220-V241 HydrophobicContact CB-CG1 4.14Å; F238-V241 HydrophobicContact CB-CG2 4Å; F238-V241 HydrophobicContact CD1-CG2 3.96Å; F238-V241 HydrophobicContact CG-CG2 4.49Å; F238-V241 VanDerWaalsContact O-CG2 3.28Å; F238-V241 WeakPolarHBondContact O-CG2 3.5Å; F238-V241 PolarHBondContact O-N 3Å; V241-H243 PolarHBondContact O-N 3.41Å; V241-H243 VanDerWaalsContact O-N 3.08Å; V241-L244 HydrophobicContact CB-CB 4.49Å; V241-L244 HydrophobicContact CG2-CB 4.4Å; V241-L244 HydrophobicContact CG2-CD2 4.37Å; V241-L244 VanDerWaalsContact O-CB 3.3Å; V241-L244 WeakPolarHBondContact O-CB 3.07Å; V241-L244 PolarHBondContact O-N 2.94Å
242	V	87.8	Confident	91.8	Very high	93 Å²	93	37.8 Å²	37.8	56%	0.564	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-21.3	-175.4	-172	0	0	0	0	113.7	D239	D239-V242 WeakPolarHBondContact O-CG2 3.27Å
243	H	91.7	Very high	92.3	Very high	106 Å²	106	38 Å²	38	49%	0.491	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	3.7	179.5	-58.6	102.7	0	0	0	114.1	K218 L220 R221 V241 R245	K218-H243 PolarHBondContact O-ND1 3.31Å; L220-H243 CarbonylContact O-C 3.37Å; R221-H243 HydrophobicContact CG-CB 4.5Å; V241-H243 PolarHBondContact O-N 3.41Å; V241-H243 VanDerWaalsContact O-N 3.08Å; H243-R245 PolarHBondContact O-N 3.45Å
244	L	95.4	Very high	92.5	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.2	C	C	.	.			trans	-63.6	122.4	-179.1	-159.7	73.1	0	0	0	110.2	L220 L223 F238 V241 L247 P261 L264	L220-L244 HydrophobicContact CB-CD1 4.41Å; L220-L244 HydrophobicContact CD2-CD1 4.02Å; L220-L244 HydrophobicContact CG-CD1 3.99Å; L220-L244 WeakPolarHBondContact O-CA 3.48Å; L220-L244 PolarHBondContact O-N 3.14Å; L223-L244 HydrophobicContact CB-CD1 3.93Å; F238-L244 HydrophobicContact CD1-CD2 4.28Å; V241-L244 HydrophobicContact CB-CB 4.49Å; V241-L244 HydrophobicContact CG2-CB 4.4Å; V241-L244 HydrophobicContact CG2-CD2 4.37Å; V241-L244 VanDerWaalsContact O-CB 3.3Å; V241-L244 WeakPolarHBondContact O-CB 3.07Å; V241-L244 PolarHBondContact O-N 2.94Å; L244-L247 HydrophobicContact CD2-CB 4.17Å; L244-L247 HydrophobicContact CD2-CD1 4.28Å; L244-L247 HydrophobicContact CD2-CD2 4.4Å; L244-P261 HydrophobicContact CB-CG 4.18Å; L244-P261 HydrophobicContact CD2-CG 3.88Å; L244-L264 HydrophobicContact CB-CD2 4.33Å; L244-L264 HydrophobicContact CD2-CD2 4.11Å; L244-L264 HydrophobicContact CG-CD2 3.96Å
245	R	96.7	Very high	92.9	Very high	81 Å²	81	39.2 Å²	39.2	31%	0.306	20%	0.204	S	C	.	.			trans	-110.3	-30.7	179.6	-61.6	-55.5	-175.5	-179.5	-1.7	112.4	R221 H243 Q263 L264 E265 Q266	R221-R245 PolarHBondContact O-N 3.02Å; H243-R245 PolarHBondContact O-N 3.45Å; R245-Q263 WeakPolarHBondContact CD-O 3.28Å; R245-Q263 PolarHBondContact NH1-O 2.81Å; R245-L264 VanDerWaalsContact C-CD2 3.48Å; R245-E265 WeakPolarHBondContact CD-OE1 3.48Å; R245-E265 IonicContact NE-OE1 2.9Å; R245-E265 PolarHBondContact O-N 3.42Å; R245-Q266 PolarHBondContact O-N 2.9Å
246	E	97.8	Very high	93.3	Very high	30 Å²	30	38.3 Å²	38.3	14%	0.14	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	127.1	-178.7	179.9	173.8	170.8	0	0	110.8	R221 V222 L223 R248 Q266	R221-E246 PolarHBondContact O-N 3.42Å; V222-E246 WeakPolarHBondContact CA-O 3.3Å; V222-E246 HydrophobicContact CB-CB 4.44Å; V222-E246 HydrophobicContact CG1-CB 4.17Å; V222-E246 HydrophobicContact CG1-CG 4.13Å; V222-E246 HydrophobicContact CG2-CB 4.16Å; L223-E246 PolarHBondContact N-O 2.87Å; E246-R248 HydrophobicContact CG-CG 4.41Å; E246-R248 IonicContact OE1-CZ 3.87Å; E246-R248 IonicContact OE1-NE 3.29Å; E246-R248 PolarHBondContact OE1-NE 3.39Å; E246-R248 IonicContact OE1-NH2 3.06Å; E246-R248 PolarHBondContact OE1-NH2 2.81Å; E246-Q266 WeakPolarHBondContact CA-O 3.4Å; E246-Q266 HydrophobicContact CB-CB 4.26Å; E246-Q266 HydrophobicContact CG-CB 4.04Å
247	L	97.8	Very high	93.7	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	116	179	178.3	59.7	0	0	0	109.9	L223 F238 L244 L249 L260 L264 Q266 L267 D268	L223-L247 HydrophobicContact CB-CD1 3.98Å; L223-L247 HydrophobicContact CD2-CD1 3.87Å; L223-L247 HydrophobicContact CG-CD1 4.03Å; F238-L247 HydrophobicContact CE1-CD1 4.29Å; F238-L247 HydrophobicContact CE1-CD2 4.29Å; F238-L247 HydrophobicContact CE2-CD2 4.1Å; F238-L247 HydrophobicContact CZ-CD1 4.27Å; F238-L247 HydrophobicContact CZ-CD2 3.82Å; L244-L247 HydrophobicContact CD2-CB 4.17Å; L244-L247 HydrophobicContact CD2-CD1 4.28Å; L244-L247 HydrophobicContact CD2-CD2 4.4Å; L247-L249 HydrophobicContact CD1-CD1 4.11Å; L247-L249 HydrophobicContact CD1-CD2 4.08Å; L247-L249 HydrophobicContact CD1-CG 3.89Å; L247-L249 HydrophobicContact CD2-CD1 3.8Å; L247-L249 HydrophobicContact CD2-CG 4.42Å; L247-L249 HydrophobicContact CG-CD1 3.84Å; L247-L249 HydrophobicContact CG-CG 3.91Å; L247-L260 HydrophobicContact CD2-CD2 3.63Å; L247-L264 HydrophobicContact CB-CD1 4.05Å; L247-L264 HydrophobicContact CB-CD2 3.78Å; L247-L264 HydrophobicContact CD2-CD1 4.08Å; L247-Q266 PolarHBondContact N-O 3.07Å; L247-L267 HydrophobicContact CB-CD1 4.32Å; L247-L267 HydrophobicContact CD2-CD1 4.22Å; L247-L267 HydrophobicContact CG-CD1 4.35Å; L247-D268 PolarHBondContact O-N 3.45Å
248	R	97.8	Very high	93.6	Very high	64 Å²	64	39.1 Å²	39.1	24%	0.242	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	114.7	176.9	-56.9	-170.1	-172	-171.8	1.1	110.9	L223 V224 A225 A226 E246 D268	L223-R248 PolarHBondContact O-N 2.64Å; V224-R248 HydrophobicContact CG1-CB 4.23Å; V224-R248 HydrophobicContact CG2-CB 4.47Å; V224-R248 HydrophobicContact CG2-CG 4.44Å; A225-R248 CarbonylContact C-O 3.14Å; A225-R248 PolarHBondContact N-O 3.26Å; A226-R248 PolarHBondContact N-O 3.25Å; E246-R248 HydrophobicContact CG-CG 4.41Å; E246-R248 IonicContact OE1-CZ 3.87Å; E246-R248 IonicContact OE1-NE 3.29Å; E246-R248 PolarHBondContact OE1-NE 3.39Å; E246-R248 IonicContact OE1-NH2 3.06Å; E246-R248 PolarHBondContact OE1-NH2 2.81Å; R248-D268 HydrophobicContact CB-CB 4.37Å; R248-D268 HydrophobicContact CG-CB 4.23Å
249	L	97.2	Very high	93.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.221	C	C	.	.			trans	-124.6	21.4	-177.5	-64.4	169.4	0	0	0	111.7	I209 A225 L230 I233 L247 N252 L254 D268 L269 N272	I209-L249 HydrophobicContact CD1-CD2 4.32Å; A225-L249 HydrophobicContact CB-CD2 4Å; L230-L249 HydrophobicContact CD1-CD2 3.64Å; I233-L249 HydrophobicContact CD1-CD1 3.63Å; L247-L249 HydrophobicContact CD1-CD1 4.11Å; L247-L249 HydrophobicContact CD1-CD2 4.08Å; L247-L249 HydrophobicContact CD1-CG 3.89Å; L247-L249 HydrophobicContact CD2-CD1 3.8Å; L247-L249 HydrophobicContact CD2-CG 4.42Å; L247-L249 HydrophobicContact CG-CD1 3.84Å; L247-L249 HydrophobicContact CG-CG 3.91Å; L249-N252 PolarHBondContact O-ND2 3.02Å; L249-L254 HydrophobicContact CB-CD1 4.32Å; L249-L254 HydrophobicContact CD1-CD1 4.48Å; L249-D268 PolarHBondContact N-O 3.49Å; L249-L269 HydrophobicContact CB-CD2 4.09Å; L249-L269 HydrophobicContact CD1-CD2 3.95Å; L249-N272 PolarHBondContact O-ND2 3.39Å
250	A	96.8	Very high	93.7	Very high	10 Å²	10	35.5 Å²	35.5	8%	0.083	20%	0.198	C	C	.	.			trans	-57.5	152.4	-179.1	0	0	0	0	0	112.8	A226 H227 N252 S270	A226-A250 CarbonylContact C-O 3.05Å; A226-A250 WeakPolarHBondContact CA-O 3.45Å; A226-A250 HydrophobicContact CB-CB 4.1Å; A226-A250 WeakPolarHBondContact CB-O 3.49Å; H227-A250 PolarHBondContact N-O 2.87Å; A250-N252 PolarHBondContact O-ND2 2.96Å; A250-S270 CarbonylContact C-O 3.48Å; A250-S270 WeakPolarHBondContact CA-O 3.47Å; A250-S270 VanDerWaalsContact CB-OG 3.28Å; A250-S270 WeakPolarHBondContact CB-OG 3.4Å
251	A	97.2	Very high	93.9	Very high	26 Å²	26	35 Å²	35	22%	0.215	20%	0.196	C	C	.	.	S	Bend	trans	55.9	55.7	174.9	0	0	0	0	0	113	H227 N228 S270 A271	H227-A251 WeakPolarHBondContact CA-O 3.42Å; H227-A251 HydrophobicContact CB-CB 4.48Å; H227-A251 VanDerWaalsContact CE1-CB 3.48Å; H227-A251 WeakPolarHBondContact CE1-CB 3.45Å; H227-A251 PolarHBondContact N-O 2.65Å; H227-A251 VanDerWaalsContact ND1-CB 3.27Å; H227-A251 WeakPolarHBondContact ND1-CB 3.27Å; N228-A251 PolarHBondContact N-O 3.43Å; A251-S270 PolarHBondContact N-O 2.84Å; A251-A271 WeakPolarHBondContact CA-O 3.39Å; A251-A271 HydrophobicContact CB-CB 4.08Å; A251-A271 PolarHBondContact N-O 3Å
252	N	96.3	Very high	93.9	Very high	6 Å²	6	39.9 Å²	39.9	3%	0.032	22%	0.218	C	C	.	.	S	Bend	trans	-124.5	-169.5	174.6	-84.5	-75.9	0	0	0	109.6	A225 N228 M229 L230 L249 A250 L254 A271 N272	A225-N252 PolarHBondContact O-ND2 2.75Å; A225-N252 VanDerWaalsContact O-ND2 3.13Å; N228-N252 VanDerWaalsContact CA-OD1 3.25Å; N228-N252 WeakPolarHBondContact CA-OD1 3.15Å; N228-N252 WeakPolarHBondContact CB-OD1 3.45Å; N228-N252 PolarHBondContact N-OD1 2.84Å; N228-N252 PolarHBondContact O-OD1 3.2Å; M229-N252 PolarHBondContact N-OD1 2.97Å; L230-N252 HydrophobicContact CB-CB 4Å; L230-N252 VanDerWaalsContact CB-OD1 3.26Å; L230-N252 WeakPolarHBondContact CB-OD1 3.48Å; L230-N252 VanDerWaalsContact CG-OD1 3.28Å; L230-N252 WeakPolarHBondContact CG-OD1 3.43Å; L230-N252 PolarHBondContact N-OD1 3.04Å; L249-N252 PolarHBondContact O-ND2 3.02Å; A250-N252 PolarHBondContact O-ND2 2.96Å; N252-L254 HydrophobicContact CB-CG 4.23Å; N252-A271 PolarHBondContact N-O 2.6Å; N252-N272 WeakPolarHBondContact CA-OD1 3.44Å; N252-N272 WeakPolarHBondContact CB-OD1 3.04Å; N252-N272 PolarHBondContact N-OD1 3Å; N252-N272 PolarHBondContact O-OD1 2.66Å
253	L	96.3	Very high	94.1	Very high	56 Å²	56	38.6 Å²	38.6	29%	0.293	21%	0.206	S	C	.	.			trans	-109.2	25.5	-177.8	-58	174.4	0	0	0	111.7	L230 Q231 T255 W273	L230-L253 CarbonylContact O-C 3.5Å; L230-L253 VanDerWaalsContact O-CA 3.32Å; L230-L253 WeakPolarHBondContact O-CA 3.27Å; L230-L253 PolarHBondContact O-N 3.46Å; Q231-L253 HydrophobicContact CG-CB 4Å; Q231-L253 HydrophobicContact CG-CD1 4.05Å; L253-T255 PolarHBondContact O-N 3.11Å; L253-W273 HydrophobicContact CD2-CH2 4.05Å; L253-W273 HydrophobicContact CD2-CZ2 3.69Å
254	L	96.1	Very high	94.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.182	C	C	.	.			trans	-71.1	121.9	-173.2	-60.9	170.5	0	0	0	110.6	L230 I233 L249 N252 V257 L269 N272 W273 L274	L230-L254 HydrophobicContact CB-CD2 4.09Å; L230-L254 HydrophobicContact CB-CG 4.49Å; L230-L254 PolarHBondContact O-N 2.79Å; I233-L254 HydrophobicContact CD1-CD1 4.13Å; I233-L254 HydrophobicContact CD1-CD2 4.25Å; I233-L254 HydrophobicContact CG1-CD2 4.04Å; L249-L254 HydrophobicContact CB-CD1 4.32Å; L249-L254 HydrophobicContact CD1-CD1 4.48Å; N252-L254 HydrophobicContact CB-CG 4.23Å; L254-V257 HydrophobicContact CD1-CG2 4.19Å; L254-L269 HydrophobicContact CD1-CD2 4.27Å; L254-N272 HydrophobicContact CB-CB 4.26Å; L254-N272 VanDerWaalsContact CB-OD1 3.3Å; L254-N272 WeakPolarHBondContact CB-OD1 3.41Å; L254-N272 WeakPolarHBondContact CG-OD1 3.21Å; L254-N272 PolarHBondContact N-OD1 3.23Å; L254-N272 VanDerWaalsContact N-OD1 3.11Å; L254-W273 CarbonylContact O-C 3.53Å; L254-W273 VanDerWaalsContact O-C 3.32Å; L254-W273 WeakPolarHBondContact O-CA 3.47Å; L254-W273 PolarHBondContact O-N 3.12Å; L254-L274 HydrophobicContact CB-CD2 4.35Å; L254-L274 PolarHBondContact O-N 3.36Å
255	T	94.4	Very high	94.4	Very high	65 Å²	65	36.6 Å²	36.6	40%	0.399	20%	0.197	S	C	.	.	S	Bend	trans	-98.4	-24.1	170.5	54.3	0	0	0	0	112.4	L253 W273 P275	L253-T255 PolarHBondContact O-N 3.11Å; T255-W273 HydrophobicContact CG2-CB 4.02Å; T255-W273 HydrophobicContact CG2-CE3 4.21Å; T255-P275 WeakPolarHBondContact O-CD 3.29Å
256	T	92.1	Very high	94.5	Very high	94 Å²	94	36.2 Å²	36.2	58%	0.577	20%	0.198	S	C	*	.			trans	-147.5	148.9	179	58.2	0	0	0	0	110.1
257	V	92.9	Very high	94.5	Very high	9 Å²	9	34.8 Å²	34.8	6%	0.055	19%	0.192	C	C	.	.			trans	-130	108.1	172.9	179.9	0	0	0	0	108.4	I233 L254 L260 L269 L274 P278	I233-V257 HydrophobicContact CD1-CG1 4.16Å; I233-V257 HydrophobicContact CD1-CG2 4.41Å; L254-V257 HydrophobicContact CD1-CG2 4.19Å; V257-L260 HydrophobicContact CG1-CD1 3.91Å; V257-L260 HydrophobicContact CG1-CD2 3.85Å; V257-L260 HydrophobicContact CG1-CG 3.6Å; V257-L269 HydrophobicContact CG2-CD2 4.28Å; V257-L274 HydrophobicContact CG2-CD2 4.17Å; V257-P278 HydrophobicContact CB-CB 4.12Å; V257-P278 HydrophobicContact CB-CG 3.93Å; V257-P278 HydrophobicContact CG2-CG 4.33Å
258	A	87	Confident	94.5	Very high	59 Å²	59	36 Å²	36	49%	0.488	20%	0.198	S	C	.	.			trans	-85.9	-34.1	-176.2	0	0	0	0	0	112.9	D235	D235-A258 WeakPolarHBondContact OD1-CB 3.41Å
259	S	87.5	Confident	94.5	Very high	18 Å²	18	32.9 Å²	32.9	13%	0.126	19%	0.186	C	C	.	.			trans	-133	132.8	-174.4	-176.6	0	0	0	0	112.4	D235	D235-S259 WeakPolarHBondContact O-CB 3.2Å; D235-S259 PolarHBondContact O-OG 3.34Å
260	L	92.6	Very high	94.6	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.021	19%	0.191	C	C	.	.			trans	-146.1	145.9	173.1	-69.7	177.4	0	0	0	108.7	F238 L247 V257 F262 L267 V280	F238-L260 HydrophobicContact CE2-CD2 4.09Å; L247-L260 HydrophobicContact CD2-CD2 3.63Å; V257-L260 HydrophobicContact CG1-CD1 3.91Å; V257-L260 HydrophobicContact CG1-CD2 3.85Å; V257-L260 HydrophobicContact CG1-CG 3.6Å; L260-F262 PolarHBondContact O-N 2.93Å; L260-L267 HydrophobicContact CD1-CD1 4.11Å; L260-L267 HydrophobicContact CD1-CD2 3.55Å; L260-L267 HydrophobicContact CD1-CG 4.5Å; L260-L267 HydrophobicContact CD2-CD1 4.36Å; L260-V280 HydrophobicContact CB-CG1 3.92Å; L260-V280 HydrophobicContact CB-CG2 4.25Å; L260-V280 HydrophobicContact CD1-CG1 3.76Å; L260-V280 HydrophobicContact CG-CG1 3.91Å
261	P	90.8	Very high	94.6	Very high	15 Å²	15	34.6 Å²	34.6	10%	0.097	20%	0.199	C	C	.	.			trans	-68.3	127.6	176.9	16.4	-17.2	0	0	0	111.3	F238 L244 Q263 L264	F238-P261 HydrophobicContact CB-CG 4Å; F238-P261 HydrophobicContact CG-CG 4.3Å; L244-P261 HydrophobicContact CB-CG 4.18Å; L244-P261 HydrophobicContact CD2-CG 3.88Å; P261-Q263 PolarHBondContact O-N 3.21Å; P261-Q263 VanDerWaalsContact O-N 3.1Å; P261-L264 HydrophobicContact CB-CG 4.42Å; P261-L264 HydrophobicContact CG-CD1 3.84Å; P261-L264 HydrophobicContact CG-CD2 4.24Å; P261-L264 HydrophobicContact CG-CG 3.8Å; P261-L264 WeakPolarHBondContact O-CG 3.44Å; P261-L264 PolarHBondContact O-N 3.04Å
262	F	90.3	Very high	94.6	Very high	101 Å²	101	33.5 Å²	33.5	44%	0.443	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-15.8	-177	-52.9	-59.5	0	0	0	114.6	L260 V280 R283	L260-F262 PolarHBondContact O-N 2.93Å; F262-V280 HydrophobicContact CD1-CG2 4.33Å; F262-V280 HydrophobicContact CE1-CG2 3.71Å; F262-R283 HydrophobicContact CD1-CB 3.78Å; F262-R283 HydrophobicContact CE1-CB 3.81Å; F262-R283 HydrophobicContact CE1-CG 4.5Å
263	Q	91.5	Very high	94.6	Very high	67 Å²	67	38.2 Å²	38.2	31%	0.313	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-0.8	-176.5	-71.2	-65.5	-36.2	0	0	113.9	R245 P261 H286	R245-Q263 WeakPolarHBondContact CD-O 3.28Å; R245-Q263 PolarHBondContact NH1-O 2.81Å; P261-Q263 PolarHBondContact O-N 3.21Å; P261-Q263 VanDerWaalsContact O-N 3.1Å; Q263-H286 PolarHBondContact OE1-CD2 3.49Å; Q263-H286 PolarHBondContact OE1-NE2 2.89Å
264	L	96.2	Very high	94.6	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.194	C	C	.	.			trans	-63.4	136.9	179.1	-72.4	168.9	0	0	0	111.5	L244 R245 L247 P261 L267 M284 H286 L287	L244-L264 HydrophobicContact CB-CD2 4.33Å; L244-L264 HydrophobicContact CD2-CD2 4.11Å; L244-L264 HydrophobicContact CG-CD2 3.96Å; R245-L264 VanDerWaalsContact C-CD2 3.48Å; L247-L264 HydrophobicContact CB-CD1 4.05Å; L247-L264 HydrophobicContact CB-CD2 3.78Å; L247-L264 HydrophobicContact CD2-CD1 4.08Å; P261-L264 HydrophobicContact CB-CG 4.42Å; P261-L264 HydrophobicContact CG-CD1 3.84Å; P261-L264 HydrophobicContact CG-CD2 4.24Å; P261-L264 HydrophobicContact CG-CG 3.8Å; P261-L264 WeakPolarHBondContact O-CG 3.44Å; P261-L264 PolarHBondContact O-N 3.04Å; L264-L267 HydrophobicContact CD1-CD1 4.26Å; L264-M284 HydrophobicContact CB-CE 3.45Å; L264-M284 VanDerWaalsContact CB-CE 3.45Å; L264-M284 HydrophobicContact CD1-CE 3.67Å; L264-M284 HydrophobicContact CG-CE 4.08Å; L264-H286 CarbonylContact O-C 3.33Å; L264-L287 WeakPolarHBondContact O-CA 3.25Å; L264-L287 PolarHBondContact O-N 3.39Å
265	E	97.7	Very high	94.6	Very high	64 Å²	64	39.1 Å²	39.1	30%	0.299	22%	0.216	S	C	.	.	S	Bend	trans	-99.7	-29.3	172.4	-64.5	174.4	-157.2	0	0	110.8	R245 H286 Q288 Y289	R245-E265 WeakPolarHBondContact CD-OE1 3.48Å; R245-E265 IonicContact NE-OE1 2.9Å; R245-E265 PolarHBondContact O-N 3.42Å; E265-H286 HydrophobicContact CG-CB 4.46Å; E265-Q288 WeakPolarHBondContact O-CA 3.46Å; E265-Q288 PolarHBondContact O-N 2.78Å; E265-Y289 PolarHBondContact O-N 2.93Å
266	Q	98.3	Very high	94.6	Very high	73 Å²	73	39.6 Å²	39.6	34%	0.341	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	125.6	-179.9	-53.9	-169.7	25.8	0	0	111	R245 E246 L247 Y289	R245-Q266 PolarHBondContact O-N 2.9Å; E246-Q266 WeakPolarHBondContact CA-O 3.4Å; E246-Q266 HydrophobicContact CB-CB 4.26Å; E246-Q266 HydrophobicContact CG-CB 4.04Å; L247-Q266 PolarHBondContact N-O 3.07Å; Q266-Y289 HydrophobicContact CB-CD1 4.44Å
267	L	98.1	Very high	94.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	121.8	178.6	178.6	63	0	0	0	110.1	L247 L260 L264 L269 I281 M284 L287 Y289 L290 N291	L247-L267 HydrophobicContact CB-CD1 4.32Å; L247-L267 HydrophobicContact CD2-CD1 4.22Å; L247-L267 HydrophobicContact CG-CD1 4.35Å; L260-L267 HydrophobicContact CD1-CD1 4.11Å; L260-L267 HydrophobicContact CD1-CD2 3.55Å; L260-L267 HydrophobicContact CD1-CG 4.5Å; L260-L267 HydrophobicContact CD2-CD1 4.36Å; L264-L267 HydrophobicContact CD1-CD1 4.26Å; L267-L269 HydrophobicContact CD1-CD1 4.34Å; L267-L269 HydrophobicContact CD1-CD2 4.32Å; L267-L269 HydrophobicContact CD1-CG 3.98Å; L267-L269 HydrophobicContact CD2-CD1 3.89Å; L267-L269 HydrophobicContact CD2-CG 4.34Å; L267-L269 HydrophobicContact CG-CD1 4.13Å; L267-L269 HydrophobicContact CG-CG 4.02Å; L267-I281 HydrophobicContact CD2-CD1 4.18Å; L267-I281 HydrophobicContact CD2-CG1 4.2Å; L267-M284 HydrophobicContact CD2-CE 4.36Å; L267-M284 HydrophobicContact CD2-SD 4.36Å; L267-L287 HydrophobicContact CB-CD1 3.93Å; L267-Y289 PolarHBondContact N-O 3.1Å; L267-L290 HydrophobicContact CB-CD1 4.21Å; L267-L290 HydrophobicContact CD2-CD1 3.92Å; L267-L290 HydrophobicContact CG-CD1 4.18Å; L267-L290 WeakPolarHBondContact O-CA 3.41Å; L267-N291 PolarHBondContact O-N 3.35Å
268	D	98.2	Very high	94.9	Very high	24 Å²	24	36.4 Å²	36.4	13%	0.128	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	112	173.8	-177.1	5	0	0	0	110.4	L247 R248 L249 S270 Y289 N291	L247-D268 PolarHBondContact O-N 3.45Å; R248-D268 HydrophobicContact CB-CB 4.37Å; R248-D268 HydrophobicContact CG-CB 4.23Å; L249-D268 PolarHBondContact N-O 3.49Å; D268-S270 VanDerWaalsContact OD1-CB 3.27Å; D268-S270 WeakPolarHBondContact OD1-CB 3.45Å; D268-S270 PolarHBondContact OD1-N 3.19Å; D268-S270 PolarHBondContact OD1-OG 3.18Å; D268-Y289 HydrophobicContact CB-CE1 4.49Å; D268-N291 HydrophobicContact CB-CB 4.38Å; D268-N291 PolarHBondContact OD1-ND2 3.3Å
269	L	98.2	Very high	95.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.216	C	C	.	.			trans	-117.3	18.5	177.5	-68.9	171.7	0	0	0	111.3	L249 L254 V257 L267 N272 L274 P278 N291 L292 N295	L249-L269 HydrophobicContact CB-CD2 4.09Å; L249-L269 HydrophobicContact CD1-CD2 3.95Å; L254-L269 HydrophobicContact CD1-CD2 4.27Å; V257-L269 HydrophobicContact CG2-CD2 4.28Å; L267-L269 HydrophobicContact CD1-CD1 4.34Å; L267-L269 HydrophobicContact CD1-CD2 4.32Å; L267-L269 HydrophobicContact CD1-CG 3.98Å; L267-L269 HydrophobicContact CD2-CD1 3.89Å; L267-L269 HydrophobicContact CD2-CG 4.34Å; L267-L269 HydrophobicContact CG-CD1 4.13Å; L267-L269 HydrophobicContact CG-CG 4.02Å; L269-N272 PolarHBondContact O-ND2 3.07Å; L269-L274 HydrophobicContact CB-CD1 4.11Å; L269-L274 HydrophobicContact CD1-CD1 4.21Å; L269-P278 HydrophobicContact CD1-CG 4.15Å; L269-N291 PolarHBondContact N-O 3.13Å; L269-L292 HydrophobicContact CB-CD2 4.07Å; L269-L292 HydrophobicContact CD1-CD2 4.01Å; L269-N295 PolarHBondContact O-ND2 2.71Å
270	S	97.9	Very high	95.3	Very high	15 Å²	15	38.6 Å²	38.6	11%	0.105	21%	0.214	C	C	.	.			trans	-62.8	160.9	-176.8	58.6	0	0	0	0	113.6	A250 A251 D268 N272 S293	A250-S270 CarbonylContact C-O 3.48Å; A250-S270 WeakPolarHBondContact CA-O 3.47Å; A250-S270 VanDerWaalsContact CB-OG 3.28Å; A250-S270 WeakPolarHBondContact CB-OG 3.4Å; A251-S270 PolarHBondContact N-O 2.84Å; D268-S270 VanDerWaalsContact OD1-CB 3.27Å; D268-S270 WeakPolarHBondContact OD1-CB 3.45Å; D268-S270 PolarHBondContact OD1-N 3.19Å; D268-S270 PolarHBondContact OD1-OG 3.18Å; S270-N272 VanDerWaalsContact C-N 3.33Å; S270-N272 PolarHBondContact O-N 2.97Å; S270-N272 PolarHBondContact O-ND2 3.1Å; S270-S293 CarbonylContact C-O 3.51Å; S270-S293 WeakPolarHBondContact CA-O 3.46Å; S270-S293 WeakPolarHBondContact CB-O 3.45Å; S270-S293 WeakPolarHBondContact CB-OG 3.13Å
271	A	97.5	Very high	95.4	Very high	30 Å²	30	38.5 Å²	38.5	25%	0.248	21%	0.213	C	C	.	.	S	Bend	trans	52.9	48.4	178.2	0	0	0	0	0	112.7	A251 N252 S293 D294	A251-A271 WeakPolarHBondContact CA-O 3.39Å; A251-A271 HydrophobicContact CB-CB 4.08Å; A251-A271 PolarHBondContact N-O 3Å; N252-A271 PolarHBondContact N-O 2.6Å; A271-S293 PolarHBondContact N-O 2.94Å; A271-D294 CarbonylContact C-O 3.57Å; A271-D294 WeakPolarHBondContact CA-O 3.22Å; A271-D294 HydrophobicContact CB-CB 4.29Å; A271-D294 PolarHBondContact N-O 3.39Å; A271-D294 VanDerWaalsContact N-O 3.16Å
272	N	97.1	Very high	95.4	Very high	4 Å²	4	39 Å²	39	2%	0.021	22%	0.221	C	C	.	.	S	Bend	trans	-123.5	-174.7	174.5	-82.4	-79	0	0	0	109.7	L249 N252 L254 L269 S270 L274 D294 N295	L249-N272 PolarHBondContact O-ND2 3.39Å; N252-N272 WeakPolarHBondContact CA-OD1 3.44Å; N252-N272 WeakPolarHBondContact CB-OD1 3.04Å; N252-N272 PolarHBondContact N-OD1 3Å; N252-N272 PolarHBondContact O-OD1 2.66Å; L254-N272 HydrophobicContact CB-CB 4.26Å; L254-N272 VanDerWaalsContact CB-OD1 3.3Å; L254-N272 WeakPolarHBondContact CB-OD1 3.41Å; L254-N272 WeakPolarHBondContact CG-OD1 3.21Å; L254-N272 PolarHBondContact N-OD1 3.23Å; L254-N272 VanDerWaalsContact N-OD1 3.11Å; L269-N272 PolarHBondContact O-ND2 3.07Å; S270-N272 VanDerWaalsContact C-N 3.33Å; S270-N272 PolarHBondContact O-N 2.97Å; S270-N272 PolarHBondContact O-ND2 3.1Å; N272-L274 HydrophobicContact CB-CG 4.21Å; N272-D294 PolarHBondContact N-O 3.41Å; N272-N295 WeakPolarHBondContact CA-OD1 3.47Å; N272-N295 VanDerWaalsContact CB-OD1 3.23Å; N272-N295 WeakPolarHBondContact CB-OD1 3.41Å; N272-N295 PolarHBondContact O-OD1 2.95Å; N272-N295 VanDerWaalsContact O-OD1 3.12Å
273	W	96.1	Very high	95.5	Very high	104 Å²	104	42.9 Å²	42.9	39%	0.394	23%	0.233	S	C	.	.			trans	-108.9	30.1	-177.5	-62.7	-1.4	0	0	0	112.2	L253 L254 T255 P275	L253-W273 HydrophobicContact CD2-CH2 4.05Å; L253-W273 HydrophobicContact CD2-CZ2 3.69Å; L254-W273 CarbonylContact O-C 3.53Å; L254-W273 VanDerWaalsContact O-C 3.32Å; L254-W273 WeakPolarHBondContact O-CA 3.47Å; L254-W273 PolarHBondContact O-N 3.12Å; T255-W273 HydrophobicContact CG2-CB 4.02Å; T255-W273 HydrophobicContact CG2-CE3 4.21Å; W273-P275 WeakPolarHBondContact O-CD 3.21Å
274	L	96.6	Very high	95.6	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	22%	0.218	C	C	.	.			trans	-68.7	121.5	-175.8	-58.8	173.8	0	0	0	110.6	L254 V257 L269 N272 P278 L292 N295 R296 L297	L254-L274 HydrophobicContact CB-CD2 4.35Å; L254-L274 PolarHBondContact O-N 3.36Å; V257-L274 HydrophobicContact CG2-CD2 4.17Å; L269-L274 HydrophobicContact CB-CD1 4.11Å; L269-L274 HydrophobicContact CD1-CD1 4.21Å; N272-L274 HydrophobicContact CB-CG 4.21Å; L274-P278 HydrophobicContact CD1-CG 4.34Å; L274-L292 HydrophobicContact CD1-CD2 4.43Å; L274-N295 HydrophobicContact CB-CB 4.37Å; L274-N295 VanDerWaalsContact CB-OD1 3.28Å; L274-N295 WeakPolarHBondContact CB-OD1 3.46Å; L274-N295 WeakPolarHBondContact CG-OD1 3.41Å; L274-N295 PolarHBondContact N-OD1 2.75Å; L274-R296 CarbonylContact O-C 3.51Å; L274-R296 WeakPolarHBondContact O-CA 3.23Å; L274-R296 PolarHBondContact O-N 2.68Å; L274-L297 PolarHBondContact O-N 3.5Å
275	P	96.2	Very high	95.5	Very high	74 Å²	74	40.9 Å²	40.9	48%	0.481	23%	0.23	S	C	.	.	S	Bend	trans	-81.3	-23	175.6	32.8	-33.8	0	0	0	112.6	T255 W273	T255-P275 WeakPolarHBondContact O-CD 3.29Å; W273-P275 WeakPolarHBondContact O-CD 3.21Å
276	S	95	Very high	95.4	Very high	75 Å²	75	41.9 Å²	41.9	52%	0.524	24%	0.235	S	C	.	.	S	Bend	trans	-146.6	160.6	-179.8	63.3	0	0	0	0	110.9	L297	S276-L297 VanDerWaalsContact CA-CD2 3.44Å
277	V	95.3	Very high	95.4	Very high	28 Å²	28	38.4 Å²	38.4	17%	0.17	22%	0.219	C	C	.	.			trans	-63.8	130.7	175.3	-175.5	0	0	0	0	109.9	S279 I281 L292 L297 F300	V277-S279 PolarHBondContact O-N 2.93Å; V277-I281 HydrophobicContact CG1-CB 4.47Å; V277-I281 HydrophobicContact CG1-CD1 3.77Å; V277-L292 HydrophobicContact CG1-CD1 4.19Å; V277-L292 HydrophobicContact CG2-CD1 4.12Å; V277-L297 HydrophobicContact CG2-CD1 4.34Å; V277-L297 HydrophobicContact CG2-CD2 4.44Å; V277-F300 HydrophobicContact CG2-CD2 3.59Å; V277-F300 HydrophobicContact CG2-CE2 3.71Å
278	P	94.5	Very high	95.4	Very high	8 Å²	8	41.3 Å²	41.3	5%	0.052	23%	0.233	C	C	.	.			trans	-56.7	126.9	174.3	-27.6	35	0	0	0	112.6	V257 L269 L274 V280 I281	V257-P278 HydrophobicContact CB-CB 4.12Å; V257-P278 HydrophobicContact CB-CG 3.93Å; V257-P278 HydrophobicContact CG2-CG 4.33Å; L269-P278 HydrophobicContact CD1-CG 4.15Å; L274-P278 HydrophobicContact CD1-CG 4.34Å; P278-V280 HydrophobicContact CB-CG1 4.08Å; P278-V280 PolarHBondContact O-N 2.78Å; P278-V280 VanDerWaalsContact O-N 3.16Å; P278-I281 HydrophobicContact CB-CD1 4.19Å; P278-I281 HydrophobicContact CB-CG1 4.36Å; P278-I281 HydrophobicContact CG-CD1 4.22Å; P278-I281 WeakPolarHBondContact O-CB 3.26Å; P278-I281 PolarHBondContact O-N 3.04Å; P278-I281 VanDerWaalsContact O-N 3.09Å
279	S	91.5	Very high	95.4	Very high	110 Å²	110	43.6 Å²	43.6	77%	0.769	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-62.2	-25.9	-176	57.4	0	0	0	0	113.8	V277 I281 G282	V277-S279 PolarHBondContact O-N 2.93Å; S279-I281 PolarHBondContact O-N 3.25Å; S279-G282 PolarHBondContact O-N 3.23Å
280	V	91.8	Very high	95.4	Very high	13 Å²	13	43.6 Å²	43.6	8%	0.079	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-59.6	-27.5	176.1	70.6	0	0	0	0	112.8	L260 F262 P278 G282 R283	L260-V280 HydrophobicContact CB-CG1 3.92Å; L260-V280 HydrophobicContact CB-CG2 4.25Å; L260-V280 HydrophobicContact CD1-CG1 3.76Å; L260-V280 HydrophobicContact CG-CG1 3.91Å; F262-V280 HydrophobicContact CD1-CG2 4.33Å; F262-V280 HydrophobicContact CE1-CG2 3.71Å; P278-V280 HydrophobicContact CB-CG1 4.08Å; P278-V280 PolarHBondContact O-N 2.78Å; P278-V280 VanDerWaalsContact O-N 3.16Å; V280-G282 PolarHBondContact O-N 3.01Å; V280-R283 PolarHBondContact O-N 3.24Å
281	I	94.8	Very high	95.4	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-60	-31.6	176	-65.6	171.9	0	0	0	111.1	L267 V277 P278 S279 R283 M284 L287 L290 L305	L267-I281 HydrophobicContact CD2-CD1 4.18Å; L267-I281 HydrophobicContact CD2-CG1 4.2Å; V277-I281 HydrophobicContact CG1-CB 4.47Å; V277-I281 HydrophobicContact CG1-CD1 3.77Å; P278-I281 HydrophobicContact CB-CD1 4.19Å; P278-I281 HydrophobicContact CB-CG1 4.36Å; P278-I281 HydrophobicContact CG-CD1 4.22Å; P278-I281 WeakPolarHBondContact O-CB 3.26Å; P278-I281 PolarHBondContact O-N 3.04Å; P278-I281 VanDerWaalsContact O-N 3.09Å; S279-I281 PolarHBondContact O-N 3.25Å; I281-R283 PolarHBondContact O-N 3.26Å; I281-M284 HydrophobicContact CB-SD 4.29Å; I281-M284 HydrophobicContact CG1-SD 3.99Å; I281-M284 PolarHBondContact O-N 3.15Å; I281-L287 HydrophobicContact CG2-CD2 4.19Å; I281-L290 HydrophobicContact CD1-CD1 4.15Å; I281-L290 HydrophobicContact CD1-CD2 4.41Å; I281-L290 HydrophobicContact CG2-CD2 4.11Å; I281-L305 HydrophobicContact CG2-CD2 3.95Å
282	G	91.6	Very high	95.5	Very high	26 Å²	26	42.1 Å²	42.1	27%	0.268	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-56.6	-13.1	174.1	0	0	0	0	0	115.8	S279 V280 C304 E307	S279-G282 PolarHBondContact O-N 3.23Å; V280-G282 PolarHBondContact O-N 3.01Å; G282-C304 WeakPolarHBondContact CA-O 3.4Å; G282-C304 PolarHBondContact N-O 2.77Å; G282-E307 WeakPolarHBondContact O-CG 3.38Å
283	R	91.2	Very high	95.5	Very high	182 Å²	182	42.7 Å²	42.7	69%	0.687	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-112.4	3	-178.9	-59.8	-176.4	-178.6	-176.5	1.1	113.6	F262 V280 I281 G285	F262-R283 HydrophobicContact CD1-CB 3.78Å; F262-R283 HydrophobicContact CE1-CB 3.81Å; F262-R283 HydrophobicContact CE1-CG 4.5Å; V280-R283 PolarHBondContact O-N 3.24Å; I281-R283 PolarHBondContact O-N 3.26Å; R283-G285 PolarHBondContact O-N 2.87Å
284	M	93.9	Very high	95.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.234	C	C	.	.			trans	-92.1	82.9	-170.6	-61	177.9	76	0	0	111.9	L264 L267 I281 H286 L287 S308	L264-M284 HydrophobicContact CB-CE 3.45Å; L264-M284 VanDerWaalsContact CB-CE 3.45Å; L264-M284 HydrophobicContact CD1-CE 3.67Å; L264-M284 HydrophobicContact CG-CE 4.08Å; L267-M284 HydrophobicContact CD2-CE 4.36Å; L267-M284 HydrophobicContact CD2-SD 4.36Å; I281-M284 HydrophobicContact CB-SD 4.29Å; I281-M284 HydrophobicContact CG1-SD 3.99Å; I281-M284 PolarHBondContact O-N 3.15Å; M284-H286 VanDerWaalsContact C-N 3.26Å; M284-H286 PolarHBondContact O-N 2.92Å; M284-L287 HydrophobicContact CB-CB 4.23Å; M284-L287 HydrophobicContact CE-CD1 4.06Å; M284-L287 PolarHBondContact O-N 2.84Å; M284-S308 WeakPolarHBondContact O-CB 3.49Å
285	G	94.1	Very high	95.7	Very high	25 Å²	25	42.2 Å²	42.2	26%	0.258	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-4.6	-176.4	0	0	0	0	0	116.8	R283 T311	R283-G285 PolarHBondContact O-N 2.87Å; G285-T311 VanDerWaalsContact O-CG2 3.28Å; G285-T311 WeakPolarHBondContact O-CG2 3.31Å; G285-T311 PolarHBondContact O-OG1 2.97Å
286	H	96.2	Very high	95.7	Very high	85 Å²	85	43 Å²	43	39%	0.394	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-1.5	-179.7	-64.7	-72	0	0	0	113.8	Q263 L264 E265 M284 Q288	Q263-H286 PolarHBondContact OE1-CD2 3.49Å; Q263-H286 PolarHBondContact OE1-NE2 2.89Å; L264-H286 CarbonylContact O-C 3.33Å; E265-H286 HydrophobicContact CG-CB 4.46Å; M284-H286 VanDerWaalsContact C-N 3.26Å; M284-H286 PolarHBondContact O-N 2.92Å; H286-Q288 PolarHBondContact O-N 3.05Å
287	L	97.9	Very high	95.8	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.205	C	C	.	.			trans	-65.2	126.5	-172.1	-166.1	67.5	0	0	0	110.7	L264 L267 I281 M284 L290 T311 V312	L264-L287 WeakPolarHBondContact O-CA 3.25Å; L264-L287 PolarHBondContact O-N 3.39Å; L267-L287 HydrophobicContact CB-CD1 3.93Å; I281-L287 HydrophobicContact CG2-CD2 4.19Å; M284-L287 HydrophobicContact CB-CB 4.23Å; M284-L287 HydrophobicContact CE-CD1 4.06Å; M284-L287 PolarHBondContact O-N 2.84Å; L287-L290 HydrophobicContact CD2-CB 3.98Å; L287-L290 HydrophobicContact CD2-CD1 4.35Å; L287-L290 HydrophobicContact CD2-CD2 4.05Å; L287-L290 HydrophobicContact CD2-CG 4.35Å; L287-T311 CarbonylContact O-C 3.08Å; L287-T311 VanDerWaalsContact O-CB 3.31Å; L287-T311 WeakPolarHBondContact O-CB 3.39Å; L287-T311 PolarHBondContact O-OG1 2.93Å; L287-V312 WeakPolarHBondContact O-CA 3.34Å; L287-V312 PolarHBondContact O-N 2.9Å
288	Q	97.9	Very high	95.8	Very high	62 Å²	62	43.7 Å²	43.7	29%	0.29	22%	0.222	S	C	.	.			trans	-114.1	-33.6	178.5	-63.8	-175.2	48.8	0	0	112.2	E265 H286 K313 V314	E265-Q288 WeakPolarHBondContact O-CA 3.46Å; E265-Q288 PolarHBondContact O-N 2.78Å; H286-Q288 PolarHBondContact O-N 3.05Å; Q288-K313 PolarHBondContact O-N 2.89Å; Q288-V314 PolarHBondContact O-N 3.35Å; Q288-V314 VanDerWaalsContact O-N 3.08Å
289	Y	98.3	Very high	95.8	Very high	72 Å²	72	47.9 Å²	47.9	28%	0.282	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	125.1	179.4	178	-85.1	0	0	0	109.9	E265 Q266 L267 D268 N291 V314	E265-Y289 PolarHBondContact O-N 2.93Å; Q266-Y289 HydrophobicContact CB-CD1 4.44Å; L267-Y289 PolarHBondContact N-O 3.1Å; D268-Y289 HydrophobicContact CB-CE1 4.49Å; Y289-N291 HydrophobicContact CE1-CB 3.62Å; Y289-N291 PolarHBondContact OH-ND2 3.03Å; Y289-V314 HydrophobicContact CD2-CB 3.76Å; Y289-V314 HydrophobicContact CD2-CG1 3.83Å; Y289-V314 HydrophobicContact CD2-CG2 4.35Å; Y289-V314 HydrophobicContact CE2-CB 4.32Å; Y289-V314 HydrophobicContact CE2-CG1 3.86Å
290	L	98.4	Very high	96	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	117.6	175.3	179.8	57.1	0	0	0	110.3	L267 I281 L287 L292 L305 V314 L315 D316	L267-L290 HydrophobicContact CB-CD1 4.21Å; L267-L290 HydrophobicContact CD2-CD1 3.92Å; L267-L290 HydrophobicContact CG-CD1 4.18Å; L267-L290 WeakPolarHBondContact O-CA 3.41Å; I281-L290 HydrophobicContact CD1-CD1 4.15Å; I281-L290 HydrophobicContact CD1-CD2 4.41Å; I281-L290 HydrophobicContact CG2-CD2 4.11Å; L287-L290 HydrophobicContact CD2-CB 3.98Å; L287-L290 HydrophobicContact CD2-CD1 4.35Å; L287-L290 HydrophobicContact CD2-CD2 4.05Å; L287-L290 HydrophobicContact CD2-CG 4.35Å; L290-L292 HydrophobicContact CD1-CD1 4.38Å; L290-L292 HydrophobicContact CD1-CD2 4.28Å; L290-L292 HydrophobicContact CD1-CG 4.01Å; L290-L292 HydrophobicContact CD2-CD1 3.98Å; L290-L292 HydrophobicContact CD2-CG 4.44Å; L290-L292 HydrophobicContact CG-CD1 4.14Å; L290-L292 HydrophobicContact CG-CG 4.06Å; L290-L305 HydrophobicContact CD2-CD2 3.88Å; L290-V314 PolarHBondContact N-O 3.49Å; L290-L315 HydrophobicContact CB-CD1 4.02Å; L290-L315 HydrophobicContact CD2-CD1 3.82Å; L290-L315 HydrophobicContact CG-CD1 3.94Å; L290-L315 WeakPolarHBondContact O-CA 3.42Å; L290-D316 PolarHBondContact O-N 2.82Å
291	N	98.5	Very high	96	Very high	13 Å²	13	44.4 Å²	44.4	7%	0.07	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	116	173.4	-172.5	-2.1	0	0	0	110.6	L267 D268 L269 Y289 S293 D316	L267-N291 PolarHBondContact O-N 3.35Å; D268-N291 HydrophobicContact CB-CB 4.38Å; D268-N291 PolarHBondContact OD1-ND2 3.3Å; L269-N291 PolarHBondContact N-O 3.13Å; Y289-N291 HydrophobicContact CE1-CB 3.62Å; Y289-N291 PolarHBondContact OH-ND2 3.03Å; N291-S293 VanDerWaalsContact OD1-CB 3.27Å; N291-S293 WeakPolarHBondContact OD1-CB 3.47Å; N291-S293 PolarHBondContact OD1-N 2.85Å; N291-S293 PolarHBondContact OD1-OG 3.24Å; N291-D316 HydrophobicContact CB-CB 4.47Å
292	L	98.4	Very high	95.9	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.212	C	C	.	.			trans	-120.6	17	176.1	-64.9	169	0	0	0	111.1	L269 L274 V277 L290 N295 L297 F300 D316 L317 N320	L269-L292 HydrophobicContact CB-CD2 4.07Å; L269-L292 HydrophobicContact CD1-CD2 4.01Å; L274-L292 HydrophobicContact CD1-CD2 4.43Å; V277-L292 HydrophobicContact CG1-CD1 4.19Å; V277-L292 HydrophobicContact CG2-CD1 4.12Å; L290-L292 HydrophobicContact CD1-CD1 4.38Å; L290-L292 HydrophobicContact CD1-CD2 4.28Å; L290-L292 HydrophobicContact CD1-CG 4.01Å; L290-L292 HydrophobicContact CD2-CD1 3.98Å; L290-L292 HydrophobicContact CD2-CG 4.44Å; L290-L292 HydrophobicContact CG-CD1 4.14Å; L290-L292 HydrophobicContact CG-CG 4.06Å; L292-N295 PolarHBondContact O-ND2 2.9Å; L292-N295 VanDerWaalsContact O-ND2 3.15Å; L292-L297 HydrophobicContact CB-CD1 4.04Å; L292-L297 HydrophobicContact CD1-CD1 4.34Å; L292-F300 HydrophobicContact CD1-CE2 4.08Å; L292-D316 CarbonylContact C-O 3.5Å; L292-D316 PolarHBondContact N-O 3.24Å; L292-L317 HydrophobicContact CB-CD2 4.12Å; L292-L317 HydrophobicContact CD1-CD2 4.02Å; L292-N320 PolarHBondContact O-ND2 2.92Å
293	S	98	Very high	95.9	Very high	16 Å²	16	45.3 Å²	45.3	11%	0.112	21%	0.211	C	C	.	.			trans	-63.6	158.3	-178.5	62.2	0	0	0	0	112.5	S270 A271 N291 N295 D316 S318	S270-S293 CarbonylContact C-O 3.51Å; S270-S293 WeakPolarHBondContact CA-O 3.46Å; S270-S293 WeakPolarHBondContact CB-O 3.45Å; S270-S293 WeakPolarHBondContact CB-OG 3.13Å; A271-S293 PolarHBondContact N-O 2.94Å; N291-S293 VanDerWaalsContact OD1-CB 3.27Å; N291-S293 WeakPolarHBondContact OD1-CB 3.47Å; N291-S293 PolarHBondContact OD1-N 2.85Å; N291-S293 PolarHBondContact OD1-OG 3.24Å; S293-N295 PolarHBondContact O-N 2.64Å; S293-N295 PolarHBondContact O-ND2 2.74Å; S293-D316 PolarHBondContact N-O 2.94Å; S293-S318 CarbonylContact C-O 3.44Å; S293-S318 WeakPolarHBondContact CA-O 3.34Å; S293-S318 VanDerWaalsContact CB-O 3.24Å; S293-S318 WeakPolarHBondContact CB-O 3.26Å
294	D	97.9	Very high	96	Very high	87 Å²	87	37.9 Å²	37.9	47%	0.465	19%	0.186	S	C	.	.	S	Bend	trans	54.1	53.1	177.6	-164	23.5	0	0	0	112.7	A271 N272 S318 R319	A271-D294 CarbonylContact C-O 3.57Å; A271-D294 WeakPolarHBondContact CA-O 3.22Å; A271-D294 HydrophobicContact CB-CB 4.29Å; A271-D294 PolarHBondContact N-O 3.39Å; A271-D294 VanDerWaalsContact N-O 3.16Å; N272-D294 PolarHBondContact N-O 3.41Å; D294-S318 PolarHBondContact N-O 3.13Å; D294-R319 VanDerWaalsContact CA-O 3.25Å; D294-R319 WeakPolarHBondContact CA-O 3.04Å; D294-R319 HydrophobicContact CB-CB 4.2Å; D294-R319 PolarHBondContact N-O 3.32Å
295	N	97.9	Very high	96	Very high	10 Å²	10	37.9 Å²	37.9	5%	0.053	19%	0.186	C	C	.	.	S	Bend	trans	-125.7	-165.2	175.9	-86.6	-82.3	0	0	0	109.5	L269 N272 L274 L292 S293 L297 N320	L269-N295 PolarHBondContact O-ND2 2.71Å; N272-N295 WeakPolarHBondContact CA-OD1 3.47Å; N272-N295 VanDerWaalsContact CB-OD1 3.23Å; N272-N295 WeakPolarHBondContact CB-OD1 3.41Å; N272-N295 PolarHBondContact O-OD1 2.95Å; N272-N295 VanDerWaalsContact O-OD1 3.12Å; L274-N295 HydrophobicContact CB-CB 4.37Å; L274-N295 VanDerWaalsContact CB-OD1 3.28Å; L274-N295 WeakPolarHBondContact CB-OD1 3.46Å; L274-N295 WeakPolarHBondContact CG-OD1 3.41Å; L274-N295 PolarHBondContact N-OD1 2.75Å; L292-N295 PolarHBondContact O-ND2 2.9Å; L292-N295 VanDerWaalsContact O-ND2 3.15Å; S293-N295 PolarHBondContact O-N 2.64Å; S293-N295 PolarHBondContact O-ND2 2.74Å; N295-L297 HydrophobicContact CB-CG 4.23Å; N295-N320 VanDerWaalsContact CA-OD1 3.25Å; N295-N320 WeakPolarHBondContact CA-OD1 2.85Å; N295-N320 WeakPolarHBondContact CB-OD1 3.13Å; N295-N320 PolarHBondContact N-OD1 2.99Å; N295-N320 PolarHBondContact O-OD1 3.28Å
296	R	96.8	Very high	95.9	Very high	91 Å²	91	44.3 Å²	44.3	34%	0.343	20%	0.203	S	C	.	.			trans	-112.6	28	179.8	-57.9	-177.2	-175.2	176.7	6.7	112.1	L274 E298 N320	L274-R296 CarbonylContact O-C 3.51Å; L274-R296 WeakPolarHBondContact O-CA 3.23Å; L274-R296 PolarHBondContact O-N 2.68Å; R296-E298 PolarHBondContact O-N 2.82Å; R296-N320 PolarHBondContact N-OD1 2.9Å
297	L	97.4	Very high	95.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	21%	0.21	C	C	.	.			trans	-66.1	124.9	-178.2	-55.4	179.2	0	0	0	110.2	L274 S276 V277 L292 N295 N320 R321 L322	L274-L297 PolarHBondContact O-N 3.5Å; S276-L297 VanDerWaalsContact CA-CD2 3.44Å; V277-L297 HydrophobicContact CG2-CD1 4.34Å; V277-L297 HydrophobicContact CG2-CD2 4.44Å; L292-L297 HydrophobicContact CB-CD1 4.04Å; L292-L297 HydrophobicContact CD1-CD1 4.34Å; N295-L297 HydrophobicContact CB-CG 4.23Å; L297-N320 HydrophobicContact CB-CB 4.11Å; L297-N320 VanDerWaalsContact CB-OD1 3.3Å; L297-N320 WeakPolarHBondContact CB-OD1 3.33Å; L297-N320 VanDerWaalsContact CG-OD1 3.26Å; L297-N320 WeakPolarHBondContact CG-OD1 3.38Å; L297-N320 PolarHBondContact N-OD1 3.19Å; L297-R321 CarbonylContact O-C 3.52Å; L297-R321 VanDerWaalsContact O-CA 3.28Å; L297-R321 WeakPolarHBondContact O-CA 3.4Å; L297-R321 PolarHBondContact O-N 3.32Å; L297-L322 HydrophobicContact CB-CD2 3.81Å; L297-L322 PolarHBondContact O-N 3.25Å
298	E	95.6	Very high	95.7	Very high	116 Å²	116	45.7 Å²	45.7	54%	0.542	21%	0.21	S	C	.	.	S	Bend	trans	-93.7	-26.5	176.9	-64.2	-175.6	175.8	0	0	112.7	R296 R321 L322 S323	R296-E298 PolarHBondContact O-N 2.82Å; E298-R321 HydrophobicContact CG-CB 4.42Å; E298-L322 WeakPolarHBondContact O-CA 3.34Å; E298-S323 PolarHBondContact O-N 3.49Å; E298-S323 PolarHBondContact O-OG 2.84Å
299	Q	93.6	Very high	95.5	Very high	97 Å²	97	43.5 Å²	43.5	45%	0.453	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	151.8	178	-55.9	-175.8	-8	0	0	110.3	H301 L322 L324	Q299-H301 PolarHBondContact OE1-NE2 3.3Å; Q299-L322 VanDerWaalsContact C-CD2 3.42Å; Q299-L324 WeakPolarHBondContact CA-O 3.42Å; Q299-L324 HydrophobicContact CB-CB 4.39Å; Q299-L324 HydrophobicContact CG-CB 4.05Å; Q299-L324 HydrophobicContact CG-CD2 4.45Å
300	F	95.1	Very high	95.4	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	123.6	172.4	-174	-89.5	0	0	0	111.2	V277 L292 F302 L305 L315 L317 L322 L324 I325 G326	V277-F300 HydrophobicContact CG2-CD2 3.59Å; V277-F300 HydrophobicContact CG2-CE2 3.71Å; L292-F300 HydrophobicContact CD1-CE2 4.08Å; F300-F302 HydrophobicContact CD1-CD1 4.38Å; F300-F302 HydrophobicContact CD1-CE1 4.34Å; F300-F302 AromaticContact CE1-CD1 3.68Å; F300-F302 HydrophobicContact CE1-CD1 3.68Å; F300-F302 AromaticContact CE1-CE1 3.81Å; F300-F302 HydrophobicContact CE1-CE1 3.81Å; F300-F302 HydrophobicContact CE1-CG 4.19Å; F300-F302 HydrophobicContact CE1-CZ 4.41Å; F300-L305 HydrophobicContact CE1-CD1 4.42Å; F300-L305 HydrophobicContact CZ-CD1 4.02Å; F300-L305 HydrophobicContact CZ-CG 4.35Å; F300-L315 HydrophobicContact CE1-CD2 3.86Å; F300-L315 HydrophobicContact CZ-CD1 4.3Å; F300-L315 HydrophobicContact CZ-CD2 3.8Å; F300-L317 HydrophobicContact CB-CD1 4.05Å; F300-L317 HydrophobicContact CD1-CD1 3.7Å; F300-L317 HydrophobicContact CD2-CD1 3.87Å; F300-L317 HydrophobicContact CD2-CD2 3.52Å; F300-L317 HydrophobicContact CD2-CG 4.36Å; F300-L317 HydrophobicContact CE1-CD1 4.09Å; F300-L317 HydrophobicContact CE2-CD1 4.25Å; F300-L317 HydrophobicContact CE2-CD2 3.62Å; F300-L317 HydrophobicContact CG-CD1 3.58Å; F300-L317 HydrophobicContact CG-CD2 4.14Å; F300-L317 HydrophobicContact CZ-CD1 4.36Å; F300-L317 HydrophobicContact CZ-CD2 4.29Å; F300-L322 HydrophobicContact CB-CD1 4.41Å; F300-L322 HydrophobicContact CB-CD2 4Å; F300-L324 PolarHBondContact N-O 3.12Å; F300-I325 HydrophobicContact CB-CG1 4.31Å; F300-I325 HydrophobicContact CD1-CD1 4.35Å; F300-I325 HydrophobicContact CD1-CG1 4.15Å; F300-I325 WeakPolarHBondContact O-CA 3.41Å; F300-G326 PolarHBondContact O-N 3Å; F300-G326 VanDerWaalsContact O-N 3.07Å
301	H	93.3	Very high	95.4	Very high	50 Å²	50	45.6 Å²	45.6	23%	0.231	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	120.4	179.5	-61.9	-62.1	0	0	0	110.3	Q299 D303 C304 G326 A328	Q299-H301 PolarHBondContact OE1-NE2 3.3Å; H301-D303 PolarHBondContact O-N 2.95Å; H301-D303 VanDerWaalsContact O-N 3.11Å; H301-C304 PolarHBondContact O-N 2.91Å; H301-C304 PolarHBondContact O-SG 3.44Å; H301-G326 CarbonylContact C-O 3.55Å; H301-G326 VanDerWaalsContact CA-O 3.26Å; H301-G326 WeakPolarHBondContact CA-O 3.23Å; H301-A328 HydrophobicContact CB-CB 4.12Å; H301-A328 VanDerWaalsContact ND1-CA 3.35Å; H301-A328 WeakPolarHBondContact ND1-CA 3.11Å; H301-A328 PolarHBondContact ND1-N 3.15Å
302	F	92.9	Very high	95.4	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-63.9	-16.5	-178.4	-73	-73.7	0	0	0	113.5	F300 C304 L305 L315 I325 G326 L327 M336 L338 L344 L356 V359 F361	F300-F302 HydrophobicContact CD1-CD1 4.38Å; F300-F302 HydrophobicContact CD1-CE1 4.34Å; F300-F302 AromaticContact CE1-CD1 3.68Å; F300-F302 HydrophobicContact CE1-CD1 3.68Å; F300-F302 AromaticContact CE1-CE1 3.81Å; F300-F302 HydrophobicContact CE1-CE1 3.81Å; F300-F302 HydrophobicContact CE1-CG 4.19Å; F300-F302 HydrophobicContact CE1-CZ 4.41Å; F302-C304 PolarHBondContact O-N 2.75Å; F302-C304 VanDerWaalsContact O-N 3.08Å; F302-L305 HydrophobicContact CD1-CD1 4.4Å; F302-L305 PolarHBondContact O-N 3.45Å; F302-L315 HydrophobicContact CE1-CD2 3.98Å; F302-I325 HydrophobicContact CE2-CD1 4.1Å; F302-I325 HydrophobicContact CE2-CG1 3.7Å; F302-I325 HydrophobicContact CZ-CD1 3.83Å; F302-I325 HydrophobicContact CZ-CG1 3.97Å; F302-G326 WeakPolarHBondContact CD2-O 3.44Å; F302-G326 PolarHBondContact N-O 3.49Å; F302-L327 HydrophobicContact CB-CD2 4.41Å; F302-M336 HydrophobicContact CB-CE 4.43Å; F302-M336 HydrophobicContact CB-SD 4.03Å; F302-M336 WeakPolarHBondContact O-CE 3.27Å; F302-L338 HydrophobicContact CB-CD1 4.24Å; F302-L338 HydrophobicContact CD1-CD1 3.37Å; F302-L338 HydrophobicContact CE1-CD1 3.87Å; F302-L338 HydrophobicContact CG-CD1 3.89Å; F302-L344 HydrophobicContact CZ-CD2 4.3Å; F302-L356 HydrophobicContact CE2-CD2 3.67Å; F302-L356 HydrophobicContact CZ-CD2 4.43Å; F302-V359 HydrophobicContact CD2-CG1 4.28Å; F302-V359 HydrophobicContact CD2-CG2 4.28Å; F302-V359 HydrophobicContact CG-CG1 4.49Å; F302-F361 HydrophobicContact CD1-CE1 4.46Å; F302-F361 HydrophobicContact CD2-CZ 4.43Å; F302-F361 AromaticContact CE1-CE1 3.85Å; F302-F361 HydrophobicContact CE1-CE1 3.85Å; F302-F361 HydrophobicContact CE1-CZ 4.13Å; F302-F361 HydrophobicContact CE2-CE1 4.36Å; F302-F361 AromaticContact CE2-CZ 3.81Å; F302-F361 HydrophobicContact CE2-CZ 3.81Å; F302-F361 AromaticContact CZ-CE1 3.79Å; F302-F361 HydrophobicContact CZ-CE1 3.79Å; F302-F361 AromaticContact CZ-CZ 3.64Å; F302-F361 HydrophobicContact CZ-CZ 3.64Å
303	D	91.1	Very high	95.4	Very high	46 Å²	46	49.3 Å²	49.3	25%	0.246	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-51.1	-32.3	173.7	-64.9	-85	0	0	0	113.2	H301 L305 R306 L327 A328	H301-D303 PolarHBondContact O-N 2.95Å; H301-D303 VanDerWaalsContact O-N 3.11Å; D303-L305 PolarHBondContact O-N 2.91Å; D303-R306 WeakPolarHBondContact O-CB 3.21Å; D303-R306 PolarHBondContact O-N 2.66Å; D303-R306 IonicContact OD1-NH2 3.35Å; D303-R306 PolarHBondContact OD1-NH2 3.1Å; D303-L327 WeakPolarHBondContact OD2-CA 3.42Å; D303-A328 PolarHBondContact OD2-N 2.98Å
304	C	92.8	Very high	95.4	Very high	26 Å²	26	50.4 Å²	50.4	18%	0.176	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-67.8	-13	176.7	72.7	0	0	0	0	114.1	G282 H301 F302	G282-C304 WeakPolarHBondContact CA-O 3.4Å; G282-C304 PolarHBondContact N-O 2.77Å; H301-C304 PolarHBondContact O-N 2.91Å; H301-C304 PolarHBondContact O-SG 3.44Å; F302-C304 PolarHBondContact O-N 2.75Å; F302-C304 VanDerWaalsContact O-N 3.08Å
305	L	94.6	Very high	95.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-103.7	9.6	177.9	-62.6	-178.5	0	0	0	112.7	I281 L290 F300 F302 D303 E307 S308 A309 L315 L338	I281-L305 HydrophobicContact CG2-CD2 3.95Å; L290-L305 HydrophobicContact CD2-CD2 3.88Å; F300-L305 HydrophobicContact CE1-CD1 4.42Å; F300-L305 HydrophobicContact CZ-CD1 4.02Å; F300-L305 HydrophobicContact CZ-CG 4.35Å; F302-L305 HydrophobicContact CD1-CD1 4.4Å; F302-L305 PolarHBondContact O-N 3.45Å; D303-L305 PolarHBondContact O-N 2.91Å; L305-E307 VanDerWaalsContact C-N 3.33Å; L305-E307 PolarHBondContact O-N 2.96Å; L305-S308 WeakPolarHBondContact CA-OG 3.34Å; L305-S308 WeakPolarHBondContact CB-OG 3.17Å; L305-S308 CarbonylContact O-C 3.32Å; L305-S308 WeakPolarHBondContact O-CA 3.16Å; L305-S308 PolarHBondContact O-N 2.9Å; L305-S308 PolarHBondContact O-OG 2.79Å; L305-A309 PolarHBondContact O-N 3.09Å; L305-L315 HydrophobicContact CD1-CD2 3.83Å; L305-L338 HydrophobicContact CB-CD2 4.26Å; L305-L338 HydrophobicContact CD1-CD2 4.38Å
306	R	92.1	Very high	95.4	Very high	159 Å²	159	46.9 Å²	46.9	60%	0.6	23%	0.229	S	C	*	.	S	Bend	trans	-52.4	-46.5	-175.2	-173.6	177	-67.5	-137.1	-0.2	113.1	D303 S308 A309 M336	D303-R306 WeakPolarHBondContact O-CB 3.21Å; D303-R306 PolarHBondContact O-N 2.66Å; D303-R306 IonicContact OD1-NH2 3.35Å; D303-R306 PolarHBondContact OD1-NH2 3.1Å; R306-S308 VanDerWaalsContact C-N 3.33Å; R306-A309 WeakPolarHBondContact O-CB 3.49Å; R306-A309 PolarHBondContact O-N 3.28Å; R306-M336 HydrophobicContact CB-CE 4.38Å
307	E	93.7	Very high	95.5	Very high	115 Å²	115	42.6 Å²	42.6	54%	0.537	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-30.7	177.9	-65	-59.6	136.7	0	0	112.9	G282 L305	G282-E307 WeakPolarHBondContact O-CG 3.38Å; L305-E307 VanDerWaalsContact C-N 3.33Å; L305-E307 PolarHBondContact O-N 2.96Å
308	S	95.6	Very high	95.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	6.8	178.2	60.6	0	0	0	0	114	M284 L305 R306 S310 T311 V312	M284-S308 WeakPolarHBondContact O-CB 3.49Å; L305-S308 WeakPolarHBondContact CA-OG 3.34Å; L305-S308 WeakPolarHBondContact CB-OG 3.17Å; L305-S308 CarbonylContact O-C 3.32Å; L305-S308 WeakPolarHBondContact O-CA 3.16Å; L305-S308 PolarHBondContact O-N 2.9Å; L305-S308 PolarHBondContact O-OG 2.79Å; R306-S308 VanDerWaalsContact C-N 3.33Å; S308-S310 PolarHBondContact O-N 3.07Å; S308-S310 VanDerWaalsContact O-N 3.08Å; S308-T311 WeakPolarHBondContact CA-OG1 3.32Å; S308-T311 PolarHBondContact O-N 2.79Å; S308-T311 PolarHBondContact O-OG1 2.84Å; S308-V312 WeakPolarHBondContact O-CG1 3.19Å; S308-V312 PolarHBondContact O-N 2.99Å
309	A	94.5	Very high	95.7	Very high	16 Å²	16	44.8 Å²	44.8	13%	0.132	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-24.9	-168.7	0	0	0	0	0	113.4	L305 R306 M336 L338 S339	L305-A309 PolarHBondContact O-N 3.09Å; R306-A309 WeakPolarHBondContact O-CB 3.49Å; R306-A309 PolarHBondContact O-N 3.28Å; A309-M336 HydrophobicContact CB-CE 4.16Å; A309-L338 HydrophobicContact CB-CD2 4.43Å; A309-L338 CarbonylContact O-C 3.47Å; A309-S339 PolarHBondContact O-N 2.94Å
310	S	96.1	Very high	95.9	Very high	83 Å²	83	40.8 Å²	40.8	58%	0.58	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.8	7.5	176.3	58.3	0	0	0	0	114.3	S308 S340	S308-S310 PolarHBondContact O-N 3.07Å; S308-S310 VanDerWaalsContact O-N 3.08Å; S310-S340 PolarHBondContact O-OG 3.17Å
311	T	97.5	Very high	95.9	Very high	33 Å²	33	45.8 Å²	45.8	20%	0.202	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128	-34.8	-179	59.9	0	0	0	0	113.1	G285 L287 S308 K313	G285-T311 VanDerWaalsContact O-CG2 3.28Å; G285-T311 WeakPolarHBondContact O-CG2 3.31Å; G285-T311 PolarHBondContact O-OG1 2.97Å; L287-T311 CarbonylContact O-C 3.08Å; L287-T311 VanDerWaalsContact O-CB 3.31Å; L287-T311 WeakPolarHBondContact O-CB 3.39Å; L287-T311 PolarHBondContact O-OG1 2.93Å; S308-T311 WeakPolarHBondContact CA-OG1 3.32Å; S308-T311 PolarHBondContact O-N 2.79Å; S308-T311 PolarHBondContact O-OG1 2.84Å; T311-K313 PolarHBondContact O-N 3.49Å
312	V	97.8	Very high	96	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.207	C	C	.	.			trans	-65.2	124.5	-176.6	70.8	0	0	0	0	110.1	L287 S308 L338 S340 L341	L287-V312 WeakPolarHBondContact O-CA 3.34Å; L287-V312 PolarHBondContact O-N 2.9Å; S308-V312 WeakPolarHBondContact O-CG1 3.19Å; S308-V312 PolarHBondContact O-N 2.99Å; V312-L338 HydrophobicContact CG1-CD2 3.7Å; V312-S340 CarbonylContact O-C 3.49Å; V312-S340 WeakPolarHBondContact O-CB 3.43Å; V312-L341 HydrophobicContact CG1-CD1 4.11Å; V312-L341 HydrophobicContact CG2-CD1 4.12Å; V312-L341 WeakPolarHBondContact O-CA 3.35Å; V312-L341 PolarHBondContact O-N 2.85Å
313	K	98.2	Very high	96	Very high	91 Å²	91	46.9 Å²	46.9	40%	0.396	23%	0.231	S	C	.	.			trans	-110.4	-36.2	-178.6	-68.9	173.8	-175.5	160.5	0	112.2	Q288 T311 S340 E342 V343	Q288-K313 PolarHBondContact O-N 2.89Å; T311-K313 PolarHBondContact O-N 3.49Å; K313-S340 WeakPolarHBondContact CA-O 3.35Å; K313-E342 PolarHBondContact O-N 3.29Å; K313-V343 PolarHBondContact O-N 3.38Å
314	V	98.6	Very high	96	Very high	38 Å²	38	48.4 Å²	48.4	23%	0.23	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	127.1	-177.8	-177.2	0	0	0	0	109.4	Q288 Y289 L290 V343	Q288-V314 PolarHBondContact O-N 3.35Å; Q288-V314 VanDerWaalsContact O-N 3.08Å; Y289-V314 HydrophobicContact CD2-CB 3.76Å; Y289-V314 HydrophobicContact CD2-CG1 3.83Å; Y289-V314 HydrophobicContact CD2-CG2 4.35Å; Y289-V314 HydrophobicContact CE2-CB 4.32Å; Y289-V314 HydrophobicContact CE2-CG1 3.86Å; L290-V314 PolarHBondContact N-O 3.49Å; V314-V343 WeakPolarHBondContact CA-O 3.03Å; V314-V343 HydrophobicContact CG1-CB 4.25Å; V314-V343 HydrophobicContact CG1-CG1 4.4Å; V314-V343 HydrophobicContact CG2-CB 4.2Å; V314-V343 HydrophobicContact CG2-CG2 4.37Å
315	L	98.4	Very high	95.9	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	120.3	173.9	178.3	60.8	0	0	0	109.6	L290 F300 F302 L305 L317 L341 V343 L344 L345	L290-L315 HydrophobicContact CB-CD1 4.02Å; L290-L315 HydrophobicContact CD2-CD1 3.82Å; L290-L315 HydrophobicContact CG-CD1 3.94Å; L290-L315 WeakPolarHBondContact O-CA 3.42Å; F300-L315 HydrophobicContact CE1-CD2 3.86Å; F300-L315 HydrophobicContact CZ-CD1 4.3Å; F300-L315 HydrophobicContact CZ-CD2 3.8Å; F302-L315 HydrophobicContact CE1-CD2 3.98Å; L305-L315 HydrophobicContact CD1-CD2 3.83Å; L315-L317 HydrophobicContact CD1-CD2 3.99Å; L315-L317 HydrophobicContact CD1-CG 4.25Å; L315-L317 HydrophobicContact CD2-CD1 4.14Å; L315-L317 HydrophobicContact CD2-CG 4.37Å; L315-L317 HydrophobicContact CG-CD1 4.34Å; L315-L317 HydrophobicContact CG-CD2 4.31Å; L315-L317 HydrophobicContact CG-CG 4.03Å; L315-L341 HydrophobicContact CB-CD1 3.81Å; L315-V343 PolarHBondContact N-O 2.94Å; L315-L344 HydrophobicContact CB-CD1 4.11Å; L315-L344 HydrophobicContact CD2-CD1 3.84Å; L315-L344 HydrophobicContact CG-CD1 4.01Å; L315-L344 WeakPolarHBondContact O-CA 3.41Å; L315-L345 PolarHBondContact O-N 3.21Å
316	D	98.5	Very high	95.7	Very high	24 Å²	24	47.8 Å²	47.8	13%	0.128	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	119	175.2	-166.3	-10.9	0	0	0	111.2	L290 N291 L292 S293 S318 L345	L290-D316 PolarHBondContact O-N 2.82Å; N291-D316 HydrophobicContact CB-CB 4.47Å; L292-D316 CarbonylContact C-O 3.5Å; L292-D316 PolarHBondContact N-O 3.24Å; S293-D316 PolarHBondContact N-O 2.94Å; D316-S318 WeakPolarHBondContact OD1-CB 3.45Å; D316-S318 PolarHBondContact OD1-N 2.94Å; D316-S318 PolarHBondContact OD1-OG 3.36Å; D316-L345 HydrophobicContact CB-CB 4.34Å; D316-L345 HydrophobicContact CB-CD1 4.31Å
317	L	98.3	Very high	95.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.212	C	C	.	.			trans	-120	12.5	-179.8	-59.4	177.3	0	0	0	111.8	L292 F300 L315 N320 L322 I325 L344 L345 V346 N349	L292-L317 HydrophobicContact CB-CD2 4.12Å; L292-L317 HydrophobicContact CD1-CD2 4.02Å; F300-L317 HydrophobicContact CB-CD1 4.05Å; F300-L317 HydrophobicContact CD1-CD1 3.7Å; F300-L317 HydrophobicContact CD2-CD1 3.87Å; F300-L317 HydrophobicContact CD2-CD2 3.52Å; F300-L317 HydrophobicContact CD2-CG 4.36Å; F300-L317 HydrophobicContact CE1-CD1 4.09Å; F300-L317 HydrophobicContact CE2-CD1 4.25Å; F300-L317 HydrophobicContact CE2-CD2 3.62Å; F300-L317 HydrophobicContact CG-CD1 3.58Å; F300-L317 HydrophobicContact CG-CD2 4.14Å; F300-L317 HydrophobicContact CZ-CD1 4.36Å; F300-L317 HydrophobicContact CZ-CD2 4.29Å; L315-L317 HydrophobicContact CD1-CD2 3.99Å; L315-L317 HydrophobicContact CD1-CG 4.25Å; L315-L317 HydrophobicContact CD2-CD1 4.14Å; L315-L317 HydrophobicContact CD2-CG 4.37Å; L315-L317 HydrophobicContact CG-CD1 4.34Å; L315-L317 HydrophobicContact CG-CD2 4.31Å; L315-L317 HydrophobicContact CG-CG 4.03Å; L317-N320 PolarHBondContact O-ND2 3.26Å; L317-L322 HydrophobicContact CB-CD1 3.87Å; L317-L322 HydrophobicContact CD1-CD1 4.26Å; L317-I325 HydrophobicContact CD1-CD1 3.78Å; L317-L344 HydrophobicContact CD1-CD1 4.49Å; L317-L345 PolarHBondContact N-O 2.89Å; L317-V346 HydrophobicContact CB-CG1 4.49Å; L317-N349 PolarHBondContact O-ND2 3.28Å
318	S	98.2	Very high	94.8	Very high	11 Å²	11	38.2 Å²	38.2	8%	0.077	21%	0.207	C	C	.	.			trans	-63.6	157.8	-172.6	-53.1	0	0	0	0	112.5	S293 D294 D316 N320 V347	S293-S318 CarbonylContact C-O 3.44Å; S293-S318 WeakPolarHBondContact CA-O 3.34Å; S293-S318 VanDerWaalsContact CB-O 3.24Å; S293-S318 WeakPolarHBondContact CB-O 3.26Å; D294-S318 PolarHBondContact N-O 3.13Å; D316-S318 WeakPolarHBondContact OD1-CB 3.45Å; D316-S318 PolarHBondContact OD1-N 2.94Å; D316-S318 PolarHBondContact OD1-OG 3.36Å; S318-N320 VanDerWaalsContact C-N 3.31Å; S318-N320 PolarHBondContact O-N 2.84Å; S318-N320 PolarHBondContact O-ND2 3.3Å; S318-V347 CarbonylContact C-O 3.21Å; S318-V347 WeakPolarHBondContact CA-O 3.39Å; S318-V347 WeakPolarHBondContact CB-O 3.42Å; S318-V347 PolarHBondContact OG-N 3.16Å
319	R	98.1	Very high	93.6	Very high	152 Å²	152	43.2 Å²	43.2	57%	0.574	23%	0.234	S	C	*	.	S	Bend	trans	55.8	42.9	175.8	-58.4	176.6	-176.6	-95.6	-1.8	113	D294 V347 N348	D294-R319 VanDerWaalsContact CA-O 3.25Å; D294-R319 WeakPolarHBondContact CA-O 3.04Å; D294-R319 HydrophobicContact CB-CB 4.2Å; D294-R319 PolarHBondContact N-O 3.32Å; R319-V347 PolarHBondContact N-O 3.03Å; R319-N348 VanDerWaalsContact CA-O 3.27Å; R319-N348 WeakPolarHBondContact CA-O 3.32Å; R319-N348 HydrophobicContact CG-CB 4.09Å; R319-N348 PolarHBondContact N-O 3.29Å
320	N	97.8	Very high	91.8	Very high	12 Å²	12	47.2 Å²	47.2	6%	0.064	26%	0.261	C	S	.	.	S	Bend	trans	-111.1	-165.8	173.1	-86	-78.1	0	0	0	109.7	L292 N295 R296 L297 L317 S318 L322 N349	L292-N320 PolarHBondContact O-ND2 2.92Å; N295-N320 VanDerWaalsContact CA-OD1 3.25Å; N295-N320 WeakPolarHBondContact CA-OD1 2.85Å; N295-N320 WeakPolarHBondContact CB-OD1 3.13Å; N295-N320 PolarHBondContact N-OD1 2.99Å; N295-N320 PolarHBondContact O-OD1 3.28Å; R296-N320 PolarHBondContact N-OD1 2.9Å; L297-N320 HydrophobicContact CB-CB 4.11Å; L297-N320 VanDerWaalsContact CB-OD1 3.3Å; L297-N320 WeakPolarHBondContact CB-OD1 3.33Å; L297-N320 VanDerWaalsContact CG-OD1 3.26Å; L297-N320 WeakPolarHBondContact CG-OD1 3.38Å; L297-N320 PolarHBondContact N-OD1 3.19Å; L317-N320 PolarHBondContact O-ND2 3.26Å; S318-N320 VanDerWaalsContact C-N 3.31Å; S318-N320 PolarHBondContact O-N 2.84Å; S318-N320 PolarHBondContact O-ND2 3.3Å; N320-L322 HydrophobicContact CB-CD1 4.44Å; N320-L322 HydrophobicContact CB-CG 3.94Å; N320-N349 VanDerWaalsContact CA-OD1 3.24Å; N320-N349 WeakPolarHBondContact CA-OD1 3.4Å; N320-N349 WeakPolarHBondContact CB-OD1 3.45Å; N320-N349 PolarHBondContact N-OD1 3.17Å; N320-N349 PolarHBondContact O-OD1 3.34Å
321	R	95.7	Very high	89.7	Confident	106 Å²	106	51.4 Å²	51.4	40%	0.4	28%	0.276	S	S	.	.			trans	-110.8	28	175.8	-59.6	176.6	-179.2	-175.3	-2.7	111	L297 E298 S323	L297-R321 CarbonylContact O-C 3.52Å; L297-R321 VanDerWaalsContact O-CA 3.28Å; L297-R321 WeakPolarHBondContact O-CA 3.4Å; L297-R321 PolarHBondContact O-N 3.32Å; E298-R321 HydrophobicContact CG-CB 4.42Å; R321-S323 PolarHBondContact O-N 3.45Å; R321-S323 VanDerWaalsContact O-N 3.11Å
322	L	95.8	Very high	87.4	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.29	C	S	.	.			trans	-62.9	117.6	-170.4	-62.8	175.1	0	0	0	110.3	L297 E298 Q299 F300 L317 N320 V346 N349 R350 L351	L297-L322 HydrophobicContact CB-CD2 3.81Å; L297-L322 PolarHBondContact O-N 3.25Å; E298-L322 WeakPolarHBondContact O-CA 3.34Å; Q299-L322 VanDerWaalsContact C-CD2 3.42Å; F300-L322 HydrophobicContact CB-CD1 4.41Å; F300-L322 HydrophobicContact CB-CD2 4Å; L317-L322 HydrophobicContact CB-CD1 3.87Å; L317-L322 HydrophobicContact CD1-CD1 4.26Å; N320-L322 HydrophobicContact CB-CD1 4.44Å; N320-L322 HydrophobicContact CB-CG 3.94Å; L322-V346 HydrophobicContact CD1-CG1 4.01Å; L322-N349 HydrophobicContact CB-CB 4.08Å; L322-N349 VanDerWaalsContact CB-OD1 3.23Å; L322-N349 WeakPolarHBondContact CB-OD1 3.26Å; L322-N349 VanDerWaalsContact CG-OD1 3.24Å; L322-N349 WeakPolarHBondContact CG-OD1 3.04Å; L322-N349 PolarHBondContact N-OD1 3.38Å; L322-R350 CarbonylContact O-C 3.21Å; L322-R350 VanDerWaalsContact O-CA 3.28Å; L322-R350 WeakPolarHBondContact O-CA 3.39Å; L322-R350 PolarHBondContact O-N 3.17Å; L322-L351 HydrophobicContact CB-CD2 4.24Å; L322-L351 WeakPolarHBondContact O-CD2 3.01Å; L322-L351 PolarHBondContact O-N 3.16Å
323	S	92.3	Very high	85.1	Confident	72 Å²	72	60.8 Å²	60.8	50%	0.503	33%	0.333	S	S	.	.	S	Bend	trans	-99.9	-15.6	168.1	59.4	0	0	0	0	112	E298 R321	E298-S323 PolarHBondContact O-N 3.49Å; E298-S323 PolarHBondContact O-OG 2.84Å; R321-S323 PolarHBondContact O-N 3.45Å; R321-S323 VanDerWaalsContact O-N 3.11Å
324	L	90.9	Very high	83.3	Confident	78 Å²	78	58.5 Å²	58.5	41%	0.408	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	136.9	-179.2	-172.1	86.4	0	0	0	111.3	Q299 F300	Q299-L324 WeakPolarHBondContact CA-O 3.42Å; Q299-L324 HydrophobicContact CB-CB 4.39Å; Q299-L324 HydrophobicContact CG-CB 4.05Å; Q299-L324 HydrophobicContact CG-CD2 4.45Å; F300-L324 PolarHBondContact N-O 3.12Å
325	I	91.2	Very high	82.4	Confident	5 Å²	5	64.6 Å²	64.6	3%	0.026	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	128.9	168.1	-171.3	168.3	0	0	0	109.3	F300 F302 L317 V346 L351 F354	F300-I325 HydrophobicContact CB-CG1 4.31Å; F300-I325 HydrophobicContact CD1-CD1 4.35Å; F300-I325 HydrophobicContact CD1-CG1 4.15Å; F300-I325 WeakPolarHBondContact O-CA 3.41Å; F302-I325 HydrophobicContact CE2-CD1 4.1Å; F302-I325 HydrophobicContact CE2-CG1 3.7Å; F302-I325 HydrophobicContact CZ-CD1 3.83Å; F302-I325 HydrophobicContact CZ-CG1 3.97Å; L317-I325 HydrophobicContact CD1-CD1 3.78Å; I325-V346 HydrophobicContact CD1-CG2 4.22Å; I325-L351 HydrophobicContact CG2-CD1 4.18Å; I325-L351 HydrophobicContact CG2-CD2 4.28Å; I325-F354 HydrophobicContact CG2-CD2 3.78Å; I325-F354 HydrophobicContact CG2-CE2 3.76Å
326	G	89.6	Confident	81.9	Confident	8 Å²	8	65.5 Å²	65.5	8%	0.082	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.5	-150.3	-175.8	0	0	0	0	0	114.6	F300 H301 F302	F300-G326 PolarHBondContact O-N 3Å; F300-G326 VanDerWaalsContact O-N 3.07Å; H301-G326 CarbonylContact C-O 3.55Å; H301-G326 VanDerWaalsContact CA-O 3.26Å; H301-G326 WeakPolarHBondContact CA-O 3.23Å; F302-G326 WeakPolarHBondContact CD2-O 3.44Å; F302-G326 PolarHBondContact N-O 3.49Å
327	L	86.5	Confident	81.5	Confident	22 Å²	22	69 Å²	69	12%	0.115	38%	0.381	C	S	.	.			trans	-96	143.7	169.1	-66.7	172.1	0	0	0	109.9	F302 D303 N329 M336 V359	F302-L327 HydrophobicContact CB-CD2 4.41Å; D303-L327 WeakPolarHBondContact OD2-CA 3.42Å; L327-N329 VanDerWaalsContact C-N 3.27Å; L327-N329 PolarHBondContact O-N 3.25Å; L327-M336 HydrophobicContact CD2-CB 4.05Å; L327-M336 HydrophobicContact CD2-SD 3.97Å; L327-V359 HydrophobicContact CD1-CG2 3.93Å; L327-V359 HydrophobicContact CD2-CG2 3.92Å; L327-V359 HydrophobicContact CG-CG2 3.56Å
328	A	81.5	Confident	81.4	Confident	52 Å²	52	69 Å²	69	43%	0.43	38%	0.381	S	S	.	.	S	Bend	trans	-61.1	-38.1	-178.4	0	0	0	0	0	112.3	H301 D303	H301-A328 HydrophobicContact CB-CB 4.12Å; H301-A328 VanDerWaalsContact ND1-CA 3.35Å; H301-A328 WeakPolarHBondContact ND1-CA 3.11Å; H301-A328 PolarHBondContact ND1-N 3.15Å; D303-A328 PolarHBondContact OD2-N 2.98Å
329	N	71.1	Confident	81.2	Confident	104 Å²	104	71.3 Å²	71.3	56%	0.556	40%	0.396	S	S	*	.			trans	-113.6	86.5	176.6	-71.2	-23.4	0	0	0	109.9	L327 L331 T332	L327-N329 VanDerWaalsContact C-N 3.27Å; L327-N329 PolarHBondContact O-N 3.25Å; N329-L331 PolarHBondContact O-N 3.32Å; N329-T332 HydrophobicContact CB-CG2 4.14Å; N329-T332 PolarHBondContact O-N 2.56Å; N329-T332 VanDerWaalsContact O-N 3.09Å; N329-T332 PolarHBondContact O-OG1 3.14Å
330	S	55.9	Low	81.2	Confident	101 Å²	101	65.5 Å²	65.5	71%	0.706	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-16	173.2	-172.6	0	0	0	0	113.4
331	L	51.4	Low	81.2	Confident	171 Å²	171	65 Å²	65	90%	0.895	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-21	179.2	-71.1	160.5	0	0	0	114.6	N329 T333	N329-L331 PolarHBondContact O-N 3.32Å; L331-T333 PolarHBondContact O-N 2.9Å
332	T	50.4	Low	81.3	Confident	82 Å²	82	63 Å²	63	50%	0.503	37%	0.372	S	S	.	.	S	Bend	trans	-82.6	120.6	175.9	49.6	0	0	0	0	108.9	N329 G334	N329-T332 HydrophobicContact CB-CG2 4.14Å; N329-T332 PolarHBondContact O-N 2.56Å; N329-T332 VanDerWaalsContact O-N 3.09Å; N329-T332 PolarHBondContact O-OG1 3.14Å; T332-G334 PolarHBondContact O-N 3.36Å
333	T	49.2	Very low	81.5	Confident	147 Å²	147	64.7 Å²	64.7	90%	0.902	38%	0.382	S	S	*	.			trans	-59.3	15.9	173.8	50.1	0	0	0	0	114.9	L331 E335	L331-T333 PolarHBondContact O-N 2.9Å; T333-E335 PolarHBondContact O-N 3.1Å
334	G	60.6	Low	81.7	Confident	44 Å²	44	61.3 Å²	61.3	45%	0.454	36%	0.358	S	S	.	.			trans	-75.7	104.9	176.2	0	0	0	0	0	110	T332 M336	T332-G334 PolarHBondContact O-N 3.36Å; G334-M336 PolarHBondContact O-N 3.47Å
335	E	78.1	Confident	82.1	Confident	165 Å²	165	59 Å²	59	77%	0.771	35%	0.346	S	S	*	.			trans	-68	125.9	165.8	-67.1	176.9	169.2	0	0	109.1	T333 G358	T333-E335 PolarHBondContact O-N 3.1Å; E335-G358 CarbonylContact C-O 3.16Å; E335-G358 WeakPolarHBondContact CA-O 3.11Å
336	M	88.6	Confident	82.3	Confident	19 Å²	19	58.8 Å²	58.8	9%	0.094	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	130.1	174.4	-176.4	168	178.4	0	0	109.7	F302 R306 A309 L327 G334 L338 G358 V359 E360	F302-M336 HydrophobicContact CB-CE 4.43Å; F302-M336 HydrophobicContact CB-SD 4.03Å; F302-M336 WeakPolarHBondContact O-CE 3.27Å; R306-M336 HydrophobicContact CB-CE 4.38Å; A309-M336 HydrophobicContact CB-CE 4.16Å; L327-M336 HydrophobicContact CD2-CB 4.05Å; L327-M336 HydrophobicContact CD2-SD 3.97Å; G334-M336 PolarHBondContact O-N 3.47Å; M336-L338 HydrophobicContact CE-CD2 4.39Å; M336-L338 HydrophobicContact CE-CG 4.31Å; M336-G358 PolarHBondContact N-O 3.29Å; M336-V359 CarbonylContact O-C 3.58Å; M336-V359 VanDerWaalsContact O-CA 3.29Å; M336-V359 WeakPolarHBondContact O-CA 3.43Å; M336-E360 PolarHBondContact O-N 2.84Å
337	K	91.3	Very high	82.7	Confident	99 Å²	99	59.8 Å²	59.8	43%	0.43	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	110.1	-179.5	-166.4	173.1	-168.5	125.8	0	110.9	S339 E360 P362	K337-S339 VanDerWaalsContact C-N 3.3Å; K337-S339 PolarHBondContact O-N 3.27Å; K337-E360 WeakPolarHBondContact CA-O 3.36Å; K337-E360 HydrophobicContact CG-CB 4.12Å; K337-E360 IonicContact NZ-OE2 2.73Å; K337-E360 PolarHBondContact NZ-OE2 3.33Å; K337-P362 HydrophobicContact CD-CG 4.23Å; K337-P362 HydrophobicContact CG-CG 3.93Å
338	L	95	Very high	83.2	Confident	0 Å²	0	62 Å²	62	0%	0	36%	0.361	C	S	.	.			trans	-83.1	79.9	173.6	-78.1	143.4	0	0	0	108.8	F302 L305 A309 V312 M336 S340 L341 V359 E360 F361	F302-L338 HydrophobicContact CB-CD1 4.24Å; F302-L338 HydrophobicContact CD1-CD1 3.37Å; F302-L338 HydrophobicContact CE1-CD1 3.87Å; F302-L338 HydrophobicContact CG-CD1 3.89Å; L305-L338 HydrophobicContact CB-CD2 4.26Å; L305-L338 HydrophobicContact CD1-CD2 4.38Å; A309-L338 HydrophobicContact CB-CD2 4.43Å; A309-L338 CarbonylContact O-C 3.47Å; V312-L338 HydrophobicContact CG1-CD2 3.7Å; M336-L338 HydrophobicContact CE-CD2 4.39Å; M336-L338 HydrophobicContact CE-CG 4.31Å; L338-S340 PolarHBondContact O-N 2.96Å; L338-L341 HydrophobicContact CB-CB 4.06Å; L338-L341 PolarHBondContact O-N 2.96Å; L338-V359 HydrophobicContact CD1-CG1 3.93Å; L338-E360 PolarHBondContact N-O 2.99Å; L338-F361 HydrophobicContact CB-CD1 3.96Å; L338-F361 HydrophobicContact CB-CE1 4.33Å; L338-F361 HydrophobicContact CD1-CD1 3.93Å; L338-F361 HydrophobicContact CD1-CE1 3.41Å; L338-F361 VanDerWaalsContact CD1-CE1 3.41Å; L338-F361 HydrophobicContact CD1-CZ 4.17Å; L338-F361 HydrophobicContact CG-CE1 4.49Å
339	S	95.2	Very high	83.9	Confident	58 Å²	58	60.1 Å²	60.1	41%	0.406	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-17.7	-166.1	-62.4	0	0	0	0	114.4	A309 K337 A363	A309-S339 PolarHBondContact O-N 2.94Å; K337-S339 VanDerWaalsContact C-N 3.3Å; K337-S339 PolarHBondContact O-N 3.27Å; S339-A363 WeakPolarHBondContact O-CB 3.43Å
340	S	97.3	Very high	85	Confident	31 Å²	31	62.9 Å²	62.9	22%	0.217	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-7.5	-177.1	-61.4	0	0	0	0	114.5	S310 V312 K313 L338 E342	S310-S340 PolarHBondContact O-OG 3.17Å; V312-S340 CarbonylContact O-C 3.49Å; V312-S340 WeakPolarHBondContact O-CB 3.43Å; K313-S340 WeakPolarHBondContact CA-O 3.35Å; L338-S340 PolarHBondContact O-N 2.96Å; S340-E342 WeakPolarHBondContact O-CG 3.02Å; S340-E342 PolarHBondContact O-N 3.48Å
341	L	98	Very high	86.7	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.313	C	S	.	.			trans	-69.8	116.9	-175.3	-169.1	73.3	0	0	0	109.7	V312 L315 L338 L344 F361 A363 L364	V312-L341 HydrophobicContact CG1-CD1 4.11Å; V312-L341 HydrophobicContact CG2-CD1 4.12Å; V312-L341 WeakPolarHBondContact O-CA 3.35Å; V312-L341 PolarHBondContact O-N 2.85Å; L315-L341 HydrophobicContact CB-CD1 3.81Å; L338-L341 HydrophobicContact CB-CB 4.06Å; L338-L341 PolarHBondContact O-N 2.96Å; L341-L344 HydrophobicContact CD2-CB 4.21Å; L341-F361 HydrophobicContact CD2-CD1 3.7Å; L341-F361 HydrophobicContact CD2-CE1 3.89Å; L341-A363 CarbonylContact O-C 3.34Å; L341-L364 HydrophobicContact CD2-CD1 4.06Å; L341-L364 HydrophobicContact CG-CD1 4.01Å; L341-L364 WeakPolarHBondContact O-CA 3.14Å; L341-L364 PolarHBondContact O-N 3.33Å
342	E	98.2	Very high	88.4	Confident	66 Å²	66	56.4 Å²	56.4	31%	0.308	30%	0.301	S	S	.	.			trans	-103.2	-32	-178.3	-55	-160.8	160.1	0	0	112.4	K313 S340 K365 K366	K313-E342 PolarHBondContact O-N 3.29Å; S340-E342 WeakPolarHBondContact O-CG 3.02Å; S340-E342 PolarHBondContact O-N 3.48Å; E342-K365 HydrophobicContact CB-CD 4.44Å; E342-K365 PolarHBondContact O-N 2.99Å; E342-K365 IonicContact OE1-NZ 2.69Å; E342-K365 PolarHBondContact OE1-NZ 3.29Å; E342-K365 IonicContact OE2-NZ 2.69Å; E342-K365 PolarHBondContact OE2-NZ 2.87Å; E342-K366 PolarHBondContact O-N 2.87Å
343	V	98.6	Very high	89.9	Confident	34 Å²	34	62.2 Å²	62.2	21%	0.206	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	123.6	-176.1	-176.9	0	0	0	0	110	K313 V314 L315 L345 K366	K313-V343 PolarHBondContact O-N 3.38Å; V314-V343 WeakPolarHBondContact CA-O 3.03Å; V314-V343 HydrophobicContact CG1-CB 4.25Å; V314-V343 HydrophobicContact CG1-CG1 4.4Å; V314-V343 HydrophobicContact CG2-CB 4.2Å; V314-V343 HydrophobicContact CG2-CG2 4.37Å; L315-V343 PolarHBondContact N-O 2.94Å; V343-L345 HydrophobicContact CG1-CD1 4.47Å; V343-L345 HydrophobicContact CG1-CD2 3.86Å; V343-L345 HydrophobicContact CG1-CG 3.95Å; V343-K366 WeakPolarHBondContact CA-O 3.28Å; V343-K366 HydrophobicContact CG1-CB 4.3Å; V343-K366 HydrophobicContact CG1-CD 4.24Å; V343-K366 HydrophobicContact CG1-CG 4.44Å; V343-K366 HydrophobicContact CG2-CB 4.27Å
344	L	97.7	Very high	91.5	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	118.2	172.7	178	57.5	0	0	0	109.6	F302 L315 L317 L341 V346 F354 F361 L364 K366 L367 D368	F302-L344 HydrophobicContact CZ-CD2 4.3Å; L315-L344 HydrophobicContact CB-CD1 4.11Å; L315-L344 HydrophobicContact CD2-CD1 3.84Å; L315-L344 HydrophobicContact CG-CD1 4.01Å; L315-L344 WeakPolarHBondContact O-CA 3.41Å; L317-L344 HydrophobicContact CD1-CD1 4.49Å; L341-L344 HydrophobicContact CD2-CB 4.21Å; L344-V346 HydrophobicContact CD1-CG2 3.94Å; L344-V346 HydrophobicContact CD2-CG2 4.43Å; L344-V346 HydrophobicContact CG-CG2 3.88Å; L344-F354 HydrophobicContact CD2-CZ 4.48Å; L344-F361 HydrophobicContact CD2-CE1 4.48Å; L344-L364 HydrophobicContact CB-CD1 3.88Å; L344-K366 PolarHBondContact N-O 3.09Å; L344-L367 HydrophobicContact CB-CD1 4.09Å; L344-L367 HydrophobicContact CD2-CD1 3.95Å; L344-L367 HydrophobicContact CG-CD1 3.99Å; L344-L367 WeakPolarHBondContact O-CA 3.43Å; L344-D368 PolarHBondContact O-N 3.33Å; L344-D368 VanDerWaalsContact O-N 3.07Å
345	L	98.2	Very high	92.2	Very high	30 Å²	30	56.8 Å²	56.8	16%	0.157	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	122.8	178.8	-51.6	177.7	0	0	0	109.6	L315 D316 L317 V343 K366 D368	L315-L345 PolarHBondContact O-N 3.21Å; D316-L345 HydrophobicContact CB-CB 4.34Å; D316-L345 HydrophobicContact CB-CD1 4.31Å; L317-L345 PolarHBondContact N-O 2.89Å; V343-L345 HydrophobicContact CG1-CD1 4.47Å; V343-L345 HydrophobicContact CG1-CD2 3.86Å; V343-L345 HydrophobicContact CG1-CG 3.95Å; L345-K366 HydrophobicContact CD2-CD 4.5Å; L345-D368 HydrophobicContact CD2-CB 3.76Å
346	V	96.3	Very high	92.4	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.233	C	C	.	.			trans	-134.7	39.6	-178.7	-158.7	0	0	0	0	109.8	L317 L322 I325 L344 N349 L351 D368 L369 N372	L317-V346 HydrophobicContact CB-CG1 4.49Å; L322-V346 HydrophobicContact CD1-CG1 4.01Å; I325-V346 HydrophobicContact CD1-CG2 4.22Å; L344-V346 HydrophobicContact CD1-CG2 3.94Å; L344-V346 HydrophobicContact CD2-CG2 4.43Å; L344-V346 HydrophobicContact CG-CG2 3.88Å; V346-N349 PolarHBondContact O-ND2 3.19Å; V346-L351 HydrophobicContact CG1-CD1 3.73Å; V346-D368 PolarHBondContact N-O 2.86Å; V346-L369 HydrophobicContact CB-CD2 4.06Å; V346-L369 HydrophobicContact CG2-CD2 4.23Å; V346-N372 PolarHBondContact O-ND2 3.46Å
347	V	97.5	Very high	91.9	Very high	30 Å²	30	55 Å²	55	18%	0.182	26%	0.257	C	S	.	.			trans	-72.9	147	-173	-176.7	0	0	0	0	110.8	S318 R319 N349 D368 S370	S318-V347 CarbonylContact C-O 3.21Å; S318-V347 WeakPolarHBondContact CA-O 3.39Å; S318-V347 WeakPolarHBondContact CB-O 3.42Å; S318-V347 PolarHBondContact OG-N 3.16Å; R319-V347 PolarHBondContact N-O 3.03Å; V347-N349 PolarHBondContact O-ND2 2.89Å; V347-D368 HydrophobicContact CG2-CB 3.82Å; V347-D368 WeakPolarHBondContact CG2-OD1 3.21Å; V347-S370 CarbonylContact C-O 3.27Å; V347-S370 WeakPolarHBondContact CA-O 3.4Å; V347-S370 WeakPolarHBondContact CG1-O 3.49Å
348	N	97.2	Very high	91.6	Very high	68 Å²	68	52 Å²	52	36%	0.364	25%	0.254	S	S	.	.	S	Bend	trans	52.8	61.4	174.4	-66.7	-10.2	0	0	0	113	R319 S370 G371	R319-N348 VanDerWaalsContact CA-O 3.27Å; R319-N348 WeakPolarHBondContact CA-O 3.32Å; R319-N348 HydrophobicContact CG-CB 4.09Å; R319-N348 PolarHBondContact N-O 3.29Å; N348-S370 PolarHBondContact N-O 2.61Å; N348-G371 WeakPolarHBondContact CA-O 3.42Å; N348-G371 WeakPolarHBondContact OD1-CA 3.27Å
349	N	96	Very high	91.2	Very high	13 Å²	13	52.3 Å²	52.3	7%	0.07	26%	0.256	C	S	.	.			trans	-122.5	-167.4	175.1	-87.6	-74.5	0	0	0	109.5	L317 N320 L322 V346 V347 L351 G371 N372	L317-N349 PolarHBondContact O-ND2 3.28Å; N320-N349 VanDerWaalsContact CA-OD1 3.24Å; N320-N349 WeakPolarHBondContact CA-OD1 3.4Å; N320-N349 WeakPolarHBondContact CB-OD1 3.45Å; N320-N349 PolarHBondContact N-OD1 3.17Å; N320-N349 PolarHBondContact O-OD1 3.34Å; L322-N349 HydrophobicContact CB-CB 4.08Å; L322-N349 VanDerWaalsContact CB-OD1 3.23Å; L322-N349 WeakPolarHBondContact CB-OD1 3.26Å; L322-N349 VanDerWaalsContact CG-OD1 3.24Å; L322-N349 WeakPolarHBondContact CG-OD1 3.04Å; L322-N349 PolarHBondContact N-OD1 3.38Å; V346-N349 PolarHBondContact O-ND2 3.19Å; V347-N349 PolarHBondContact O-ND2 2.89Å; N349-L351 HydrophobicContact CB-CG 4.4Å; N349-G371 PolarHBondContact N-O 3.05Å; N349-N372 WeakPolarHBondContact CA-OD1 3.48Å; N349-N372 WeakPolarHBondContact CB-OD1 3.36Å; N349-N372 PolarHBondContact O-OD1 2.74Å
350	R	93.5	Very high	91	Very high	161 Å²	161	53.3 Å²	53.3	61%	0.608	25%	0.254	S	S	*	.			trans	-115.3	31	-179.3	-61	-179.9	179	-177.2	-4.1	111.3	L322 E352	L322-R350 CarbonylContact O-C 3.21Å; L322-R350 VanDerWaalsContact O-CA 3.28Å; L322-R350 WeakPolarHBondContact O-CA 3.39Å; L322-R350 PolarHBondContact O-N 3.17Å; R350-E352 PolarHBondContact O-N 2.7Å
351	L	91.8	Very high	90.9	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	24%	0.244	C	C	.	.			trans	-73	120.9	-177.9	-62.7	175.3	0	0	0	109.3	L322 I325 V346 N349 F354 N372 H373 F374	L322-L351 HydrophobicContact CB-CD2 4.24Å; L322-L351 WeakPolarHBondContact O-CD2 3.01Å; L322-L351 PolarHBondContact O-N 3.16Å; I325-L351 HydrophobicContact CG2-CD1 4.18Å; I325-L351 HydrophobicContact CG2-CD2 4.28Å; V346-L351 HydrophobicContact CG1-CD1 3.73Å; N349-L351 HydrophobicContact CB-CG 4.4Å; L351-F354 HydrophobicContact CD1-CD2 4.28Å; L351-N372 HydrophobicContact CB-CB 4.19Å; L351-N372 VanDerWaalsContact CB-OD1 3.28Å; L351-N372 WeakPolarHBondContact CB-OD1 3.2Å; L351-N372 WeakPolarHBondContact CG-OD1 3.32Å; L351-N372 PolarHBondContact N-OD1 2.73Å; L351-H373 CarbonylContact O-C 3.32Å; L351-H373 PolarHBondContact O-N 2.92Å; L351-F374 HydrophobicContact CB-CE1 3.83Å; L351-F374 HydrophobicContact CB-CZ 3.99Å; L351-F374 WeakPolarHBondContact O-CE1 3.3Å
352	E	87.4	Confident	90.7	Very high	136 Å²	136	53.1 Å²	53.1	64%	0.636	25%	0.252	S	S	*	.	S	Bend	trans	-87.2	-22	170.2	-67.5	-176.9	-173.8	0	0	112.4	R350 H373	R350-E352 PolarHBondContact O-N 2.7Å; E352-H373 WeakPolarHBondContact CA-O 3.5Å
353	R	82.3	Confident	90.6	Very high	204 Å²	204	51 Å²	51	77%	0.77	25%	0.246	S	C	*	.			trans	-147.5	154.6	-179.2	-62	-177.5	-177.7	158.1	2.7	109.6
354	F	82.7	Confident	90.5	Very high	19 Å²	19	49.4 Å²	49.4	8%	0.083	24%	0.236	C	C	.	.			trans	-120.6	83.6	174.6	-168.6	-114.1	0	0	0	109.3	I325 L344 L351 L356 L367 L369 F374 H381 M385	I325-F354 HydrophobicContact CG2-CD2 3.78Å; I325-F354 HydrophobicContact CG2-CE2 3.76Å; L344-F354 HydrophobicContact CD2-CZ 4.48Å; L351-F354 HydrophobicContact CD1-CD2 4.28Å; F354-L356 HydrophobicContact CD1-CD1 4.03Å; F354-L356 HydrophobicContact CD1-CG 4.4Å; F354-L356 HydrophobicContact CE1-CD1 3.25Å; F354-L356 HydrophobicContact CE1-CG 4.01Å; F354-L356 HydrophobicContact CE2-CD1 4.25Å; F354-L356 HydrophobicContact CE2-CD2 4.47Å; F354-L356 HydrophobicContact CE2-CG 4.45Å; F354-L356 HydrophobicContact CZ-CD1 3.37Å; F354-L356 HydrophobicContact CZ-CD2 4.33Å; F354-L356 HydrophobicContact CZ-CG 4.02Å; F354-L367 HydrophobicContact CE1-CD2 3.83Å; F354-L367 HydrophobicContact CZ-CD1 4.06Å; F354-L367 HydrophobicContact CZ-CD2 4.21Å; F354-L369 HydrophobicContact CB-CD1 4.46Å; F354-L369 HydrophobicContact CD1-CD1 3.91Å; F354-L369 HydrophobicContact CD2-CD1 4.3Å; F354-L369 HydrophobicContact CD2-CD2 3.79Å; F354-L369 HydrophobicContact CE1-CD1 4.13Å; F354-L369 HydrophobicContact CE1-CD2 4.39Å; F354-L369 HydrophobicContact CE2-CD2 3.58Å; F354-L369 HydrophobicContact CG-CD1 3.98Å; F354-L369 HydrophobicContact CG-CD2 4.32Å; F354-L369 HydrophobicContact CZ-CD1 4.46Å; F354-L369 HydrophobicContact CZ-CD2 3.9Å; F354-F374 HydrophobicContact CB-CE1 4.28Å; F354-F374 HydrophobicContact CB-CZ 4.46Å; F354-H381 WeakPolarHBondContact O-CB 3.39Å; F354-H381 PolarHBondContact O-CD2 3.05Å; F354-H381 VanDerWaalsContact O-CG 3.28Å; F354-M385 HydrophobicContact CE1-CE 4.02Å
355	D	76.2	Confident	90.5	Very high	59 Å²	59	52.8 Å²	52.8	32%	0.316	25%	0.251	S	S	.	.			trans	-103.9	110.9	-178.9	-168.4	-4	0	0	0	110.8	K357 H381	D355-K357 WeakPolarHBondContact OD1-CD 3.37Å; D355-K357 WeakPolarHBondContact OD1-CG 3.5Å; D355-K357 PolarHBondContact OD1-N 3.25Å; D355-K357 VanDerWaalsContact OD1-N 3.13Å; D355-K357 IonicContact OD2-NZ 3.98Å; D355-K357 PolarHBondContact OD2-NZ 2.79Å; D355-H381 IonicContact OD1-CE1 2.78Å; D355-H381 PolarHBondContact OD1-CE1 3.02Å; D355-H381 VanDerWaalsContact OD1-CE1 3.25Å; D355-H381 IonicContact OD1-ND1 3.68Å; D355-H381 PolarHBondContact OD1-ND1 3.07Å; D355-H381 IonicContact OD2-CE1 3.77Å
356	L	81.3	Confident	90.5	Very high	10 Å²	10	54.8 Å²	54.8	5%	0.052	26%	0.258	C	S	.	.			trans	-111.8	30.4	-179.8	-64.4	170.9	0	0	0	112.6	F302 F354 G358 V359 F361 M385	F302-L356 HydrophobicContact CE2-CD2 3.67Å; F302-L356 HydrophobicContact CZ-CD2 4.43Å; F354-L356 HydrophobicContact CD1-CD1 4.03Å; F354-L356 HydrophobicContact CD1-CG 4.4Å; F354-L356 HydrophobicContact CE1-CD1 3.25Å; F354-L356 HydrophobicContact CE1-CG 4.01Å; F354-L356 HydrophobicContact CE2-CD1 4.25Å; F354-L356 HydrophobicContact CE2-CD2 4.47Å; F354-L356 HydrophobicContact CE2-CG 4.45Å; F354-L356 HydrophobicContact CZ-CD1 3.37Å; F354-L356 HydrophobicContact CZ-CD2 4.33Å; F354-L356 HydrophobicContact CZ-CG 4.02Å; L356-G358 PolarHBondContact O-N 2.81Å; L356-V359 PolarHBondContact O-N 2.88Å; L356-F361 HydrophobicContact CB-CE2 4.31Å; L356-F361 HydrophobicContact CD1-CD2 4.27Å; L356-F361 HydrophobicContact CD1-CE2 3.47Å; L356-F361 VanDerWaalsContact CD1-CE2 3.47Å; L356-F361 HydrophobicContact CD1-CZ 4.06Å; L356-F361 HydrophobicContact CD2-CE2 4.22Å; L356-F361 HydrophobicContact CD2-CZ 4.14Å; L356-F361 HydrophobicContact CG-CE2 4.21Å; L356-M385 HydrophobicContact CD1-CE 3.55Å
357	K	78.9	Confident	90.5	Very high	137 Å²	137	54.8 Å²	54.8	60%	0.596	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	129	176	-83.6	166.6	-168.7	159.1	0	111.7	D355 V359	D355-K357 WeakPolarHBondContact OD1-CD 3.37Å; D355-K357 WeakPolarHBondContact OD1-CG 3.5Å; D355-K357 PolarHBondContact OD1-N 3.25Å; D355-K357 VanDerWaalsContact OD1-N 3.13Å; D355-K357 IonicContact OD2-NZ 3.98Å; D355-K357 PolarHBondContact OD2-NZ 2.79Å; K357-V359 VanDerWaalsContact C-N 3.3Å
358	G	83.4	Confident	90.5	Very high	34 Å²	34	54.4 Å²	54.4	35%	0.351	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	2.1	-178.6	0	0	0	0	0	114.6	E335 M336 L356	E335-G358 CarbonylContact C-O 3.16Å; E335-G358 WeakPolarHBondContact CA-O 3.11Å; M336-G358 PolarHBondContact N-O 3.29Å; L356-G358 PolarHBondContact O-N 2.81Å
359	V	88.3	Confident	90.3	Very high	7 Å²	7	51.4 Å²	51.4	4%	0.042	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	125.9	176.6	-165.7	0	0	0	0	111.5	F302 L327 M336 L338 L356 K357 F361	F302-V359 HydrophobicContact CD2-CG1 4.28Å; F302-V359 HydrophobicContact CD2-CG2 4.28Å; F302-V359 HydrophobicContact CG-CG1 4.49Å; L327-V359 HydrophobicContact CD1-CG2 3.93Å; L327-V359 HydrophobicContact CD2-CG2 3.92Å; L327-V359 HydrophobicContact CG-CG2 3.56Å; M336-V359 CarbonylContact O-C 3.58Å; M336-V359 VanDerWaalsContact O-CA 3.29Å; M336-V359 WeakPolarHBondContact O-CA 3.43Å; L338-V359 HydrophobicContact CD1-CG1 3.93Å; L356-V359 PolarHBondContact O-N 2.88Å; K357-V359 VanDerWaalsContact C-N 3.3Å; V359-F361 HydrophobicContact CB-CE2 4Å; V359-F361 HydrophobicContact CB-CZ 4.13Å; V359-F361 HydrophobicContact CG1-CD2 4.43Å; V359-F361 HydrophobicContact CG1-CE1 4Å; V359-F361 HydrophobicContact CG1-CE2 3.59Å; V359-F361 HydrophobicContact CG1-CZ 3.37Å
360	E	90.5	Very high	90.3	Very high	79 Å²	79	51.4 Å²	51.4	37%	0.369	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	143.5	175.1	-69.5	-171.3	175.1	0	0	112	M336 K337 L338 P362	M336-E360 PolarHBondContact O-N 2.84Å; K337-E360 WeakPolarHBondContact CA-O 3.36Å; K337-E360 HydrophobicContact CG-CB 4.12Å; K337-E360 IonicContact NZ-OE2 2.73Å; K337-E360 PolarHBondContact NZ-OE2 3.33Å; L338-E360 PolarHBondContact N-O 2.99Å; E360-P362 WeakPolarHBondContact O-CD 3.35Å
361	F	94	Very high	90.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.22	C	C	.	.			trans	-126.8	71.3	179.1	-48.5	-97.1	0	0	0	109.7	F302 L338 L341 L344 L356 V359 A363 L364 G384 M385	F302-F361 HydrophobicContact CD1-CE1 4.46Å; F302-F361 HydrophobicContact CD2-CZ 4.43Å; F302-F361 AromaticContact CE1-CE1 3.85Å; F302-F361 HydrophobicContact CE1-CE1 3.85Å; F302-F361 HydrophobicContact CE1-CZ 4.13Å; F302-F361 HydrophobicContact CE2-CE1 4.36Å; F302-F361 AromaticContact CE2-CZ 3.81Å; F302-F361 HydrophobicContact CE2-CZ 3.81Å; F302-F361 AromaticContact CZ-CE1 3.79Å; F302-F361 HydrophobicContact CZ-CE1 3.79Å; F302-F361 AromaticContact CZ-CZ 3.64Å; F302-F361 HydrophobicContact CZ-CZ 3.64Å; L338-F361 HydrophobicContact CB-CD1 3.96Å; L338-F361 HydrophobicContact CB-CE1 4.33Å; L338-F361 HydrophobicContact CD1-CD1 3.93Å; L338-F361 HydrophobicContact CD1-CE1 3.41Å; L338-F361 VanDerWaalsContact CD1-CE1 3.41Å; L338-F361 HydrophobicContact CD1-CZ 4.17Å; L338-F361 HydrophobicContact CG-CE1 4.49Å; L341-F361 HydrophobicContact CD2-CD1 3.7Å; L341-F361 HydrophobicContact CD2-CE1 3.89Å; L344-F361 HydrophobicContact CD2-CE1 4.48Å; L356-F361 HydrophobicContact CB-CE2 4.31Å; L356-F361 HydrophobicContact CD1-CD2 4.27Å; L356-F361 HydrophobicContact CD1-CE2 3.47Å; L356-F361 VanDerWaalsContact CD1-CE2 3.47Å; L356-F361 HydrophobicContact CD1-CZ 4.06Å; L356-F361 HydrophobicContact CD2-CE2 4.22Å; L356-F361 HydrophobicContact CD2-CZ 4.14Å; L356-F361 HydrophobicContact CG-CE2 4.21Å; V359-F361 HydrophobicContact CB-CE2 4Å; V359-F361 HydrophobicContact CB-CZ 4.13Å; V359-F361 HydrophobicContact CG1-CD2 4.43Å; V359-F361 HydrophobicContact CG1-CE1 4Å; V359-F361 HydrophobicContact CG1-CE2 3.59Å; V359-F361 HydrophobicContact CG1-CZ 3.37Å; F361-A363 PolarHBondContact O-N 3.06Å; F361-A363 VanDerWaalsContact O-N 3.17Å; F361-L364 HydrophobicContact CB-CB 3.71Å; F361-L364 HydrophobicContact CB-CD2 4.18Å; F361-L364 HydrophobicContact CB-CG 4.38Å; F361-L364 HydrophobicContact CG-CD2 4.48Å; F361-L364 WeakPolarHBondContact O-CB 3.49Å; F361-L364 PolarHBondContact O-N 3.19Å; F361-L364 VanDerWaalsContact O-N 3.17Å; F361-G384 CarbonylContact C-O 3.14Å; F361-G384 PolarHBondContact N-O 3.2Å; F361-M385 HydrophobicContact CB-CG 4.12Å; F361-M385 HydrophobicContact CD2-CE 4.43Å; F361-M385 HydrophobicContact CD2-CG 4.19Å
362	P	94	Very high	90.4	Very high	27 Å²	27	45 Å²	45	18%	0.175	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-26.4	-172.9	30.9	-41.9	0	0	0	113.1	K337 E360 N387	K337-P362 HydrophobicContact CD-CG 4.23Å; K337-P362 HydrophobicContact CG-CG 3.93Å; E360-P362 WeakPolarHBondContact O-CD 3.35Å; P362-N387 PolarHBondContact O-ND2 2.96Å
363	A	96.7	Very high	90.4	Very high	23 Å²	23	42.1 Å²	42.1	19%	0.19	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-0.7	-178.6	0	0	0	0	0	113.9	S339 L341 F361 K365	S339-A363 WeakPolarHBondContact O-CB 3.43Å; L341-A363 CarbonylContact O-C 3.34Å; F361-A363 PolarHBondContact O-N 3.06Å; F361-A363 VanDerWaalsContact O-N 3.17Å; A363-K365 PolarHBondContact O-N 2.88Å
364	L	97	Very high	90.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.173	C	C	.	.			trans	-66.2	123.4	-172.3	-158.4	72.3	0	0	0	110.7	L341 L344 F361 L367 M385 N387 L388	L341-L364 HydrophobicContact CD2-CD1 4.06Å; L341-L364 HydrophobicContact CG-CD1 4.01Å; L341-L364 WeakPolarHBondContact O-CA 3.14Å; L341-L364 PolarHBondContact O-N 3.33Å; L344-L364 HydrophobicContact CB-CD1 3.88Å; F361-L364 HydrophobicContact CB-CB 3.71Å; F361-L364 HydrophobicContact CB-CD2 4.18Å; F361-L364 HydrophobicContact CB-CG 4.38Å; F361-L364 HydrophobicContact CG-CD2 4.48Å; F361-L364 WeakPolarHBondContact O-CB 3.49Å; F361-L364 PolarHBondContact O-N 3.19Å; F361-L364 VanDerWaalsContact O-N 3.17Å; L364-L367 HydrophobicContact CD2-CB 4.16Å; L364-M385 HydrophobicContact CB-CG 4.47Å; L364-M385 HydrophobicContact CD2-CG 3.83Å; L364-M385 HydrophobicContact CD2-SD 3.56Å; L364-M385 VanDerWaalsContact CD2-SD 3.56Å; L364-N387 CarbonylContact O-C 3.44Å; L364-L388 HydrophobicContact CD2-CD1 4.19Å; L364-L388 HydrophobicContact CG-CD1 4.32Å; L364-L388 VanDerWaalsContact O-CA 3.3Å; L364-L388 WeakPolarHBondContact O-CA 3.23Å; L364-L388 PolarHBondContact O-N 3.43Å
365	K	97.7	Very high	90.1	Very high	72 Å²	72	34.6 Å²	34.6	31%	0.313	19%	0.187	S	C	.	.			trans	-107.2	-34.2	178.8	-63.8	171.9	-164.7	160.5	0	111.4	E342 A363 R389 S390	E342-K365 HydrophobicContact CB-CD 4.44Å; E342-K365 PolarHBondContact O-N 2.99Å; E342-K365 IonicContact OE1-NZ 2.69Å; E342-K365 PolarHBondContact OE1-NZ 3.29Å; E342-K365 IonicContact OE2-NZ 2.69Å; E342-K365 PolarHBondContact OE2-NZ 2.87Å; A363-K365 PolarHBondContact O-N 2.88Å; K365-R389 CarbonylContact O-C 3.58Å; K365-R389 WeakPolarHBondContact O-CA 3.39Å; K365-R389 PolarHBondContact O-N 2.94Å; K365-S390 PolarHBondContact O-N 2.77Å
366	K	98.2	Very high	89.6	Confident	72 Å²	72	37.9 Å²	37.9	31%	0.313	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	127.6	-177.7	-177.7	176.6	177.7	-173.5	0	111.2	E342 V343 L344 L345 S390	E342-K366 PolarHBondContact O-N 2.87Å; V343-K366 WeakPolarHBondContact CA-O 3.28Å; V343-K366 HydrophobicContact CG1-CB 4.3Å; V343-K366 HydrophobicContact CG1-CD 4.24Å; V343-K366 HydrophobicContact CG1-CG 4.44Å; V343-K366 HydrophobicContact CG2-CB 4.27Å; L344-K366 PolarHBondContact N-O 3.09Å; L345-K366 HydrophobicContact CD2-CD 4.5Å; K366-S390 WeakPolarHBondContact CA-O 3.42Å
367	L	96.1	Very high	88.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	123.4	172.4	177.6	59.5	0	0	0	109.2	L344 F354 L364 L369 L382 M385 L388 S390 L391 K392	L344-L367 HydrophobicContact CB-CD1 4.09Å; L344-L367 HydrophobicContact CD2-CD1 3.95Å; L344-L367 HydrophobicContact CG-CD1 3.99Å; L344-L367 WeakPolarHBondContact O-CA 3.43Å; F354-L367 HydrophobicContact CE1-CD2 3.83Å; F354-L367 HydrophobicContact CZ-CD1 4.06Å; F354-L367 HydrophobicContact CZ-CD2 4.21Å; L364-L367 HydrophobicContact CD2-CB 4.16Å; L367-L369 HydrophobicContact CD1-CD2 3.89Å; L367-L369 HydrophobicContact CD1-CG 4.09Å; L367-L369 HydrophobicContact CD2-CD1 4.1Å; L367-L369 HydrophobicContact CD2-CG 4.32Å; L367-L369 HydrophobicContact CG-CD1 4.32Å; L367-L369 HydrophobicContact CG-CD2 4.35Å; L367-L369 HydrophobicContact CG-CG 3.99Å; L367-L382 HydrophobicContact CD2-CD2 4.03Å; L367-M385 HydrophobicContact CD2-CE 4.28Å; L367-M385 HydrophobicContact CD2-SD 3.74Å; L367-L388 HydrophobicContact CB-CD1 3.77Å; L367-S390 PolarHBondContact N-O 2.85Å; L367-L391 HydrophobicContact CB-CD1 4.13Å; L367-L391 HydrophobicContact CD2-CD1 3.94Å; L367-L391 HydrophobicContact CG-CD1 4.07Å; L367-L391 WeakPolarHBondContact O-CA 3.25Å; L367-K392 PolarHBondContact O-N 3.11Å
368	D	96.4	Very high	87.9	Confident	22 Å²	22	39.4 Å²	39.4	12%	0.118	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	117.4	175.1	-158.3	-25.9	0	0	0	110.4	L344 L345 V346 V347 S370 K392	L344-D368 PolarHBondContact O-N 3.33Å; L344-D368 VanDerWaalsContact O-N 3.07Å; L345-D368 HydrophobicContact CD2-CB 3.76Å; V346-D368 PolarHBondContact N-O 2.86Å; V347-D368 HydrophobicContact CG2-CB 3.82Å; V347-D368 WeakPolarHBondContact CG2-OD1 3.21Å; D368-S370 VanDerWaalsContact OD1-CB 3.29Å; D368-S370 WeakPolarHBondContact OD1-CB 3.41Å; D368-S370 PolarHBondContact OD1-N 3.44Å; D368-S370 VanDerWaalsContact OD1-N 3.07Å; D368-S370 PolarHBondContact OD1-OG 3.12Å; D368-K392 HydrophobicContact CB-CB 4.36Å; D368-K392 WeakPolarHBondContact OD1-CB 3.43Å
369	L	94.5	Very high	86.9	Confident	4 Å²	4	38.3 Å²	38.3	2%	0.021	19%	0.194	C	C	.	.			trans	-118.6	14.5	-179.5	-59.2	176	0	0	0	111.6	V346 F354 L367 N372 F374 K392 I393 S396	V346-L369 HydrophobicContact CB-CD2 4.06Å; V346-L369 HydrophobicContact CG2-CD2 4.23Å; F354-L369 HydrophobicContact CB-CD1 4.46Å; F354-L369 HydrophobicContact CD1-CD1 3.91Å; F354-L369 HydrophobicContact CD2-CD1 4.3Å; F354-L369 HydrophobicContact CD2-CD2 3.79Å; F354-L369 HydrophobicContact CE1-CD1 4.13Å; F354-L369 HydrophobicContact CE1-CD2 4.39Å; F354-L369 HydrophobicContact CE2-CD2 3.58Å; F354-L369 HydrophobicContact CG-CD1 3.98Å; F354-L369 HydrophobicContact CG-CD2 4.32Å; F354-L369 HydrophobicContact CZ-CD1 4.46Å; F354-L369 HydrophobicContact CZ-CD2 3.9Å; L367-L369 HydrophobicContact CD1-CD2 3.89Å; L367-L369 HydrophobicContact CD1-CG 4.09Å; L367-L369 HydrophobicContact CD2-CD1 4.1Å; L367-L369 HydrophobicContact CD2-CG 4.32Å; L367-L369 HydrophobicContact CG-CD1 4.32Å; L367-L369 HydrophobicContact CG-CD2 4.35Å; L367-L369 HydrophobicContact CG-CG 3.99Å; L369-N372 PolarHBondContact O-ND2 2.77Å; L369-F374 HydrophobicContact CB-CE2 3.9Å; L369-F374 HydrophobicContact CB-CZ 4.33Å; L369-F374 HydrophobicContact CD1-CE2 4.44Å; L369-F374 HydrophobicContact CD1-CZ 4.49Å; L369-K392 PolarHBondContact N-O 3.11Å; L369-I393 HydrophobicContact CB-CG1 4.39Å; L369-I393 HydrophobicContact CB-CG2 4.47Å; L369-S396 PolarHBondContact O-OG 3.48Å
370	S	95.8	Very high	85.7	Confident	13 Å²	13	40.1 Å²	40.1	9%	0.091	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	151.9	-174.4	-50.5	0	0	0	0	112.4	V347 N348 D368 N372 S394	V347-S370 CarbonylContact C-O 3.27Å; V347-S370 WeakPolarHBondContact CA-O 3.4Å; V347-S370 WeakPolarHBondContact CG1-O 3.49Å; N348-S370 PolarHBondContact N-O 2.61Å; D368-S370 VanDerWaalsContact OD1-CB 3.29Å; D368-S370 WeakPolarHBondContact OD1-CB 3.41Å; D368-S370 PolarHBondContact OD1-N 3.44Å; D368-S370 VanDerWaalsContact OD1-N 3.07Å; D368-S370 PolarHBondContact OD1-OG 3.12Å; S370-N372 VanDerWaalsContact C-N 3.32Å; S370-N372 PolarHBondContact O-N 3.24Å; S370-S394 CarbonylContact C-O 3.23Å; S370-S394 VanDerWaalsContact CA-O 3.25Å; S370-S394 WeakPolarHBondContact CA-O 3.47Å; S370-S394 PolarHBondContact OG-N 3.47Å; S370-S394 VanDerWaalsContact OG-N 3.1Å
371	G	94.8	Very high	84.4	Confident	18 Å²	18	38.9 Å²	38.9	19%	0.186	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.9	29.2	179.8	0	0	0	0	0	114.9	N348 N349 S394 S396	N348-G371 WeakPolarHBondContact CA-O 3.42Å; N348-G371 WeakPolarHBondContact OD1-CA 3.27Å; N349-G371 PolarHBondContact N-O 3.05Å; G371-S394 PolarHBondContact N-O 3.28Å; G371-S396 PolarHBondContact N-OG 2.66Å
372	N	92.2	Very high	83.5	Confident	9 Å²	9	39.1 Å²	39.1	5%	0.048	20%	0.202	C	C	.	.	S	Bend	trans	-101.8	-165.5	168	-77.3	-78.7	0	0	0	109.9	V346 N349 L351 L369 S370 F374 S396	V346-N372 PolarHBondContact O-ND2 3.46Å; N349-N372 WeakPolarHBondContact CA-OD1 3.48Å; N349-N372 WeakPolarHBondContact CB-OD1 3.36Å; N349-N372 PolarHBondContact O-OD1 2.74Å; L351-N372 HydrophobicContact CB-CB 4.19Å; L351-N372 VanDerWaalsContact CB-OD1 3.28Å; L351-N372 WeakPolarHBondContact CB-OD1 3.2Å; L351-N372 WeakPolarHBondContact CG-OD1 3.32Å; L351-N372 PolarHBondContact N-OD1 2.73Å; L369-N372 PolarHBondContact O-ND2 2.77Å; S370-N372 VanDerWaalsContact C-N 3.32Å; S370-N372 PolarHBondContact O-N 3.24Å; N372-F374 HydrophobicContact CB-CD2 4.15Å; N372-F374 HydrophobicContact CB-CE1 4.25Å; N372-F374 HydrophobicContact CB-CE2 3.47Å; N372-F374 VanDerWaalsContact CB-CE2 3.47Å; N372-F374 HydrophobicContact CB-CZ 3.53Å; N372-S396 PolarHBondContact N-OG 3.18Å; N372-S396 VanDerWaalsContact O-CA 3.26Å; N372-S396 WeakPolarHBondContact O-CA 3.4Å
373	H	88.3	Confident	82.8	Confident	76 Å²	76	44.4 Å²	44.4	35%	0.352	22%	0.222	S	C	.	.			trans	-129.3	88.9	178.9	-176.5	60.6	0	0	0	111.1	L351 E352 P375 S397	L351-H373 CarbonylContact O-C 3.32Å; L351-H373 PolarHBondContact O-N 2.92Å; E352-H373 WeakPolarHBondContact CA-O 3.5Å; H373-P375 VanDerWaalsContact C-CD 3.44Å; H373-P375 WeakPolarHBondContact O-CD 3.5Å; H373-S397 WeakPolarHBondContact ND1-CB 3.32Å; H373-S397 PolarHBondContact ND1-OG 3.31Å; H373-S397 VanDerWaalsContact ND1-OG 3.16Å
374	F	85.1	Confident	82.1	Confident	6 Å²	6	44.1 Å²	44.1	3%	0.026	22%	0.221	C	C	.	.			trans	-111.6	78.4	-179.1	-52.9	-60.2	0	0	0	111.8	L351 F354 L369 N372 D376 V377 I393 S396 V398	L351-F374 HydrophobicContact CB-CE1 3.83Å; L351-F374 HydrophobicContact CB-CZ 3.99Å; L351-F374 WeakPolarHBondContact O-CE1 3.3Å; F354-F374 HydrophobicContact CB-CE1 4.28Å; F354-F374 HydrophobicContact CB-CZ 4.46Å; L369-F374 HydrophobicContact CB-CE2 3.9Å; L369-F374 HydrophobicContact CB-CZ 4.33Å; L369-F374 HydrophobicContact CD1-CE2 4.44Å; L369-F374 HydrophobicContact CD1-CZ 4.49Å; N372-F374 HydrophobicContact CB-CD2 4.15Å; N372-F374 HydrophobicContact CB-CE1 4.25Å; N372-F374 HydrophobicContact CB-CE2 3.47Å; N372-F374 VanDerWaalsContact CB-CE2 3.47Å; N372-F374 HydrophobicContact CB-CZ 3.53Å; F374-D376 PolarHBondContact O-N 2.79Å; F374-V377 HydrophobicContact CB-CB 4.5Å; F374-V377 HydrophobicContact CB-CG2 3.57Å; F374-V377 WeakPolarHBondContact O-CG2 3.28Å; F374-I393 HydrophobicContact CD2-CG2 3.81Å; F374-I393 HydrophobicContact CE2-CG2 4.08Å; F374-S396 PolarHBondContact N-O 3.2Å; F374-V398 HydrophobicContact CB-CG2 4.46Å
375	P	73.7	Confident	81.9	Confident	58 Å²	58	44.1 Å²	44.1	38%	0.377	22%	0.221	S	C	.	.	S	Bend	trans	-62.6	-40.7	-179.1	23.4	-32	0	0	0	112.6	H373	H373-P375 VanDerWaalsContact C-CD 3.44Å; H373-P375 WeakPolarHBondContact O-CD 3.5Å
376	D	64.9	Low	81.6	Confident	129 Å²	129	43.7 Å²	43.7	69%	0.69	23%	0.226	S	C	*	.	S	Bend	trans	-118.7	86.5	176.7	-69.9	-37.9	0	0	0	109.5	F374 R378	F374-D376 PolarHBondContact O-N 2.79Å; D376-R378 PolarHBondContact O-N 2.76Å
377	V	62.2	Low	81.4	Confident	15 Å²	15	44.3 Å²	44.3	9%	0.091	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-77.2	98.3	-178.9	-156.3	0	0	0	0	111.1	F374 F379 V398	F374-V377 HydrophobicContact CB-CB 4.5Å; F374-V377 HydrophobicContact CB-CG2 3.57Å; F374-V377 WeakPolarHBondContact O-CG2 3.28Å; V377-F379 HydrophobicContact CB-CD2 3.9Å; V377-F379 HydrophobicContact CB-CE1 4.3Å; V377-F379 HydrophobicContact CB-CE2 3.46Å; V377-F379 VanDerWaalsContact CB-CE2 3.46Å; V377-F379 HydrophobicContact CB-CZ 3.71Å; V377-F379 HydrophobicContact CG1-CD1 3.57Å; V377-F379 HydrophobicContact CG1-CD2 3.59Å; V377-F379 HydrophobicContact CG1-CE1 3.22Å; V377-F379 HydrophobicContact CG1-CE2 3.28Å; V377-F379 HydrophobicContact CG1-CG 3.74Å; V377-F379 HydrophobicContact CG1-CZ 3.11Å; V377-F379 HydrophobicContact CG2-CE2 4.12Å; V377-F379 HydrophobicContact CG2-CZ 4.08Å; V377-F379 PolarHBondContact O-N 2.92Å; V377-V398 HydrophobicContact CG2-CB 4Å; V377-V398 HydrophobicContact CG2-CG1 3.56Å; V377-V398 HydrophobicContact CG2-CG2 3.43Å; V377-V398 VanDerWaalsContact CG2-CG2 3.43Å
378	R	61.9	Low	81.4	Confident	163 Å²	163	44.3 Å²	44.3	62%	0.615	23%	0.233	S	C	*	.			trans	-85.7	88.7	166.8	-59.6	-148.6	173	141	4.4	110.4	D376 S380 H381 E402	D376-R378 PolarHBondContact O-N 2.76Å; R378-S380 PolarHBondContact O-N 2.74Å; R378-H381 PolarHBondContact O-CD2 3.12Å; R378-H381 VanDerWaalsContact O-CD2 3.25Å; R378-E402 WeakPolarHBondContact CA-OE2 3.11Å; R378-E402 VanDerWaalsContact CD-OE1 3.3Å; R378-E402 WeakPolarHBondContact CD-OE1 3.44Å; R378-E402 VanDerWaalsContact CG-OE1 3.27Å; R378-E402 WeakPolarHBondContact CG-OE1 3.42Å; R378-E402 IonicContact NE-OE1 3.92Å; R378-E402 PolarHBondContact NE-OE1 3.22Å
379	F	63.6	Low	81.4	Confident	11 Å²	11	49.5 Å²	49.5	5%	0.048	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-72.2	7.1	-177.5	-72.3	-69.5	0	0	0	115.4	V377 H381 L382 I393 V401 A405	V377-F379 HydrophobicContact CB-CD2 3.9Å; V377-F379 HydrophobicContact CB-CE1 4.3Å; V377-F379 HydrophobicContact CB-CE2 3.46Å; V377-F379 VanDerWaalsContact CB-CE2 3.46Å; V377-F379 HydrophobicContact CB-CZ 3.71Å; V377-F379 HydrophobicContact CG1-CD1 3.57Å; V377-F379 HydrophobicContact CG1-CD2 3.59Å; V377-F379 HydrophobicContact CG1-CE1 3.22Å; V377-F379 HydrophobicContact CG1-CE2 3.28Å; V377-F379 HydrophobicContact CG1-CG 3.74Å; V377-F379 HydrophobicContact CG1-CZ 3.11Å; V377-F379 HydrophobicContact CG2-CE2 4.12Å; V377-F379 HydrophobicContact CG2-CZ 4.08Å; V377-F379 PolarHBondContact O-N 2.92Å; F379-H381 PolarHBondContact O-N 2.9Å; F379-L382 HydrophobicContact CB-CD1 4.21Å; F379-L382 HydrophobicContact CB-CG 4.47Å; F379-L382 HydrophobicContact CD1-CD1 3.76Å; F379-L382 HydrophobicContact CD1-CG 4.16Å; F379-L382 HydrophobicContact CG-CD1 4.3Å; F379-L382 PolarHBondContact O-N 3.12Å; F379-I393 HydrophobicContact CD1-CD1 4.45Å; F379-I393 HydrophobicContact CE1-CD1 3.18Å; F379-I393 HydrophobicContact CZ-CD1 3.32Å; F379-V401 HydrophobicContact CD2-CG1 3.92Å; F379-V401 HydrophobicContact CE2-CB 4.48Å; F379-V401 HydrophobicContact CE2-CG1 3.89Å; F379-V401 HydrophobicContact CE2-CG2 4.22Å; F379-A405 HydrophobicContact CB-CB 3.45Å; F379-A405 VanDerWaalsContact CB-CB 3.45Å; F379-A405 WeakPolarHBondContact CB-O 3.2Å; F379-A405 HydrophobicContact CD2-CB 3.62Å; F379-A405 HydrophobicContact CG-CB 3.88Å
380	S	63	Low	81.6	Confident	45 Å²	45	49.9 Å²	49.9	32%	0.315	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-48.8	-18.7	173	66.8	0	0	0	0	114.4	R378 K383	R378-S380 PolarHBondContact O-N 2.74Å; S380-K383 WeakPolarHBondContact O-CG 3.43Å
381	H	62.4	Low	81.6	Confident	54 Å²	54	49.2 Å²	49.2	25%	0.25	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-80.5	-12.2	177.3	-55.1	-75.2	0	0	0	115.7	F354 D355 R378 F379 K383	F354-H381 WeakPolarHBondContact O-CB 3.39Å; F354-H381 PolarHBondContact O-CD2 3.05Å; F354-H381 VanDerWaalsContact O-CG 3.28Å; D355-H381 IonicContact OD1-CE1 2.78Å; D355-H381 PolarHBondContact OD1-CE1 3.02Å; D355-H381 VanDerWaalsContact OD1-CE1 3.25Å; D355-H381 IonicContact OD1-ND1 3.68Å; D355-H381 PolarHBondContact OD1-ND1 3.07Å; D355-H381 IonicContact OD2-CE1 3.77Å; R378-H381 PolarHBondContact O-CD2 3.12Å; R378-H381 VanDerWaalsContact O-CD2 3.25Å; F379-H381 PolarHBondContact O-N 2.9Å; H381-K383 PolarHBondContact O-N 3.07Å
382	L	75.3	Confident	81.6	Confident	4 Å²	4	50.8 Å²	50.8	2%	0.021	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-70.7	-6	174.5	-65.6	179.8	0	0	0	113.1	L367 F379 G384 M385 L388 L391 F406 S409	L367-L382 HydrophobicContact CD2-CD2 4.03Å; F379-L382 HydrophobicContact CB-CD1 4.21Å; F379-L382 HydrophobicContact CB-CG 4.47Å; F379-L382 HydrophobicContact CD1-CD1 3.76Å; F379-L382 HydrophobicContact CD1-CG 4.16Å; F379-L382 HydrophobicContact CG-CD1 4.3Å; F379-L382 PolarHBondContact O-N 3.12Å; L382-G384 PolarHBondContact O-N 3.01Å; L382-M385 HydrophobicContact CD2-CE 3.9Å; L382-M385 HydrophobicContact CD2-SD 3.96Å; L382-M385 PolarHBondContact O-N 3.2Å; L382-L388 HydrophobicContact CD2-CD2 4.49Å; L382-L391 HydrophobicContact CD1-CD2 3.77Å; L382-F406 HydrophobicContact CD1-CD1 4.15Å; L382-F406 HydrophobicContact CD1-CE1 4.29Å; L382-S409 PolarHBondContact O-OG 2.8Å; L382-S409 VanDerWaalsContact O-OG 3.11Å
383	K	78.2	Confident	81.7	Confident	139 Å²	139	50.4 Å²	50.4	60%	0.604	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-52.9	-28.9	178.6	-74.9	-179.7	-177.9	178.4	0	114.5	S380 H381 M385	S380-K383 WeakPolarHBondContact O-CG 3.43Å; H381-K383 PolarHBondContact O-N 3.07Å; K383-M385 VanDerWaalsContact C-N 3.28Å; K383-M385 PolarHBondContact O-N 3.25Å
384	G	83	Confident	82	Confident	16 Å²	16	47.5 Å²	47.5	17%	0.165	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-80	6	178.8	0	0	0	0	0	115.8	F361 L382	F361-G384 CarbonylContact C-O 3.14Å; F361-G384 PolarHBondContact N-O 3.2Å; L382-G384 PolarHBondContact O-N 3.01Å
385	M	91.9	Very high	82.5	Confident	1 Å²	1	50 Å²	50	1%	0.005	25%	0.25	C	S	.	.			trans	-130.7	67.9	-171.1	-61.3	166.2	-126.4	0	0	112.3	F354 L356 F361 L364 L367 L382 K383 N387 L388 S409	F354-M385 HydrophobicContact CE1-CE 4.02Å; L356-M385 HydrophobicContact CD1-CE 3.55Å; F361-M385 HydrophobicContact CB-CG 4.12Å; F361-M385 HydrophobicContact CD2-CE 4.43Å; F361-M385 HydrophobicContact CD2-CG 4.19Å; L364-M385 HydrophobicContact CB-CG 4.47Å; L364-M385 HydrophobicContact CD2-CG 3.83Å; L364-M385 HydrophobicContact CD2-SD 3.56Å; L364-M385 VanDerWaalsContact CD2-SD 3.56Å; L367-M385 HydrophobicContact CD2-CE 4.28Å; L367-M385 HydrophobicContact CD2-SD 3.74Å; L382-M385 HydrophobicContact CD2-CE 3.9Å; L382-M385 HydrophobicContact CD2-SD 3.96Å; L382-M385 PolarHBondContact O-N 3.2Å; K383-M385 VanDerWaalsContact C-N 3.28Å; K383-M385 PolarHBondContact O-N 3.25Å; M385-N387 VanDerWaalsContact C-N 3.28Å; M385-N387 PolarHBondContact O-N 3.36Å; M385-L388 HydrophobicContact CB-CB 4.25Å; M385-L388 PolarHBondContact O-N 3.27Å; M385-S409 PolarHBondContact O-OG 2.83Å
386	P	92	Very high	83.4	Confident	63 Å²	63	47.2 Å²	47.2	41%	0.409	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-23.8	-173.3	27	-35.8	0	0	0	114.5	G408 Q411	P386-G408 WeakPolarHBondContact CA-O 3.15Å; P386-Q411 WeakPolarHBondContact O-CG 3.39Å
387	N	95.1	Very high	84.6	Confident	85 Å²	85	42.5 Å²	42.5	46%	0.455	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	12	-175.7	-74.4	-48.7	0	0	0	113.9	P362 L364 M385 R389	P362-N387 PolarHBondContact O-ND2 2.96Å; L364-N387 CarbonylContact O-C 3.44Å; M385-N387 VanDerWaalsContact C-N 3.28Å; M385-N387 PolarHBondContact O-N 3.36Å; N387-R389 WeakPolarHBondContact O-CG 3.48Å; N387-R389 PolarHBondContact O-N 3.1Å
388	L	95.7	Very high	86	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.205	C	C	.	.			trans	-62.2	126.9	-176.9	-167.9	67.5	0	0	0	110.9	L364 L367 L382 M385 L391 Q411 V412	L364-L388 HydrophobicContact CD2-CD1 4.19Å; L364-L388 HydrophobicContact CG-CD1 4.32Å; L364-L388 VanDerWaalsContact O-CA 3.3Å; L364-L388 WeakPolarHBondContact O-CA 3.23Å; L364-L388 PolarHBondContact O-N 3.43Å; L367-L388 HydrophobicContact CB-CD1 3.77Å; L382-L388 HydrophobicContact CD2-CD2 4.49Å; M385-L388 HydrophobicContact CB-CB 4.25Å; M385-L388 PolarHBondContact O-N 3.27Å; L388-L391 HydrophobicContact CD2-CB 4.09Å; L388-L391 HydrophobicContact CD2-CD1 4.28Å; L388-L391 HydrophobicContact CD2-CD2 4.43Å; L388-Q411 CarbonylContact O-C 3.46Å; L388-V412 HydrophobicContact CB-CG2 4.33Å; L388-V412 HydrophobicContact CD2-CG2 4.15Å; L388-V412 HydrophobicContact CG-CG2 4.2Å; L388-V412 WeakPolarHBondContact O-CA 3.09Å; L388-V412 PolarHBondContact O-N 3.12Å; L388-V412 VanDerWaalsContact O-N 3.12Å
389	R	96.9	Very high	87.2	Confident	131 Å²	131	35.7 Å²	35.7	49%	0.494	19%	0.193	S	C	.	.			trans	-113.2	-32	-178.5	-62	-177.3	-178.8	-171.7	-1.1	112.8	K365 N387 K413 E414	K365-R389 CarbonylContact O-C 3.58Å; K365-R389 WeakPolarHBondContact O-CA 3.39Å; K365-R389 PolarHBondContact O-N 2.94Å; N387-R389 WeakPolarHBondContact O-CG 3.48Å; N387-R389 PolarHBondContact O-N 3.1Å; R389-K413 WeakPolarHBondContact O-CA 3.37Å; R389-K413 PolarHBondContact O-N 2.91Å; R389-E414 PolarHBondContact O-N 2.97Å
390	S	97.8	Very high	88.3	Confident	11 Å²	11	38.5 Å²	38.5	8%	0.077	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	121.1	-179.1	-178.8	0	0	0	0	109	K365 K366 L367 E414	K365-S390 PolarHBondContact O-N 2.77Å; K366-S390 WeakPolarHBondContact CA-O 3.42Å; L367-S390 PolarHBondContact N-O 2.85Å; S390-E414 WeakPolarHBondContact CA-O 3.29Å; S390-E414 WeakPolarHBondContact CB-OE2 3.24Å; S390-E414 PolarHBondContact OG-OE2 2.97Å
391	L	95.4	Very high	89.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	119.9	177.1	178	60.5	0	0	0	109.1	L367 L382 L388 I393 F406 E414 L415 C416	L367-L391 HydrophobicContact CB-CD1 4.13Å; L367-L391 HydrophobicContact CD2-CD1 3.94Å; L367-L391 HydrophobicContact CG-CD1 4.07Å; L367-L391 WeakPolarHBondContact O-CA 3.25Å; L382-L391 HydrophobicContact CD1-CD2 3.77Å; L388-L391 HydrophobicContact CD2-CB 4.09Å; L388-L391 HydrophobicContact CD2-CD1 4.28Å; L388-L391 HydrophobicContact CD2-CD2 4.43Å; L391-I393 HydrophobicContact CD1-CD1 4Å; L391-I393 HydrophobicContact CD1-CG1 4.02Å; L391-I393 HydrophobicContact CD2-CD1 4.15Å; L391-I393 HydrophobicContact CG-CD1 4.02Å; L391-I393 HydrophobicContact CG-CG1 4.13Å; L391-F406 HydrophobicContact CD2-CD1 4.48Å; L391-F406 HydrophobicContact CD2-CE1 3.76Å; L391-E414 PolarHBondContact N-O 2.98Å; L391-L415 HydrophobicContact CB-CD1 4.21Å; L391-L415 HydrophobicContact CD2-CD1 4.02Å; L391-L415 HydrophobicContact CG-CD1 4.17Å; L391-L415 WeakPolarHBondContact O-CA 3.45Å; L391-C416 PolarHBondContact O-N 3.06Å
392	K	95.8	Very high	90.6	Very high	50 Å²	50	37.7 Å²	37.7	22%	0.217	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	129.4	179.9	-57.2	-165.3	178.7	-154.1	0	110.9	L367 D368 L369 E414 C416	L367-K392 PolarHBondContact O-N 3.11Å; D368-K392 HydrophobicContact CB-CB 4.36Å; D368-K392 WeakPolarHBondContact OD1-CB 3.43Å; L369-K392 PolarHBondContact N-O 3.11Å; K392-E414 WeakPolarHBondContact CE-OE1 3.32Å; K392-E414 IonicContact NZ-OE1 3.13Å; K392-E414 PolarHBondContact NZ-OE1 3.01Å; K392-C416 HydrophobicContact CB-CB 4.2Å; K392-C416 HydrophobicContact CD-CB 4.43Å; K392-C416 HydrophobicContact CG-CB 3.93Å
393	I	93.4	Very high	90.9	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	24%	0.244	C	C	.	.			trans	-147.4	52.4	-176.6	-41	174.7	0	0	0	107.9	L369 F374 F379 L391 V398 C416 L417 N420	L369-I393 HydrophobicContact CB-CG1 4.39Å; L369-I393 HydrophobicContact CB-CG2 4.47Å; F374-I393 HydrophobicContact CD2-CG2 3.81Å; F374-I393 HydrophobicContact CE2-CG2 4.08Å; F379-I393 HydrophobicContact CD1-CD1 4.45Å; F379-I393 HydrophobicContact CE1-CD1 3.18Å; F379-I393 HydrophobicContact CZ-CD1 3.32Å; L391-I393 HydrophobicContact CD1-CD1 4Å; L391-I393 HydrophobicContact CD1-CG1 4.02Å; L391-I393 HydrophobicContact CD2-CD1 4.15Å; L391-I393 HydrophobicContact CG-CD1 4.02Å; L391-I393 HydrophobicContact CG-CG1 4.13Å; I393-V398 HydrophobicContact CG2-CG2 4.24Å; I393-C416 PolarHBondContact N-O 3.35Å; I393-L417 HydrophobicContact CB-CD2 4.07Å; I393-L417 HydrophobicContact CD1-CD2 4.32Å; I393-N420 PolarHBondContact O-ND2 3.38Å
394	S	94.7	Very high	91.1	Very high	15 Å²	15	42.4 Å²	42.4	11%	0.105	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	155.3	178.7	-54.8	0	0	0	0	111.2	S370 G371 S396 C416 A418	S370-S394 CarbonylContact C-O 3.23Å; S370-S394 VanDerWaalsContact CA-O 3.25Å; S370-S394 WeakPolarHBondContact CA-O 3.47Å; S370-S394 PolarHBondContact OG-N 3.47Å; S370-S394 VanDerWaalsContact OG-N 3.1Å; G371-S394 PolarHBondContact N-O 3.28Å; S394-S396 PolarHBondContact O-N 3.16Å; S394-S396 PolarHBondContact O-OG 3.29Å; S394-C416 PolarHBondContact OG-SG 3.02Å; S394-A418 CarbonylContact C-O 3.59Å; S394-A418 WeakPolarHBondContact CA-O 3.37Å; S394-A418 WeakPolarHBondContact CB-O 3.34Å
395	D	95.1	Very high	91.2	Very high	59 Å²	59	41.7 Å²	41.7	32%	0.316	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	38.3	170.8	-56.9	-70.2	0	0	0	113.2	A418 G419	D395-A418 PolarHBondContact N-O 3.35Å; D395-G419 WeakPolarHBondContact CA-O 3.41Å; D395-G419 WeakPolarHBondContact OD1-CA 3.3Å
396	S	92.8	Very high	91	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.226	C	C	.	.	S	Bend	trans	-114.3	18.2	-170.9	-62.9	0	0	0	0	113.2	L369 G371 N372 F374 S394 V398 N420	L369-S396 PolarHBondContact O-OG 3.48Å; G371-S396 PolarHBondContact N-OG 2.66Å; N372-S396 PolarHBondContact N-OG 3.18Å; N372-S396 VanDerWaalsContact O-CA 3.26Å; N372-S396 WeakPolarHBondContact O-CA 3.4Å; F374-S396 PolarHBondContact N-O 3.2Å; S394-S396 PolarHBondContact O-N 3.16Å; S394-S396 PolarHBondContact O-OG 3.29Å; S396-V398 PolarHBondContact O-N 2.92Å; S396-N420 WeakPolarHBondContact CA-OD1 3.48Å; S396-N420 PolarHBondContact N-OD1 3.18Å
397	S	91.2	Very high	90.6	Very high	29 Å²	29	42.4 Å²	42.4	20%	0.203	23%	0.229	C	C	.	.			trans	58.5	24.4	179.1	-52.6	0	0	0	0	114.9	H373 G399 N420	H373-S397 WeakPolarHBondContact ND1-CB 3.32Å; H373-S397 PolarHBondContact ND1-OG 3.31Å; H373-S397 VanDerWaalsContact ND1-OG 3.16Å; S397-G399 PolarHBondContact O-N 2.66Å; S397-N420 PolarHBondContact N-OD1 3.01Å; S397-N420 VanDerWaalsContact N-OD1 3.11Å
398	V	90.4	Very high	90.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.218	C	C	.	.			trans	-68.8	115.7	-175.6	179.6	0	0	0	0	110.6	F374 V377 I393 S396 S400 V401 N420 F421 L422	F374-V398 HydrophobicContact CB-CG2 4.46Å; V377-V398 HydrophobicContact CG2-CB 4Å; V377-V398 HydrophobicContact CG2-CG1 3.56Å; V377-V398 HydrophobicContact CG2-CG2 3.43Å; V377-V398 VanDerWaalsContact CG2-CG2 3.43Å; I393-V398 HydrophobicContact CG2-CG2 4.24Å; S396-V398 PolarHBondContact O-N 2.92Å; V398-S400 WeakPolarHBondContact CG1-O 3.02Å; V398-V401 HydrophobicContact CG1-CG2 4.32Å; V398-N420 HydrophobicContact CB-CB 3.94Å; V398-N420 WeakPolarHBondContact CB-OD1 3.26Å; V398-N420 WeakPolarHBondContact CG2-OD1 3.34Å; V398-N420 PolarHBondContact N-OD1 3.27Å; V398-F421 CarbonylContact O-C 3.15Å; V398-F421 WeakPolarHBondContact O-CA 3.46Å; V398-F421 PolarHBondContact O-N 3.09Å; V398-L422 HydrophobicContact CG1-CD2 4.17Å; V398-L422 PolarHBondContact O-N 3.16Å
399	G	88.2	Confident	89.8	Confident	36 Å²	36	39.4 Å²	39.4	37%	0.371	22%	0.218	S	C	.	.			trans	-87.8	-32.8	177.5	0	0	0	0	0	114.4	S397	S397-G399 PolarHBondContact O-N 2.66Å
400	S	87.1	Confident	89.5	Confident	69 Å²	69	35.4 Å²	35.4	48%	0.483	21%	0.208	S	C	.	.			trans	-154.6	164.9	179.4	69.2	0	0	0	0	111.5	V398	V398-S400 WeakPolarHBondContact CG1-O 3.02Å
401	V	88.1	Confident	89.3	Confident	21 Å²	21	38.6 Å²	38.6	13%	0.127	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-125.1	125.5	176.6	-179.6	0	0	0	0	108	F379 V398 A405 F406 L417 L422 P426 V428	F379-V401 HydrophobicContact CD2-CG1 3.92Å; F379-V401 HydrophobicContact CE2-CB 4.48Å; F379-V401 HydrophobicContact CE2-CG1 3.89Å; F379-V401 HydrophobicContact CE2-CG2 4.22Å; V398-V401 HydrophobicContact CG1-CG2 4.32Å; V401-A405 HydrophobicContact CG1-CB 3.68Å; V401-F406 HydrophobicContact CG1-CE2 4.26Å; V401-F406 HydrophobicContact CG1-CZ 4.39Å; V401-L417 HydrophobicContact CG2-CD1 4.26Å; V401-L422 HydrophobicContact CG2-CD2 4.24Å; V401-P426 HydrophobicContact CB-CB 3.94Å; V401-P426 HydrophobicContact CB-CG 4Å; V401-P426 HydrophobicContact CG1-CB 4.44Å; V401-P426 HydrophobicContact CG2-CB 4.21Å; V401-P426 HydrophobicContact CG2-CG 3.7Å; V401-V428 HydrophobicContact CG1-CG1 3.79Å
402	E	84.2	Confident	89.3	Confident	61 Å²	61	38.6 Å²	38.6	29%	0.285	22%	0.222	S	C	.	.			trans	-64	154.9	180	-67.5	-176.7	153.7	0	0	112.8	R378 D404 A405	R378-E402 WeakPolarHBondContact CA-OE2 3.11Å; R378-E402 VanDerWaalsContact CD-OE1 3.3Å; R378-E402 WeakPolarHBondContact CD-OE1 3.44Å; R378-E402 VanDerWaalsContact CG-OE1 3.27Å; R378-E402 WeakPolarHBondContact CG-OE1 3.42Å; R378-E402 IonicContact NE-OE1 3.92Å; R378-E402 PolarHBondContact NE-OE1 3.22Å; E402-D404 VanDerWaalsContact C-N 3.29Å; E402-D404 PolarHBondContact O-N 2.9Å; E402-A405 WeakPolarHBondContact O-CB 3.21Å; E402-A405 PolarHBondContact O-N 3.47Å
403	E	82.6	Confident	89.4	Confident	170 Å²	170	40.5 Å²	40.5	79%	0.794	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-20.9	-174	-64.6	-171.1	163.5	0	0	114.1	V428	E403-V428 WeakPolarHBondContact O-CG2 3.46Å
404	D	82.6	Confident	89.6	Confident	72 Å²	72	43.4 Å²	43.4	39%	0.385	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	8.6	178.8	70.4	-28.3	0	0	0	113.3	E402 F406 V407	E402-D404 VanDerWaalsContact C-N 3.29Å; E402-D404 PolarHBondContact O-N 2.9Å; D404-F406 VanDerWaalsContact C-N 3.25Å; D404-F406 PolarHBondContact O-N 2.85Å; D404-F406 VanDerWaalsContact O-N 3.08Å; D404-V407 HydrophobicContact CB-CG2 3.87Å; D404-V407 WeakPolarHBondContact O-CB 3.48Å; D404-V407 VanDerWaalsContact O-CG2 3.27Å; D404-V407 WeakPolarHBondContact O-CG2 3.27Å; D404-V407 PolarHBondContact O-N 2.92Å; D404-V407 VanDerWaalsContact O-N 3.15Å
405	A	83.8	Confident	89.7	Confident	2 Å²	2	42.7 Å²	42.7	2%	0.017	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-39.1	-172.3	0	0	0	0	0	114.8	F379 V401 E402	F379-A405 HydrophobicContact CB-CB 3.45Å; F379-A405 VanDerWaalsContact CB-CB 3.45Å; F379-A405 WeakPolarHBondContact CB-O 3.2Å; F379-A405 HydrophobicContact CD2-CB 3.62Å; F379-A405 HydrophobicContact CG-CB 3.88Å; V401-A405 HydrophobicContact CG1-CB 3.68Å; E402-A405 WeakPolarHBondContact O-CB 3.21Å; E402-A405 PolarHBondContact O-N 3.47Å
406	F	87.3	Confident	89.8	Confident	1 Å²	1	40.6 Å²	40.6	0%	0.004	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106	9.4	-173.8	-57.7	-56.3	0	0	0	114.3	L382 L391 V401 D404 G408 S409 T410 L415 V428 L432	L382-F406 HydrophobicContact CD1-CD1 4.15Å; L382-F406 HydrophobicContact CD1-CE1 4.29Å; L391-F406 HydrophobicContact CD2-CD1 4.48Å; L391-F406 HydrophobicContact CD2-CE1 3.76Å; V401-F406 HydrophobicContact CG1-CE2 4.26Å; V401-F406 HydrophobicContact CG1-CZ 4.39Å; D404-F406 VanDerWaalsContact C-N 3.25Å; D404-F406 PolarHBondContact O-N 2.85Å; D404-F406 VanDerWaalsContact O-N 3.08Å; F406-G408 PolarHBondContact O-N 3.39Å; F406-G408 VanDerWaalsContact O-N 3.15Å; F406-S409 CarbonylContact O-C 3.34Å; F406-S409 PolarHBondContact O-N 3.29Å; F406-T410 PolarHBondContact O-N 2.5Å; F406-L415 HydrophobicContact CE1-CD1 4.27Å; F406-L415 HydrophobicContact CE2-CD2 4.02Å; F406-L415 HydrophobicContact CZ-CD1 4.03Å; F406-L415 HydrophobicContact CZ-CD2 3.73Å; F406-V428 HydrophobicContact CD2-CB 4.44Å; F406-V428 HydrophobicContact CD2-CG1 3.78Å; F406-V428 HydrophobicContact CD2-CG2 3.94Å; F406-V428 HydrophobicContact CE2-CG1 3.73Å; F406-L432 HydrophobicContact CB-CD2 3.67Å; F406-L432 HydrophobicContact CB-CG 4.4Å; F406-L432 HydrophobicContact CD2-CD1 3.96Å; F406-L432 HydrophobicContact CD2-CD2 4.32Å; F406-L432 HydrophobicContact CD2-CG 4.2Å; F406-L432 HydrophobicContact CE2-CD1 4.18Å; F406-L432 HydrophobicContact CG-CD1 4.23Å; F406-L432 HydrophobicContact CG-CD2 3.94Å; F406-L432 HydrophobicContact CG-CG 4.33Å
407	V	84.9	Confident	90	Very high	77 Å²	77	40.6 Å²	40.6	47%	0.467	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-36.6	-176.7	170.7	0	0	0	0	112.5	D404 M431	D404-V407 HydrophobicContact CB-CG2 3.87Å; D404-V407 WeakPolarHBondContact O-CB 3.48Å; D404-V407 VanDerWaalsContact O-CG2 3.27Å; D404-V407 WeakPolarHBondContact O-CG2 3.27Å; D404-V407 PolarHBondContact O-N 2.92Å; D404-V407 VanDerWaalsContact O-N 3.15Å; V407-M431 HydrophobicContact CG2-CE 3.87Å; V407-M431 HydrophobicContact CG2-SD 4.42Å
408	G	83.6	Confident	90.3	Very high	22 Å²	22	39.9 Å²	39.9	23%	0.227	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-11.2	179.4	0	0	0	0	0	115.8	P386 F406	P386-G408 WeakPolarHBondContact CA-O 3.15Å; F406-G408 PolarHBondContact O-N 3.39Å; F406-G408 VanDerWaalsContact O-N 3.15Å
409	S	90.8	Very high	90.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.229	C	C	.	.			trans	-135.9	50.7	-171.7	-60.6	0	0	0	0	111.1	L382 M385 F406 Q411 V412	L382-S409 PolarHBondContact O-OG 2.8Å; L382-S409 VanDerWaalsContact O-OG 3.11Å; M385-S409 PolarHBondContact O-OG 2.83Å; F406-S409 CarbonylContact O-C 3.34Å; F406-S409 PolarHBondContact O-N 3.29Å; S409-Q411 PolarHBondContact O-N 3.23Å; S409-Q411 VanDerWaalsContact O-N 3.14Å; S409-V412 VanDerWaalsContact O-CG2 3.27Å; S409-V412 WeakPolarHBondContact O-CG2 3.21Å; S409-V412 PolarHBondContact O-N 2.91Å
410	T	90.9	Very high	90.8	Very high	47 Å²	47	38.8 Å²	38.8	29%	0.288	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-9.2	-178.5	56.7	0	0	0	0	114.1	F406 V412	F406-T410 PolarHBondContact O-N 2.5Å; T410-V412 VanDerWaalsContact C-N 3.29Å; T410-V412 PolarHBondContact O-N 3.44Å
411	Q	93.5	Very high	91.1	Very high	78 Å²	78	39 Å²	39	36%	0.364	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	0.9	-179.8	-60	-55.9	-53.1	0	0	114.4	P386 L388 S409 K413 N434	P386-Q411 WeakPolarHBondContact O-CG 3.39Å; L388-Q411 CarbonylContact O-C 3.46Å; S409-Q411 PolarHBondContact O-N 3.23Å; S409-Q411 VanDerWaalsContact O-N 3.14Å; Q411-K413 PolarHBondContact O-N 2.87Å; Q411-N434 PolarHBondContact OE1-ND2 3.37Å
412	V	95.5	Very high	91.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.199	C	C	.	.			trans	-59.3	126.7	-178.8	171.6	0	0	0	0	110.5	L388 S409 T410 E414 L415 L432 N434 L435	L388-V412 HydrophobicContact CB-CG2 4.33Å; L388-V412 HydrophobicContact CD2-CG2 4.15Å; L388-V412 HydrophobicContact CG-CG2 4.2Å; L388-V412 WeakPolarHBondContact O-CA 3.09Å; L388-V412 PolarHBondContact O-N 3.12Å; L388-V412 VanDerWaalsContact O-N 3.12Å; S409-V412 VanDerWaalsContact O-CG2 3.27Å; S409-V412 WeakPolarHBondContact O-CG2 3.21Å; S409-V412 PolarHBondContact O-N 2.91Å; T410-V412 VanDerWaalsContact C-N 3.29Å; T410-V412 PolarHBondContact O-N 3.44Å; V412-E414 WeakPolarHBondContact CG1-O 2.87Å; V412-L415 HydrophobicContact CG1-CB 4.2Å; V412-L432 HydrophobicContact CB-CD1 4.3Å; V412-L432 HydrophobicContact CB-CD2 4.04Å; V412-L432 HydrophobicContact CG1-CD1 4.26Å; V412-N434 CarbonylContact O-C 3.47Å; V412-L435 HydrophobicContact CG1-CD1 4.21Å; V412-L435 PolarHBondContact O-N 3.43Å
413	K	97.4	Very high	91.9	Very high	91 Å²	91	39.2 Å²	39.2	40%	0.396	21%	0.21	S	C	.	.			trans	-105.3	-30.8	177.9	-62.2	-164.8	174.7	-168.4	0	112.7	R389 Q411 N434 T436 N437	R389-K413 WeakPolarHBondContact O-CA 3.37Å; R389-K413 PolarHBondContact O-N 2.91Å; Q411-K413 PolarHBondContact O-N 2.87Å; K413-N434 HydrophobicContact CG-CB 4.45Å; K413-T436 HydrophobicContact CB-CG2 4.49Å; K413-T436 WeakPolarHBondContact O-CA 3.05Å; K413-T436 PolarHBondContact O-N 3.32Å; K413-T436 PolarHBondContact O-OG1 2.9Å; K413-N437 PolarHBondContact O-N 3.24Å
414	E	97.9	Very high	92.4	Very high	61 Å²	61	37 Å²	37	29%	0.285	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	118.7	178.7	-177.3	-170.4	-171.6	0	0	108.4	R389 S390 L391 K392 V412 N437	R389-E414 PolarHBondContact O-N 2.97Å; S390-E414 WeakPolarHBondContact CA-O 3.29Å; S390-E414 WeakPolarHBondContact CB-OE2 3.24Å; S390-E414 PolarHBondContact OG-OE2 2.97Å; L391-E414 PolarHBondContact N-O 2.98Å; K392-E414 WeakPolarHBondContact CE-OE1 3.32Å; K392-E414 IonicContact NZ-OE1 3.13Å; K392-E414 PolarHBondContact NZ-OE1 3.01Å; V412-E414 WeakPolarHBondContact CG1-O 2.87Å; E414-N437 WeakPolarHBondContact CA-O 3.15Å; E414-N437 HydrophobicContact CG-CB 4.3Å
415	L	96.8	Very high	93	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	119.6	174.9	178.8	61.3	0	0	0	109.2	L391 F406 V412 L417 I429 L432 L435 N437 L438 D439	L391-L415 HydrophobicContact CB-CD1 4.21Å; L391-L415 HydrophobicContact CD2-CD1 4.02Å; L391-L415 HydrophobicContact CG-CD1 4.17Å; L391-L415 WeakPolarHBondContact O-CA 3.45Å; F406-L415 HydrophobicContact CE1-CD1 4.27Å; F406-L415 HydrophobicContact CE2-CD2 4.02Å; F406-L415 HydrophobicContact CZ-CD1 4.03Å; F406-L415 HydrophobicContact CZ-CD2 3.73Å; V412-L415 HydrophobicContact CG1-CB 4.2Å; L415-L417 HydrophobicContact CD1-CD1 4.39Å; L415-L417 HydrophobicContact CD1-CG 4.18Å; L415-L417 HydrophobicContact CD2-CD1 4.14Å; L415-L417 HydrophobicContact CG-CD1 4.25Å; L415-L417 HydrophobicContact CG-CG 4.27Å; L415-I429 HydrophobicContact CD2-CG2 4.21Å; L415-L432 HydrophobicContact CD2-CD1 3.99Å; L415-L435 HydrophobicContact CB-CD1 3.82Å; L415-N437 PolarHBondContact N-O 3.25Å; L415-L438 HydrophobicContact CB-CD1 4.12Å; L415-L438 HydrophobicContact CD2-CD1 3.95Å; L415-L438 HydrophobicContact CG-CD1 4.12Å; L415-L438 WeakPolarHBondContact O-CA 3.43Å; L415-D439 PolarHBondContact O-N 2.68Å
416	C	97.2	Very high	93.3	Very high	14 Å²	14	34 Å²	34	10%	0.095	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	116.8	177.1	-169.7	0	0	0	0	109.9	L391 K392 I393 S394 D439	L391-C416 PolarHBondContact O-N 3.06Å; K392-C416 HydrophobicContact CB-CB 4.2Å; K392-C416 HydrophobicContact CD-CB 4.43Å; K392-C416 HydrophobicContact CG-CB 3.93Å; I393-C416 PolarHBondContact N-O 3.35Å; S394-C416 PolarHBondContact OG-SG 3.02Å; C416-D439 HydrophobicContact CB-CB 4.33Å
417	L	95.7	Very high	93.5	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	21%	0.213	C	C	.	.			trans	-125.9	31.4	177.2	-67.9	169.6	0	0	0	109.9	I393 V401 L415 N420 L422 D439 L440 N443	I393-L417 HydrophobicContact CB-CD2 4.07Å; I393-L417 HydrophobicContact CD1-CD2 4.32Å; V401-L417 HydrophobicContact CG2-CD1 4.26Å; L415-L417 HydrophobicContact CD1-CD1 4.39Å; L415-L417 HydrophobicContact CD1-CG 4.18Å; L415-L417 HydrophobicContact CD2-CD1 4.14Å; L415-L417 HydrophobicContact CG-CD1 4.25Å; L415-L417 HydrophobicContact CG-CG 4.27Å; L417-N420 VanDerWaalsContact C-ND2 3.26Å; L417-N420 PolarHBondContact O-ND2 3.12Å; L417-L422 HydrophobicContact CB-CD1 4.12Å; L417-L422 HydrophobicContact CD1-CD1 4.22Å; L417-D439 PolarHBondContact N-O 3.22Å; L417-L440 HydrophobicContact CB-CD2 3.94Å; L417-L440 HydrophobicContact CD1-CD2 4.11Å; L417-N443 PolarHBondContact O-ND2 3.37Å
418	A	97.3	Very high	93.7	Very high	13 Å²	13	37.5 Å²	37.5	11%	0.107	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	155.2	-176.9	0	0	0	0	0	112.2	S394 D395 N420 S441	S394-A418 CarbonylContact C-O 3.59Å; S394-A418 WeakPolarHBondContact CA-O 3.37Å; S394-A418 WeakPolarHBondContact CB-O 3.34Å; D395-A418 PolarHBondContact N-O 3.35Å; A418-N420 VanDerWaalsContact C-N 3.28Å; A418-N420 PolarHBondContact O-N 3.37Å; A418-N420 PolarHBondContact O-ND2 3.3Å; A418-S441 CarbonylContact C-O 3.52Å; A418-S441 WeakPolarHBondContact CA-O 3.13Å; A418-S441 WeakPolarHBondContact CB-O 3.34Å
419	G	95.8	Very high	94.2	Very high	10 Å²	10	36.5 Å²	36.5	10%	0.103	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	24.2	173.8	0	0	0	0	0	115.1	D395 S441 G442	D395-G419 WeakPolarHBondContact CA-O 3.41Å; D395-G419 WeakPolarHBondContact OD1-CA 3.3Å; G419-S441 PolarHBondContact N-O 3.37Å; G419-G442 CarbonylContact C-O 3.34Å; G419-G442 VanDerWaalsContact CA-O 3.27Å; G419-G442 WeakPolarHBondContact CA-O 3.29Å
420	N	93.7	Very high	94.2	Very high	3 Å²	3	40.8 Å²	40.8	2%	0.016	20%	0.199	C	C	.	.	S	Bend	trans	-104.9	-169.5	-179	-76.1	-60.4	0	0	0	111.9	I393 S396 S397 V398 L417 A418 L422 G442 N443	I393-N420 PolarHBondContact O-ND2 3.38Å; S396-N420 WeakPolarHBondContact CA-OD1 3.48Å; S396-N420 PolarHBondContact N-OD1 3.18Å; S397-N420 PolarHBondContact N-OD1 3.01Å; S397-N420 VanDerWaalsContact N-OD1 3.11Å; V398-N420 HydrophobicContact CB-CB 3.94Å; V398-N420 WeakPolarHBondContact CB-OD1 3.26Å; V398-N420 WeakPolarHBondContact CG2-OD1 3.34Å; V398-N420 PolarHBondContact N-OD1 3.27Å; L417-N420 VanDerWaalsContact C-ND2 3.26Å; L417-N420 PolarHBondContact O-ND2 3.12Å; A418-N420 VanDerWaalsContact C-N 3.28Å; A418-N420 PolarHBondContact O-N 3.37Å; A418-N420 PolarHBondContact O-ND2 3.3Å; N420-L422 HydrophobicContact CB-CG 4.48Å; N420-G442 PolarHBondContact N-O 3.2Å; N420-N443 VanDerWaalsContact CA-OD1 3.32Å; N420-N443 WeakPolarHBondContact CA-OD1 3.35Å; N420-N443 WeakPolarHBondContact CB-OD1 3.18Å; N420-N443 PolarHBondContact N-OD1 3.19Å; N420-N443 PolarHBondContact O-OD1 3.07Å
421	F	94	Very high	94.1	Very high	73 Å²	73	42.2 Å²	42.2	32%	0.32	20%	0.204	S	C	.	.			trans	-107.3	24.7	-178.4	-55.7	-41.7	0	0	0	113.1	V398 V423 N443	V398-F421 CarbonylContact O-C 3.15Å; V398-F421 WeakPolarHBondContact O-CA 3.46Å; V398-F421 PolarHBondContact O-N 3.09Å; F421-V423 PolarHBondContact O-N 3.23Å; F421-N443 PolarHBondContact N-OD1 2.85Å
422	L	93.8	Very high	94.1	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.016	19%	0.186	C	C	.	.			trans	-65.8	124.3	-178.4	-61	171.1	0	0	0	110.6	V398 V401 L417 N420 P426 L440 N443 R444 I445	V398-L422 HydrophobicContact CG1-CD2 4.17Å; V398-L422 PolarHBondContact O-N 3.16Å; V401-L422 HydrophobicContact CG2-CD2 4.24Å; L417-L422 HydrophobicContact CB-CD1 4.12Å; L417-L422 HydrophobicContact CD1-CD1 4.22Å; N420-L422 HydrophobicContact CB-CG 4.48Å; L422-P426 HydrophobicContact CD1-CG 4.3Å; L422-P426 HydrophobicContact CD2-CG 4.45Å; L422-L440 HydrophobicContact CD1-CD2 3.85Å; L422-N443 HydrophobicContact CB-CB 4.17Å; L422-N443 VanDerWaalsContact CB-OD1 3.26Å; L422-N443 WeakPolarHBondContact CB-OD1 3.14Å; L422-N443 WeakPolarHBondContact CG-OD1 3.3Å; L422-N443 PolarHBondContact N-OD1 2.6Å; L422-R444 CarbonylContact O-C 3.41Å; L422-R444 VanDerWaalsContact O-C 3.28Å; L422-R444 WeakPolarHBondContact O-CA 3.44Å; L422-R444 PolarHBondContact O-N 3.44Å; L422-I445 PolarHBondContact O-N 2.95Å
423	V	95	Very high	94	Very high	84 Å²	84	41.9 Å²	41.9	51%	0.509	21%	0.207	S	C	.	.	S	Bend	trans	-87.8	-18.2	176	-177.7	0	0	0	0	111.8	F421 I445	F421-V423 PolarHBondContact O-N 3.23Å; V423-I445 WeakPolarHBondContact O-CA 3.45Å
424	Q	93.7	Very high	93.9	Very high	123 Å²	123	40.3 Å²	40.3	58%	0.575	20%	0.203	S	C	*	.	S	Bend	trans	-145.3	154.7	179.9	64.3	-176	21.8	0	0	109.9
425	V	94	Very high	93.8	Very high	4 Å²	4	37.4 Å²	37.4	2%	0.024	19%	0.19	C	C	.	.			trans	-65.1	128.7	170.5	-177.8	0	0	0	0	109.4	K427 I429 L440 I445 L452 L464	V425-K427 PolarHBondContact O-N 3.16Å; V425-I429 HydrophobicContact CG1-CD1 3.6Å; V425-L440 HydrophobicContact CB-CD1 4.26Å; V425-L440 HydrophobicContact CG1-CD1 3.64Å; V425-L440 HydrophobicContact CG2-CD1 3.96Å; V425-I445 HydrophobicContact CG2-CD1 4Å; V425-I445 HydrophobicContact CG2-CG2 4.22Å; V425-L452 HydrophobicContact CB-CD1 4.42Å; V425-L452 HydrophobicContact CB-CD2 3.44Å; V425-L452 VanDerWaalsContact CB-CD2 3.44Å; V425-L452 HydrophobicContact CB-CG 4.45Å; V425-L452 HydrophobicContact CG1-CD1 4.36Å; V425-L452 HydrophobicContact CG1-CD2 3.65Å; V425-L452 HydrophobicContact CG1-CG 4.32Å; V425-L452 HydrophobicContact CG2-CD2 3.75Å; V425-L464 HydrophobicContact CG2-CD2 4.25Å
426	P	91.7	Very high	93.9	Very high	9 Å²	9	39.3 Å²	39.3	6%	0.058	20%	0.201	C	C	.	.			trans	-61.6	125.7	179.2	-24.9	34.7	0	0	0	112.6	V401 L422 V428 I429	V401-P426 HydrophobicContact CB-CB 3.94Å; V401-P426 HydrophobicContact CB-CG 4Å; V401-P426 HydrophobicContact CG1-CB 4.44Å; V401-P426 HydrophobicContact CG2-CB 4.21Å; V401-P426 HydrophobicContact CG2-CG 3.7Å; L422-P426 HydrophobicContact CD1-CG 4.3Å; L422-P426 HydrophobicContact CD2-CG 4.45Å; P426-V428 HydrophobicContact CB-CG1 4.05Å; P426-V428 PolarHBondContact O-N 2.94Å; P426-I429 HydrophobicContact CB-CG2 4.42Å; P426-I429 VanDerWaalsContact O-CG1 3.27Å; P426-I429 WeakPolarHBondContact O-CG1 3.47Å; P426-I429 WeakPolarHBondContact O-CG2 3.29Å; P426-I429 PolarHBondContact O-N 3.23Å
427	K	90.8	Very high	93.9	Very high	139 Å²	139	41.9 Å²	41.9	60%	0.604	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-65.3	-26.5	-179	-63.7	177.1	-175.6	171.8	0	113.4	V425 I429 R430	V425-K427 PolarHBondContact O-N 3.16Å; K427-I429 PolarHBondContact O-N 2.86Å; K427-I429 VanDerWaalsContact O-N 3.16Å; K427-R430 WeakPolarHBondContact O-CG 3.44Å; K427-R430 PolarHBondContact O-N 2.97Å
428	V	88.9	Confident	94	Very high	12 Å²	12	42 Å²	42	7%	0.073	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-62.3	-18.3	-179.3	66.3	0	0	0	0	113.3	V401 E403 F406 P426 R430 M431	V401-V428 HydrophobicContact CG1-CG1 3.79Å; E403-V428 WeakPolarHBondContact O-CG2 3.46Å; F406-V428 HydrophobicContact CD2-CB 4.44Å; F406-V428 HydrophobicContact CD2-CG1 3.78Å; F406-V428 HydrophobicContact CD2-CG2 3.94Å; F406-V428 HydrophobicContact CE2-CG1 3.73Å; P426-V428 HydrophobicContact CB-CG1 4.05Å; P426-V428 PolarHBondContact O-N 2.94Å; V428-R430 PolarHBondContact O-N 3.42Å; V428-M431 HydrophobicContact CG2-CG 4.34Å; V428-M431 HydrophobicContact CG2-SD 3.87Å; V428-M431 WeakPolarHBondContact O-CB 3.44Å; V428-M431 PolarHBondContact O-N 3.15Å
429	I	93	Very high	94.1	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-55.4	-27.2	176.1	66.7	178.6	0	0	0	112.4	L415 V425 P426 K427 M431 L432 L438 F453 L456	L415-I429 HydrophobicContact CD2-CG2 4.21Å; V425-I429 HydrophobicContact CG1-CD1 3.6Å; P426-I429 HydrophobicContact CB-CG2 4.42Å; P426-I429 VanDerWaalsContact O-CG1 3.27Å; P426-I429 WeakPolarHBondContact O-CG1 3.47Å; P426-I429 WeakPolarHBondContact O-CG2 3.29Å; P426-I429 PolarHBondContact O-N 3.23Å; K427-I429 PolarHBondContact O-N 2.86Å; K427-I429 VanDerWaalsContact O-N 3.16Å; I429-M431 PolarHBondContact O-N 3.36Å; I429-L432 WeakPolarHBondContact O-CB 3.36Å; I429-L432 PolarHBondContact O-N 3.3Å; I429-L438 HydrophobicContact CD1-CD2 3.71Å; I429-F453 HydrophobicContact CD1-CD1 4.14Å; I429-F453 HydrophobicContact CD1-CE1 4.17Å; I429-L456 HydrophobicContact CD1-CD1 4.11Å; I429-L456 HydrophobicContact CG1-CD1 4.13Å; I429-L456 WeakPolarHBondContact O-CD2 3.43Å
430	R	91.4	Very high	94.2	Very high	90 Å²	90	42.9 Å²	42.9	34%	0.34	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-59.3	-18.1	176.9	-64.9	-177.1	-179.9	177.8	0.7	114	K427 V428 L432 F451 L452	K427-R430 WeakPolarHBondContact O-CG 3.44Å; K427-R430 PolarHBondContact O-N 2.97Å; V428-R430 PolarHBondContact O-N 3.42Å; R430-L432 VanDerWaalsContact C-N 3.32Å; R430-F451 PolarHBondContact NE-O 3.25Å; R430-F451 PolarHBondContact NH2-O 3.17Å; R430-L452 VanDerWaalsContact CG-O 3.32Å; R430-L452 WeakPolarHBondContact CG-O 3.33Å; R430-L452 PolarHBondContact NE-O 2.98Å
431	M	89.5	Confident	94.4	Very high	77 Å²	77	43.6 Å²	43.6	38%	0.379	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-76.5	-20.7	174	-61.4	-171.2	66.1	0	0	112.9	V407 V428 I429 T433	V407-M431 HydrophobicContact CG2-CE 3.87Å; V407-M431 HydrophobicContact CG2-SD 4.42Å; V428-M431 HydrophobicContact CG2-CG 4.34Å; V428-M431 HydrophobicContact CG2-SD 3.87Å; V428-M431 WeakPolarHBondContact O-CB 3.44Å; V428-M431 PolarHBondContact O-N 3.15Å; I429-M431 PolarHBondContact O-N 3.36Å; M431-T433 VanDerWaalsContact C-N 3.33Å; M431-T433 PolarHBondContact O-N 3.32Å; M431-T433 VanDerWaalsContact O-N 3.12Å
432	L	93.5	Very high	94.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.217	C	C	.	.			trans	-87.3	68.2	-177	-55.5	-179.7	0	0	0	110.2	F406 V412 L415 I429 R430 N434 L435 L456	F406-L432 HydrophobicContact CB-CD2 3.67Å; F406-L432 HydrophobicContact CB-CG 4.4Å; F406-L432 HydrophobicContact CD2-CD1 3.96Å; F406-L432 HydrophobicContact CD2-CD2 4.32Å; F406-L432 HydrophobicContact CD2-CG 4.2Å; F406-L432 HydrophobicContact CE2-CD1 4.18Å; F406-L432 HydrophobicContact CG-CD1 4.23Å; F406-L432 HydrophobicContact CG-CD2 3.94Å; F406-L432 HydrophobicContact CG-CG 4.33Å; V412-L432 HydrophobicContact CB-CD1 4.3Å; V412-L432 HydrophobicContact CB-CD2 4.04Å; V412-L432 HydrophobicContact CG1-CD1 4.26Å; L415-L432 HydrophobicContact CD2-CD1 3.99Å; I429-L432 WeakPolarHBondContact O-CB 3.36Å; I429-L432 PolarHBondContact O-N 3.3Å; R430-L432 VanDerWaalsContact C-N 3.32Å; L432-N434 PolarHBondContact O-N 3.11Å; L432-N434 VanDerWaalsContact O-N 3.07Å; L432-L435 HydrophobicContact CB-CB 3.86Å; L432-L435 HydrophobicContact CB-CD2 4.4Å; L432-L435 HydrophobicContact CD1-CD1 4.16Å; L432-L435 HydrophobicContact CD1-CD2 4.36Å; L432-L435 WeakPolarHBondContact O-CB 3.31Å; L432-L435 PolarHBondContact O-N 3.1Å; L432-L456 VanDerWaalsContact O-CD2 3.23Å; L432-L456 WeakPolarHBondContact O-CD2 3.44Å
433	T	92.9	Very high	94.7	Very high	71 Å²	71	41.5 Å²	41.5	44%	0.436	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-20.1	-174.9	55.9	0	0	0	0	114.1	M431	M431-T433 VanDerWaalsContact C-N 3.33Å; M431-T433 PolarHBondContact O-N 3.32Å; M431-T433 VanDerWaalsContact O-N 3.12Å
434	N	94.7	Very high	94.7	Very high	58 Å²	58	43.4 Å²	43.4	31%	0.31	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	4	174.9	-75.2	-18.4	0	0	0	113.8	Q411 V412 K413 L432 T436	Q411-N434 PolarHBondContact OE1-ND2 3.37Å; V412-N434 CarbonylContact O-C 3.47Å; K413-N434 HydrophobicContact CG-CB 4.45Å; L432-N434 PolarHBondContact O-N 3.11Å; L432-N434 VanDerWaalsContact O-N 3.07Å; N434-T436 PolarHBondContact O-N 3.05Å
435	L	97.1	Very high	94.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.189	C	C	.	.			trans	-64.4	118.9	-176.7	-168.2	67.7	0	0	0	110.6	V412 L415 L432 L438 L456 A458 M459	V412-L435 HydrophobicContact CG1-CD1 4.21Å; V412-L435 PolarHBondContact O-N 3.43Å; L415-L435 HydrophobicContact CB-CD1 3.82Å; L432-L435 HydrophobicContact CB-CB 3.86Å; L432-L435 HydrophobicContact CB-CD2 4.4Å; L432-L435 HydrophobicContact CD1-CD1 4.16Å; L432-L435 HydrophobicContact CD1-CD2 4.36Å; L432-L435 WeakPolarHBondContact O-CB 3.31Å; L432-L435 PolarHBondContact O-N 3.1Å; L435-L438 HydrophobicContact CD2-CB 4.1Å; L435-L438 HydrophobicContact CD2-CD1 4.41Å; L435-L438 HydrophobicContact CD2-CD2 4.31Å; L435-L456 HydrophobicContact CB-CD2 4.36Å; L435-A458 CarbonylContact O-C 3.53Å; L435-A458 VanDerWaalsContact O-C 3.28Å; L435-M459 HydrophobicContact CD2-CE 3.93Å; L435-M459 VanDerWaalsContact O-CA 3.24Å; L435-M459 WeakPolarHBondContact O-CA 3.2Å; L435-M459 PolarHBondContact O-N 3.43Å; L435-M459 VanDerWaalsContact O-N 3.12Å
436	T	97.7	Very high	95	Very high	40 Å²	40	43.2 Å²	43.2	25%	0.245	22%	0.215	C	C	.	.			trans	-100.6	-41.7	178.2	57	0	0	0	0	111.6	K413 N434 A458 S460 G461	K413-T436 HydrophobicContact CB-CG2 4.49Å; K413-T436 WeakPolarHBondContact O-CA 3.05Å; K413-T436 PolarHBondContact O-N 3.32Å; K413-T436 PolarHBondContact O-OG1 2.9Å; N434-T436 PolarHBondContact O-N 3.05Å; T436-A458 HydrophobicContact CG2-CB 4.43Å; T436-S460 PolarHBondContact O-N 3.44Å; T436-S460 PolarHBondContact O-OG 3.09Å; T436-S460 VanDerWaalsContact O-OG 3.09Å; T436-G461 PolarHBondContact O-N 2.75Å
437	N	98.2	Very high	95.1	Very high	68 Å²	68	45.6 Å²	45.6	36%	0.364	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	126.5	-176.3	-68.1	-18	0	0	0	110.1	K413 E414 L415 S460 G461	K413-N437 PolarHBondContact O-N 3.24Å; E414-N437 WeakPolarHBondContact CA-O 3.15Å; E414-N437 HydrophobicContact CG-CB 4.3Å; L415-N437 PolarHBondContact N-O 3.25Å; N437-S460 PolarHBondContact OD1-OG 2.88Å; N437-G461 WeakPolarHBondContact CA-O 3.11Å; N437-G461 PolarHBondContact OD1-N 3.33Å
438	L	97.7	Very high	95.3	Very high	3 Å²	3	39.7 Å²	39.7	2%	0.016	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	117.7	175.8	178.4	58	0	0	0	109.6	L415 I429 L435 L440 F453 M459 G461 L462 N463	L415-L438 HydrophobicContact CB-CD1 4.12Å; L415-L438 HydrophobicContact CD2-CD1 3.95Å; L415-L438 HydrophobicContact CG-CD1 4.12Å; L415-L438 WeakPolarHBondContact O-CA 3.43Å; I429-L438 HydrophobicContact CD1-CD2 3.71Å; L435-L438 HydrophobicContact CD2-CB 4.1Å; L435-L438 HydrophobicContact CD2-CD1 4.41Å; L435-L438 HydrophobicContact CD2-CD2 4.31Å; L438-L440 HydrophobicContact CD1-CD1 4.16Å; L438-L440 HydrophobicContact CD1-CD2 4.32Å; L438-L440 HydrophobicContact CD1-CG 3.97Å; L438-L440 HydrophobicContact CD2-CD1 3.85Å; L438-L440 HydrophobicContact CD2-CG 4.49Å; L438-L440 HydrophobicContact CG-CD1 3.92Å; L438-L440 HydrophobicContact CG-CG 4.02Å; L438-F453 HydrophobicContact CD2-CE1 4.44Å; L438-M459 HydrophobicContact CB-CE 4.19Å; L438-M459 HydrophobicContact CD2-CE 4.1Å; L438-G461 PolarHBondContact N-O 3.49Å; L438-L462 HydrophobicContact CB-CD1 4.07Å; L438-L462 HydrophobicContact CD2-CD1 3.94Å; L438-L462 HydrophobicContact CG-CD1 4.07Å; L438-N463 PolarHBondContact O-N 3.18Å
439	D	98.2	Very high	95.3	Very high	43 Å²	43	42.3 Å²	42.3	23%	0.23	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	117.3	174.7	-163.1	-23.1	0	0	0	111	L415 C416 L417 S441 N463	L415-D439 PolarHBondContact O-N 2.68Å; C416-D439 HydrophobicContact CB-CB 4.33Å; L417-D439 PolarHBondContact N-O 3.22Å; D439-S441 VanDerWaalsContact OD1-CB 3.3Å; D439-S441 WeakPolarHBondContact OD1-CB 3.49Å; D439-S441 PolarHBondContact OD1-N 3.3Å; D439-S441 PolarHBondContact OD1-OG 2.96Å; D439-N463 HydrophobicContact CB-CB 4.32Å; D439-N463 PolarHBondContact OD1-ND2 2.63Å; D439-N463 VanDerWaalsContact OD1-ND2 3.16Å; D439-N463 PolarHBondContact OD2-ND2 2.92Å; D439-N463 VanDerWaalsContact OD2-ND2 3.09Å
440	L	97.9	Very high	95	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.246	C	C	.	.			trans	-126.9	20.5	178.9	-65.6	168.7	0	0	0	110.7	L417 L422 V425 L438 N443 I445 N463 L464 N467	L417-L440 HydrophobicContact CB-CD2 3.94Å; L417-L440 HydrophobicContact CD1-CD2 4.11Å; L422-L440 HydrophobicContact CD1-CD2 3.85Å; V425-L440 HydrophobicContact CB-CD1 4.26Å; V425-L440 HydrophobicContact CG1-CD1 3.64Å; V425-L440 HydrophobicContact CG2-CD1 3.96Å; L438-L440 HydrophobicContact CD1-CD1 4.16Å; L438-L440 HydrophobicContact CD1-CD2 4.32Å; L438-L440 HydrophobicContact CD1-CG 3.97Å; L438-L440 HydrophobicContact CD2-CD1 3.85Å; L438-L440 HydrophobicContact CD2-CG 4.49Å; L438-L440 HydrophobicContact CG-CD1 3.92Å; L438-L440 HydrophobicContact CG-CG 4.02Å; L440-N443 PolarHBondContact O-ND2 3.31Å; L440-I445 HydrophobicContact CB-CD1 4Å; L440-I445 HydrophobicContact CD1-CD1 4.39Å; L440-N463 CarbonylContact C-O 3.42Å; L440-N463 PolarHBondContact N-O 2.84Å; L440-L464 HydrophobicContact CB-CD2 3.92Å; L440-L464 HydrophobicContact CD1-CD2 4.07Å; L440-N467 PolarHBondContact O-ND2 2.93Å
441	S	98.1	Very high	94.8	Very high	18 Å²	18	48.7 Å²	48.7	13%	0.126	26%	0.258	C	S	.	.			trans	-65.9	155	-179.1	58.8	0	0	0	0	112.7	A418 G419 D439 N443 N463 A465	A418-S441 CarbonylContact C-O 3.52Å; A418-S441 WeakPolarHBondContact CA-O 3.13Å; A418-S441 WeakPolarHBondContact CB-O 3.34Å; G419-S441 PolarHBondContact N-O 3.37Å; D439-S441 VanDerWaalsContact OD1-CB 3.3Å; D439-S441 WeakPolarHBondContact OD1-CB 3.49Å; D439-S441 PolarHBondContact OD1-N 3.3Å; D439-S441 PolarHBondContact OD1-OG 2.96Å; S441-N443 VanDerWaalsContact C-N 3.32Å; S441-N443 PolarHBondContact O-N 3.01Å; S441-N443 PolarHBondContact O-ND2 2.99Å; S441-N463 PolarHBondContact N-O 3.17Å; S441-N463 PolarHBondContact OG-ND2 3.17Å; S441-A465 CarbonylContact C-O 3.11Å; S441-A465 WeakPolarHBondContact CA-O 3.38Å; S441-A465 WeakPolarHBondContact CB-O 3.45Å
442	G	97.5	Very high	94.7	Very high	25 Å²	25	45.2 Å²	45.2	26%	0.258	24%	0.241	S	C	.	.	S	Bend	trans	65.7	33	178	0	0	0	0	0	113.8	G419 N420 A465 N466	G419-G442 CarbonylContact C-O 3.34Å; G419-G442 VanDerWaalsContact CA-O 3.27Å; G419-G442 WeakPolarHBondContact CA-O 3.29Å; N420-G442 PolarHBondContact N-O 3.2Å; G442-A465 PolarHBondContact N-O 3.32Å; G442-N466 WeakPolarHBondContact CA-O 3.41Å; G442-N466 PolarHBondContact N-O 3.04Å
443	N	96.7	Very high	94.6	Very high	6 Å²	6	45.2 Å²	45.2	3%	0.032	24%	0.241	C	C	.	.	S	Bend	trans	-109.9	-167.9	174.7	-81.2	-83	0	0	0	110	L417 N420 F421 L422 L440 S441 I445 N466 N467	L417-N443 PolarHBondContact O-ND2 3.37Å; N420-N443 VanDerWaalsContact CA-OD1 3.32Å; N420-N443 WeakPolarHBondContact CA-OD1 3.35Å; N420-N443 WeakPolarHBondContact CB-OD1 3.18Å; N420-N443 PolarHBondContact N-OD1 3.19Å; N420-N443 PolarHBondContact O-OD1 3.07Å; F421-N443 PolarHBondContact N-OD1 2.85Å; L422-N443 HydrophobicContact CB-CB 4.17Å; L422-N443 VanDerWaalsContact CB-OD1 3.26Å; L422-N443 WeakPolarHBondContact CB-OD1 3.14Å; L422-N443 WeakPolarHBondContact CG-OD1 3.3Å; L422-N443 PolarHBondContact N-OD1 2.6Å; L440-N443 PolarHBondContact O-ND2 3.31Å; S441-N443 VanDerWaalsContact C-N 3.32Å; S441-N443 PolarHBondContact O-N 3.01Å; S441-N443 PolarHBondContact O-ND2 2.99Å; N443-I445 HydrophobicContact CB-CD1 4.19Å; N443-I445 HydrophobicContact CB-CG1 4.11Å; N443-N466 PolarHBondContact N-O 3.35Å; N443-N467 VanDerWaalsContact CA-OD1 3.29Å; N443-N467 WeakPolarHBondContact CA-OD1 3.25Å; N443-N467 WeakPolarHBondContact CB-OD1 3.27Å; N443-N467 PolarHBondContact N-OD1 2.85Å; N443-N467 PolarHBondContact O-OD1 2.93Å
444	R	96.8	Very high	94.4	Very high	125 Å²	125	44 Å²	44	47%	0.472	23%	0.232	S	C	.	.			trans	-112.4	32.2	179.8	-58.6	-177.4	-173.7	175.9	4.5	112	L422 E446 N467	L422-R444 CarbonylContact O-C 3.41Å; L422-R444 VanDerWaalsContact O-C 3.28Å; L422-R444 WeakPolarHBondContact O-CA 3.44Å; L422-R444 PolarHBondContact O-N 3.44Å; R444-E446 PolarHBondContact O-N 3.21Å; R444-N467 PolarHBondContact N-OD1 3.46Å
445	I	97.3	Very high	93.9	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.246	C	C	.	.			trans	-72.8	121.9	-173.4	-60.3	167.2	0	0	0	109.9	L422 V423 V425 L440 N443 L464 N467 H468 I469	L422-I445 PolarHBondContact O-N 2.95Å; V423-I445 WeakPolarHBondContact O-CA 3.45Å; V425-I445 HydrophobicContact CG2-CD1 4Å; V425-I445 HydrophobicContact CG2-CG2 4.22Å; L440-I445 HydrophobicContact CB-CD1 4Å; L440-I445 HydrophobicContact CD1-CD1 4.39Å; N443-I445 HydrophobicContact CB-CD1 4.19Å; N443-I445 HydrophobicContact CB-CG1 4.11Å; I445-L464 HydrophobicContact CD1-CD2 3.97Å; I445-N467 HydrophobicContact CB-CB 4.19Å; I445-N467 VanDerWaalsContact CB-OD1 3.26Å; I445-N467 WeakPolarHBondContact CB-OD1 3.24Å; I445-N467 WeakPolarHBondContact CG1-OD1 3.15Å; I445-N467 PolarHBondContact N-OD1 3.08Å; I445-H468 CarbonylContact O-C 3.25Å; I445-H468 WeakPolarHBondContact O-CA 3.14Å; I445-H468 PolarHBondContact O-N 3.04Å; I445-I469 HydrophobicContact CG2-CG1 4.41Å; I445-I469 WeakPolarHBondContact O-CG1 3.44Å; I445-I469 PolarHBondContact O-N 3.22Å
446	E	95.7	Very high	93.7	Very high	122 Å²	122	46.5 Å²	46.5	57%	0.57	25%	0.246	S	C	*	.			trans	-94.7	-25.7	-175.9	-64.9	-179.2	-174.2	0	0	114	R444 H468 I469	R444-E446 PolarHBondContact O-N 3.21Å; E446-H468 HydrophobicContact CG-CB 4.17Å; E446-I469 WeakPolarHBondContact O-CA 3.35Å
447	A	94	Very high	93.3	Very high	59 Å²	59	48 Å²	48	49%	0.488	26%	0.256	S	S	.	.			trans	-152.4	156.5	-175.7	0	0	0	0	0	112.5	P449	A447-P449 WeakPolarHBondContact O-CD 3.4Å
448	I	94.1	Very high	93.2	Very high	15 Å²	15	46.4 Å²	46.4	8%	0.077	25%	0.252	C	S	.	.			trans	-108.8	103.2	171.5	-54.2	176.8	0	0	0	107.9	L452 F453 L464 I469 I472 V476 F477 L488	I448-L452 HydrophobicContact CG2-CD2 4.36Å; I448-F453 HydrophobicContact CG2-CE2 3.6Å; I448-F453 HydrophobicContact CG2-CZ 4.15Å; I448-L464 HydrophobicContact CD1-CD1 3.68Å; I448-L464 HydrophobicContact CG1-CD1 4.33Å; I448-I469 HydrophobicContact CD1-CD1 4.1Å; I448-I469 HydrophobicContact CG1-CD1 4.07Å; I448-I472 HydrophobicContact CD1-CD1 4Å; I448-V476 HydrophobicContact CG2-CB 4.43Å; I448-F477 HydrophobicContact CD1-CE1 4.19Å; I448-F477 HydrophobicContact CD1-CZ 3.77Å; I448-L488 HydrophobicContact CD1-CD2 4.22Å
449	P	89.3	Confident	93.1	Very high	68 Å²	68	46.3 Å²	46.3	44%	0.442	25%	0.252	S	S	.	.			trans	-63.4	150.6	177.5	-21.6	32.7	0	0	0	112.7	A447 L452	A447-P449 WeakPolarHBondContact O-CD 3.4Å; P449-L452 VanDerWaalsContact O-CB 3.29Å; P449-L452 WeakPolarHBondContact O-CB 3.44Å; P449-L452 PolarHBondContact O-N 2.98Å
450	K	87.1	Confident	93.1	Very high	90 Å²	90	46 Å²	46	39%	0.391	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	148.3	172.2	-72.6	-179.5	176	151	0	111.5	L452 D473 V476	K450-L452 PolarHBondContact O-N 3.24Å; K450-D473 WeakPolarHBondContact CE-OD2 3.32Å; K450-D473 IonicContact NZ-OD1 2.68Å; K450-D473 IonicContact NZ-OD2 2.66Å; K450-D473 PolarHBondContact NZ-OD2 3.17Å; K450-V476 HydrophobicContact CG-CG1 4.27Å
451	F	85.9	Confident	93.1	Very high	134 Å²	134	46.7 Å²	46.7	59%	0.588	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	4.8	176.8	-46.3	-65.9	0	0	0	114.3	R430 F453 D454	R430-F451 PolarHBondContact NE-O 3.25Å; R430-F451 PolarHBondContact NH2-O 3.17Å; F451-F453 VanDerWaalsContact C-N 3.29Å; F451-F453 PolarHBondContact O-N 2.79Å; F451-D454 WeakPolarHBondContact CA-OD1 3.07Å; F451-D454 WeakPolarHBondContact CB-OD2 3.41Å; F451-D454 WeakPolarHBondContact O-CB 3.33Å; F451-D454 PolarHBondContact O-N 3.16Å
452	L	88.7	Confident	93.1	Very high	4 Å²	4	46 Å²	46	2%	0.021	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-42.2	-176	175.9	66	0	0	0	112.4	V425 R430 I448 P449 K450 D454	V425-L452 HydrophobicContact CB-CD1 4.42Å; V425-L452 HydrophobicContact CB-CD2 3.44Å; V425-L452 VanDerWaalsContact CB-CD2 3.44Å; V425-L452 HydrophobicContact CB-CG 4.45Å; V425-L452 HydrophobicContact CG1-CD1 4.36Å; V425-L452 HydrophobicContact CG1-CD2 3.65Å; V425-L452 HydrophobicContact CG1-CG 4.32Å; V425-L452 HydrophobicContact CG2-CD2 3.75Å; R430-L452 VanDerWaalsContact CG-O 3.32Å; R430-L452 WeakPolarHBondContact CG-O 3.33Å; R430-L452 PolarHBondContact NE-O 2.98Å; I448-L452 HydrophobicContact CG2-CD2 4.36Å; P449-L452 VanDerWaalsContact O-CB 3.29Å; P449-L452 WeakPolarHBondContact O-CB 3.44Å; P449-L452 PolarHBondContact O-N 2.98Å; K450-L452 PolarHBondContact O-N 3.24Å; L452-D454 VanDerWaalsContact C-N 3.31Å; L452-D454 PolarHBondContact O-N 3.29Å
453	F	91.9	Very high	93.1	Very high	1 Å²	1	46.4 Å²	46.4	0%	0.004	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	15.2	-177.3	-52.7	-67.7	0	0	0	114.1	I429 L438 I448 F451 L456 M459 L462 F477 V480	I429-F453 HydrophobicContact CD1-CD1 4.14Å; I429-F453 HydrophobicContact CD1-CE1 4.17Å; L438-F453 HydrophobicContact CD2-CE1 4.44Å; I448-F453 HydrophobicContact CG2-CE2 3.6Å; I448-F453 HydrophobicContact CG2-CZ 4.15Å; F451-F453 VanDerWaalsContact C-N 3.29Å; F451-F453 PolarHBondContact O-N 2.79Å; F453-L456 HydrophobicContact CB-CD1 4.32Å; F453-L456 HydrophobicContact CD1-CD1 4.2Å; F453-L456 PolarHBondContact O-N 3.31Å; F453-M459 HydrophobicContact CD1-CE 4.32Å; F453-L462 HydrophobicContact CE1-CD1 4.25Å; F453-L462 HydrophobicContact CE1-CD2 3.99Å; F453-L462 HydrophobicContact CE2-CD2 4.04Å; F453-L462 HydrophobicContact CZ-CD1 4.43Å; F453-L462 HydrophobicContact CZ-CD2 3.62Å; F453-F477 HydrophobicContact CD2-CD1 4.17Å; F453-F477 HydrophobicContact CD2-CE1 4.47Å; F453-F477 AromaticContact CE2-CD1 3.99Å; F453-F477 HydrophobicContact CE2-CD1 3.99Å; F453-F477 AromaticContact CE2-CE1 3.83Å; F453-F477 HydrophobicContact CE2-CE1 3.83Å; F453-V480 HydrophobicContact CB-CG1 3.69Å; F453-V480 HydrophobicContact CG-CG1 4.49Å
454	D	87.8	Confident	93.2	Very high	45 Å²	45	46.1 Å²	46.1	24%	0.241	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	143.8	171.7	-71.4	8.7	0	0	0	110.4	F451 L452 L456 S479	F451-D454 WeakPolarHBondContact CA-OD1 3.07Å; F451-D454 WeakPolarHBondContact CB-OD2 3.41Å; F451-D454 WeakPolarHBondContact O-CB 3.33Å; F451-D454 PolarHBondContact O-N 3.16Å; L452-D454 VanDerWaalsContact C-N 3.31Å; L452-D454 PolarHBondContact O-N 3.29Å; D454-L456 VanDerWaalsContact C-N 3.34Å; D454-S479 VanDerWaalsContact OD1-CB 3.31Å; D454-S479 WeakPolarHBondContact OD1-CB 3.41Å; D454-S479 PolarHBondContact OD1-OG 3.11Å
455	N	83.7	Confident	93.3	Very high	111 Å²	111	40.3 Å²	40.3	59%	0.594	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	69	18.6	-175.7	-53.9	-33.9	0	0	0	116.3	P457	N455-P457 WeakPolarHBondContact O-CD 3.28Å
456	L	93.3	Very high	93.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.241	C	C	.	.			trans	-113.9	54	176.1	-55.7	176.6	0	0	0	113.1	I429 L432 L435 F453 D454 A458 M459 V480	I429-L456 HydrophobicContact CD1-CD1 4.11Å; I429-L456 HydrophobicContact CG1-CD1 4.13Å; I429-L456 WeakPolarHBondContact O-CD2 3.43Å; L432-L456 VanDerWaalsContact O-CD2 3.23Å; L432-L456 WeakPolarHBondContact O-CD2 3.44Å; L435-L456 HydrophobicContact CB-CD2 4.36Å; F453-L456 HydrophobicContact CB-CD1 4.32Å; F453-L456 HydrophobicContact CD1-CD1 4.2Å; F453-L456 PolarHBondContact O-N 3.31Å; D454-L456 VanDerWaalsContact C-N 3.34Å; L456-A458 PolarHBondContact O-N 3.31Å; L456-A458 VanDerWaalsContact O-N 3.17Å; L456-M459 HydrophobicContact CB-CB 4.4Å; L456-M459 HydrophobicContact CB-CE 4.06Å; L456-M459 HydrophobicContact CD1-CE 3.43Å; L456-M459 VanDerWaalsContact CD1-CE 3.43Å; L456-M459 HydrophobicContact CG-CE 4.3Å; L456-M459 WeakPolarHBondContact O-CB 3.29Å; L456-M459 PolarHBondContact O-N 2.8Å; L456-V480 HydrophobicContact CB-CG1 4.22Å
457	P	90.4	Very high	93.5	Very high	71 Å²	71	37.2 Å²	37.2	46%	0.461	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-21.7	-174.3	30.9	-37	0	0	0	112.7	N455 M459 N482	N455-P457 WeakPolarHBondContact O-CD 3.28Å; P457-M459 VanDerWaalsContact C-N 3.31Å; P457-N482 WeakPolarHBondContact O-CB 3.37Å; P457-N482 PolarHBondContact O-ND2 3.29Å
458	A	94.5	Very high	93.6	Very high	35 Å²	35	39.2 Å²	39.2	29%	0.289	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-7.2	-179.8	0	0	0	0	0	113.9	L435 T436 L456 S460	L435-A458 CarbonylContact O-C 3.53Å; L435-A458 VanDerWaalsContact O-C 3.28Å; T436-A458 HydrophobicContact CG2-CB 4.43Å; L456-A458 PolarHBondContact O-N 3.31Å; L456-A458 VanDerWaalsContact O-N 3.17Å; A458-S460 PolarHBondContact O-N 3.17Å
459	M	96.9	Very high	93.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.211	C	C	.	.			trans	-66.4	121.6	-172.7	-167.8	177.5	-73.5	0	0	111.3	L435 L438 F453 L456 P457 L462 V480 N482 L483	L435-M459 HydrophobicContact CD2-CE 3.93Å; L435-M459 VanDerWaalsContact O-CA 3.24Å; L435-M459 WeakPolarHBondContact O-CA 3.2Å; L435-M459 PolarHBondContact O-N 3.43Å; L435-M459 VanDerWaalsContact O-N 3.12Å; L438-M459 HydrophobicContact CB-CE 4.19Å; L438-M459 HydrophobicContact CD2-CE 4.1Å; F453-M459 HydrophobicContact CD1-CE 4.32Å; L456-M459 HydrophobicContact CB-CB 4.4Å; L456-M459 HydrophobicContact CB-CE 4.06Å; L456-M459 HydrophobicContact CD1-CE 3.43Å; L456-M459 VanDerWaalsContact CD1-CE 3.43Å; L456-M459 HydrophobicContact CG-CE 4.3Å; L456-M459 WeakPolarHBondContact O-CB 3.29Å; L456-M459 PolarHBondContact O-N 2.8Å; P457-M459 VanDerWaalsContact C-N 3.31Å; M459-L462 HydrophobicContact SD-CB 4.18Å; M459-L462 HydrophobicContact SD-CD1 4.46Å; M459-L462 HydrophobicContact SD-CD2 4.49Å; M459-V480 HydrophobicContact CB-CB 4.47Å; M459-V480 HydrophobicContact CB-CG1 4.03Å; M459-V480 HydrophobicContact SD-CG1 4.05Å; M459-N482 CarbonylContact O-C 3.55Å; M459-L483 HydrophobicContact CG-CD1 3.78Å; M459-L483 VanDerWaalsContact O-CA 3.32Å; M459-L483 WeakPolarHBondContact O-CA 3.45Å; M459-L483 PolarHBondContact O-N 2.83Å; M459-L483 VanDerWaalsContact O-N 3.09Å; M459-L483 HydrophobicContact SD-CD1 4.2Å
460	S	97.5	Very high	94.2	Very high	37 Å²	37	39 Å²	39	26%	0.259	21%	0.212	S	C	.	.			trans	-111.2	-28.8	178.5	54.8	0	0	0	0	113.3	T436 N437 A458 V484 E485	T436-S460 PolarHBondContact O-N 3.44Å; T436-S460 PolarHBondContact O-OG 3.09Å; T436-S460 VanDerWaalsContact O-OG 3.09Å; N437-S460 PolarHBondContact OD1-OG 2.88Å; A458-S460 PolarHBondContact O-N 3.17Å; S460-V484 WeakPolarHBondContact O-CA 3.47Å; S460-V484 PolarHBondContact O-N 2.71Å; S460-E485 PolarHBondContact O-N 2.9Å
461	G	97.9	Very high	94.6	Very high	14 Å²	14	36.6 Å²	36.6	14%	0.144	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	128.6	-179.1	0	0	0	0	0	112.1	T436 N437 L438 E485	T436-G461 PolarHBondContact O-N 2.75Å; N437-G461 WeakPolarHBondContact CA-O 3.11Å; N437-G461 PolarHBondContact OD1-N 3.33Å; L438-G461 PolarHBondContact N-O 3.49Å; G461-E485 WeakPolarHBondContact CA-O 3.12Å
462	L	98	Very high	95	Very high	4 Å²	4	30.3 Å²	30.3	2%	0.021	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	117	175.5	177.1	59.5	0	0	0	109.9	L438 F453 M459 L464 F477 L483 E485 L486 N487	L438-L462 HydrophobicContact CB-CD1 4.07Å; L438-L462 HydrophobicContact CD2-CD1 3.94Å; L438-L462 HydrophobicContact CG-CD1 4.07Å; F453-L462 HydrophobicContact CE1-CD1 4.25Å; F453-L462 HydrophobicContact CE1-CD2 3.99Å; F453-L462 HydrophobicContact CE2-CD2 4.04Å; F453-L462 HydrophobicContact CZ-CD1 4.43Å; F453-L462 HydrophobicContact CZ-CD2 3.62Å; M459-L462 HydrophobicContact SD-CB 4.18Å; M459-L462 HydrophobicContact SD-CD1 4.46Å; M459-L462 HydrophobicContact SD-CD2 4.49Å; L462-L464 HydrophobicContact CD1-CD1 4.24Å; L462-L464 HydrophobicContact CD1-CG 4.18Å; L462-L464 HydrophobicContact CD2-CD1 3.98Å; L462-L464 HydrophobicContact CG-CD1 4.05Å; L462-L464 HydrophobicContact CG-CG 4.29Å; L462-F477 HydrophobicContact CD2-CD1 4.34Å; L462-F477 HydrophobicContact CD2-CE1 3.86Å; L462-L483 HydrophobicContact CB-CD1 3.85Å; L462-L483 HydrophobicContact CB-CD2 4.37Å; L462-E485 PolarHBondContact N-O 3.26Å; L462-L486 HydrophobicContact CB-CD1 4.08Å; L462-L486 HydrophobicContact CD2-CD1 3.89Å; L462-L486 HydrophobicContact CG-CD1 4.03Å; L462-N487 PolarHBondContact O-N 3.12Å
463	N	98.5	Very high	95.2	Very high	34 Å²	34	33.4 Å²	33.4	18%	0.182	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	116	177.7	-173.7	10.6	0	0	0	111.1	L438 D439 L440 S441 A465 N487	L438-N463 PolarHBondContact O-N 3.18Å; D439-N463 HydrophobicContact CB-CB 4.32Å; D439-N463 PolarHBondContact OD1-ND2 2.63Å; D439-N463 VanDerWaalsContact OD1-ND2 3.16Å; D439-N463 PolarHBondContact OD2-ND2 2.92Å; D439-N463 VanDerWaalsContact OD2-ND2 3.09Å; L440-N463 CarbonylContact C-O 3.42Å; L440-N463 PolarHBondContact N-O 2.84Å; S441-N463 PolarHBondContact N-O 3.17Å; S441-N463 PolarHBondContact OG-ND2 3.17Å; N463-A465 VanDerWaalsContact OD1-CB 3.32Å; N463-A465 WeakPolarHBondContact OD1-CB 3.48Å; N463-A465 PolarHBondContact OD1-N 2.75Å; N463-A465 VanDerWaalsContact OD1-N 3.11Å; N463-N487 HydrophobicContact CB-CB 4.42Å; N463-N487 PolarHBondContact OD1-ND2 2.82Å
464	L	98.3	Very high	95.2	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.223	C	C	.	.			trans	-125.2	19.6	178.2	-74.3	164.5	0	0	0	110.9	V425 L440 I445 I448 L462 N467 I469 N487 L488 N491	V425-L464 HydrophobicContact CG2-CD2 4.25Å; L440-L464 HydrophobicContact CB-CD2 3.92Å; L440-L464 HydrophobicContact CD1-CD2 4.07Å; I445-L464 HydrophobicContact CD1-CD2 3.97Å; I448-L464 HydrophobicContact CD1-CD1 3.68Å; I448-L464 HydrophobicContact CG1-CD1 4.33Å; L462-L464 HydrophobicContact CD1-CD1 4.24Å; L462-L464 HydrophobicContact CD1-CG 4.18Å; L462-L464 HydrophobicContact CD2-CD1 3.98Å; L462-L464 HydrophobicContact CG-CD1 4.05Å; L462-L464 HydrophobicContact CG-CG 4.29Å; L464-N467 PolarHBondContact O-ND2 3.37Å; L464-I469 HydrophobicContact CB-CD1 4.16Å; L464-I469 HydrophobicContact CD1-CD1 4.45Å; L464-N487 CarbonylContact C-O 3.55Å; L464-N487 WeakPolarHBondContact CA-O 3.47Å; L464-N487 PolarHBondContact N-O 2.74Å; L464-L488 HydrophobicContact CB-CD2 4.01Å; L464-L488 HydrophobicContact CD1-CD2 4.1Å; L464-N491 PolarHBondContact O-ND2 2.76Å
465	A	98.4	Very high	95.4	Very high	2 Å²	2	43.3 Å²	43.3	2%	0.017	23%	0.233	C	C	.	.			trans	-62.9	154.8	-178.8	0	0	0	0	0	112.6	S441 G442 N463 N467 N487 A489	S441-A465 CarbonylContact C-O 3.11Å; S441-A465 WeakPolarHBondContact CA-O 3.38Å; S441-A465 WeakPolarHBondContact CB-O 3.45Å; G442-A465 PolarHBondContact N-O 3.32Å; N463-A465 VanDerWaalsContact OD1-CB 3.32Å; N463-A465 WeakPolarHBondContact OD1-CB 3.48Å; N463-A465 PolarHBondContact OD1-N 2.75Å; N463-A465 VanDerWaalsContact OD1-N 3.11Å; A465-N467 PolarHBondContact O-N 2.63Å; A465-N467 PolarHBondContact O-ND2 2.97Å; A465-N487 PolarHBondContact N-O 2.79Å; A465-A489 CarbonylContact C-O 3.25Å; A465-A489 WeakPolarHBondContact CA-O 3.22Å; A465-A489 HydrophobicContact CB-CB 4.19Å
466	N	98.2	Very high	95.8	Very high	52 Å²	52	38.2 Å²	38.2	28%	0.278	21%	0.206	S	C	.	.	S	Bend	trans	55.5	52.4	177.4	-44.9	-74.7	0	0	0	112.2	G442 N443 A489 N490	G442-N466 WeakPolarHBondContact CA-O 3.41Å; G442-N466 PolarHBondContact N-O 3.04Å; N443-N466 PolarHBondContact N-O 3.35Å; N466-A489 PolarHBondContact N-O 3.15Å; N466-N490 VanDerWaalsContact CA-O 3.25Å; N466-N490 WeakPolarHBondContact CA-O 3.36Å; N466-N490 PolarHBondContact N-O 3.22Å; N466-N490 WeakPolarHBondContact OD1-CB 3.45Å; N466-N490 PolarHBondContact OD1-ND2 3.03Å
467	N	98.1	Very high	95.8	Very high	5 Å²	5	38.2 Å²	38.2	3%	0.027	21%	0.206	C	C	.	.	S	Bend	trans	-122.3	-166.3	173.4	-85.2	-79.8	0	0	0	109.1	L440 N443 R444 I445 L464 A465 I469 N491	L440-N467 PolarHBondContact O-ND2 2.93Å; N443-N467 VanDerWaalsContact CA-OD1 3.29Å; N443-N467 WeakPolarHBondContact CA-OD1 3.25Å; N443-N467 WeakPolarHBondContact CB-OD1 3.27Å; N443-N467 PolarHBondContact N-OD1 2.85Å; N443-N467 PolarHBondContact O-OD1 2.93Å; R444-N467 PolarHBondContact N-OD1 3.46Å; I445-N467 HydrophobicContact CB-CB 4.19Å; I445-N467 VanDerWaalsContact CB-OD1 3.26Å; I445-N467 WeakPolarHBondContact CB-OD1 3.24Å; I445-N467 WeakPolarHBondContact CG1-OD1 3.15Å; I445-N467 PolarHBondContact N-OD1 3.08Å; L464-N467 PolarHBondContact O-ND2 3.37Å; A465-N467 PolarHBondContact O-N 2.63Å; A465-N467 PolarHBondContact O-ND2 2.97Å; N467-I469 HydrophobicContact CB-CD1 4.43Å; N467-I469 HydrophobicContact CB-CG1 4.28Å; N467-N491 VanDerWaalsContact CA-OD1 3.26Å; N467-N491 WeakPolarHBondContact CA-OD1 3.32Å; N467-N491 WeakPolarHBondContact CB-OD1 3.31Å; N467-N491 PolarHBondContact N-OD1 3.02Å; N467-N491 PolarHBondContact O-OD1 3.37Å
468	H	97.3	Very high	95.9	Very high	102 Å²	102	37.9 Å²	37.9	47%	0.472	20%	0.203	S	C	.	.			trans	-112.4	28.6	-179.1	-62.5	-36.1	0	0	0	112.6	I445 E446 V470 N491	I445-H468 CarbonylContact O-C 3.25Å; I445-H468 WeakPolarHBondContact O-CA 3.14Å; I445-H468 PolarHBondContact O-N 3.04Å; E446-H468 HydrophobicContact CG-CB 4.17Å; H468-V470 PolarHBondContact O-N 2.91Å; H468-N491 PolarHBondContact N-OD1 2.84Å
469	I	97.9	Very high	95.6	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.204	C	C	.	.			trans	-69.9	123.8	-175.4	-57.3	168.2	0	0	0	109.9	I445 E446 I448 L464 N467 I472 L488 N491 A492 I493	I445-I469 HydrophobicContact CG2-CG1 4.41Å; I445-I469 WeakPolarHBondContact O-CG1 3.44Å; I445-I469 PolarHBondContact O-N 3.22Å; E446-I469 WeakPolarHBondContact O-CA 3.35Å; I448-I469 HydrophobicContact CD1-CD1 4.1Å; I448-I469 HydrophobicContact CG1-CD1 4.07Å; L464-I469 HydrophobicContact CB-CD1 4.16Å; L464-I469 HydrophobicContact CD1-CD1 4.45Å; N467-I469 HydrophobicContact CB-CD1 4.43Å; N467-I469 HydrophobicContact CB-CG1 4.28Å; I469-I472 HydrophobicContact CG2-CD1 3.71Å; I469-L488 HydrophobicContact CD1-CD2 4.21Å; I469-N491 HydrophobicContact CB-CB 4.17Å; I469-N491 WeakPolarHBondContact CB-OD1 3.4Å; I469-N491 WeakPolarHBondContact CG1-OD1 3.41Å; I469-N491 PolarHBondContact N-OD1 3.49Å; I469-A492 CarbonylContact O-C 3.29Å; I469-A492 WeakPolarHBondContact O-CA 3.35Å; I469-A492 PolarHBondContact O-N 3.18Å; I469-I493 HydrophobicContact CB-CG1 4.34Å; I469-I493 HydrophobicContact CG2-CD1 4.44Å; I469-I493 HydrophobicContact CG2-CG1 4.12Å; I469-I493 WeakPolarHBondContact O-CG1 3.29Å; I469-I493 PolarHBondContact O-N 2.97Å; I469-I493 VanDerWaalsContact O-N 3.11Å
470	V	96.9	Very high	95.5	Very high	77 Å²	77	38.4 Å²	38.4	47%	0.467	20%	0.204	S	C	.	.			trans	-97.8	-30.2	-175.8	-177.7	0	0	0	0	113.2	H468 A492 I493 S494	H468-V470 PolarHBondContact O-N 2.91Å; V470-A492 HydrophobicContact CG2-CB 4.24Å; V470-I493 WeakPolarHBondContact O-CA 3.35Å; V470-S494 PolarHBondContact O-N 2.86Å
471	A	95.6	Very high	95.3	Very high	40 Å²	40	38.9 Å²	38.9	33%	0.331	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	151.3	-176.5	0	0	0	0	0	111.9	Q495	A471-Q495 WeakPolarHBondContact CA-O 3.24Å; A471-Q495 HydrophobicContact CB-CB 4.01Å
472	I	95.5	Very high	95.1	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.015	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	108.9	171.7	-47.2	-64.9	0	0	0	109.1	I448 I469 V476 F477 L488 I493 Q495 L496 S497 C500	I448-I472 HydrophobicContact CD1-CD1 4Å; I469-I472 HydrophobicContact CG2-CD1 3.71Å; I472-V476 HydrophobicContact CG2-CG2 3.67Å; I472-F477 HydrophobicContact CG2-CE2 3.84Å; I472-L488 HydrophobicContact CD1-CD1 4.23Å; I472-L488 HydrophobicContact CD1-CD2 4.25Å; I472-L488 HydrophobicContact CG1-CD1 4.49Å; I472-I493 HydrophobicContact CD1-CD1 3.97Å; I472-I493 HydrophobicContact CG1-CD1 4.09Å; I472-I493 HydrophobicContact CG1-CG2 4.29Å; I472-Q495 PolarHBondContact N-O 3.47Å; I472-L496 HydrophobicContact CB-CD2 3.9Å; I472-L496 HydrophobicContact CG1-CD2 3.66Å; I472-S497 PolarHBondContact O-N 3.4Å; I472-S497 PolarHBondContact O-OG 3.21Å; I472-C500 HydrophobicContact CB-CB 4.11Å; I472-C500 HydrophobicContact CG2-CB 3.61Å
473	D	92.8	Very high	95.1	Very high	68 Å²	68	41.7 Å²	41.7	36%	0.364	22%	0.218	S	C	.	.			trans	-74.9	166.9	178.8	-162.4	1.9	0	0	0	111.4	K450 V476	K450-D473 WeakPolarHBondContact CE-OD2 3.32Å; K450-D473 IonicContact NZ-OD1 2.68Å; K450-D473 IonicContact NZ-OD2 2.66Å; K450-D473 PolarHBondContact NZ-OD2 3.17Å; D473-V476 HydrophobicContact CB-CG1 4.14Å; D473-V476 WeakPolarHBondContact O-CG2 3.34Å
474	R	92.2	Very high	95.1	Very high	141 Å²	141	42.7 Å²	42.7	53%	0.532	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	142.9	-176.7	68.6	-174.6	95.4	173.7	3.3	111.5	V476 S497	R474-V476 PolarHBondContact O-N 2.81Å; R474-V476 VanDerWaalsContact O-N 3.11Å; R474-S497 WeakPolarHBondContact CA-OG 3.07Å; R474-S497 PolarHBondContact N-OG 3.11Å
475	Y	90.6	Very high	95.1	Very high	113 Å²	113	45.6 Å²	45.6	44%	0.443	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	20.4	169.1	-44.3	-57.4	0	0	0	115.6	F477 T478 N499 D502	Y475-F477 VanDerWaalsContact C-N 3.29Å; Y475-F477 PolarHBondContact O-N 2.73Å; Y475-T478 VanDerWaalsContact CA-OG1 3.29Å; Y475-T478 WeakPolarHBondContact CA-OG1 3.35Å; Y475-T478 WeakPolarHBondContact CB-OG1 3.3Å; Y475-T478 PolarHBondContact O-N 3.5Å; Y475-T478 PolarHBondContact O-OG1 3.44Å; Y475-N499 HydrophobicContact CD1-CB 4.23Å; Y475-N499 HydrophobicContact CE1-CB 3.57Å; Y475-N499 PolarHBondContact N-O 3.48Å; Y475-N499 PolarHBondContact OH-ND2 3.37Å; Y475-D502 HydrophobicContact CD1-CB 3.98Å; Y475-D502 HydrophobicContact CE1-CB 4.13Å
476	V	93	Very high	95.1	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.024	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-25.2	-178.2	-67.3	0	0	0	0	113.2	I448 K450 I472 D473 R474	I448-V476 HydrophobicContact CG2-CB 4.43Å; K450-V476 HydrophobicContact CG-CG1 4.27Å; I472-V476 HydrophobicContact CG2-CG2 3.67Å; D473-V476 HydrophobicContact CB-CG1 4.14Å; D473-V476 WeakPolarHBondContact O-CG2 3.34Å; R474-V476 PolarHBondContact O-N 2.81Å; R474-V476 VanDerWaalsContact O-N 3.11Å
477	F	94	Very high	95.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104	9.1	179.6	-57.1	-66.9	0	0	0	114	I448 F453 L462 I472 Y475 S479 V480 L486 L488 F501 L504	I448-F477 HydrophobicContact CD1-CE1 4.19Å; I448-F477 HydrophobicContact CD1-CZ 3.77Å; F453-F477 HydrophobicContact CD2-CD1 4.17Å; F453-F477 HydrophobicContact CD2-CE1 4.47Å; F453-F477 AromaticContact CE2-CD1 3.99Å; F453-F477 HydrophobicContact CE2-CD1 3.99Å; F453-F477 AromaticContact CE2-CE1 3.83Å; F453-F477 HydrophobicContact CE2-CE1 3.83Å; L462-F477 HydrophobicContact CD2-CD1 4.34Å; L462-F477 HydrophobicContact CD2-CE1 3.86Å; I472-F477 HydrophobicContact CG2-CE2 3.84Å; Y475-F477 VanDerWaalsContact C-N 3.29Å; Y475-F477 PolarHBondContact O-N 2.73Å; F477-S479 PolarHBondContact O-N 2.81Å; F477-S479 VanDerWaalsContact O-N 3.15Å; F477-V480 HydrophobicContact CB-CG2 4.06Å; F477-V480 HydrophobicContact CD1-CG2 4.49Å; F477-V480 WeakPolarHBondContact O-CG2 3.47Å; F477-V480 PolarHBondContact O-N 3.46Å; F477-V480 VanDerWaalsContact O-N 3.16Å; F477-L486 HydrophobicContact CD2-CD2 4.17Å; F477-L486 HydrophobicContact CE1-CD1 4.13Å; F477-L486 HydrophobicContact CE1-CD2 4.31Å; F477-L486 HydrophobicContact CE2-CD2 3.83Å; F477-L486 HydrophobicContact CZ-CD1 4.19Å; F477-L486 HydrophobicContact CZ-CD2 3.91Å; F477-L488 HydrophobicContact CZ-CD1 4.39Å; F477-F501 HydrophobicContact CD2-CD1 4.02Å; F477-F501 HydrophobicContact CD2-CE1 4.44Å; F477-F501 HydrophobicContact CE2-CD1 4.07Å; F477-F501 HydrophobicContact CE2-CE1 4.03Å; F477-L504 HydrophobicContact CB-CD1 3.95Å; F477-L504 HydrophobicContact CB-CD2 3.68Å; F477-L504 HydrophobicContact CB-CG 3.83Å; F477-L504 HydrophobicContact CD2-CD1 4.23Å; F477-L504 HydrophobicContact CG-CD1 4.24Å
478	T	91.1	Very high	95.1	Very high	64 Å²	64	44.1 Å²	44.1	39%	0.393	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-25.2	-173.9	-57	0	0	0	0	113.5	Y475 V480 D502	Y475-T478 VanDerWaalsContact CA-OG1 3.29Å; Y475-T478 WeakPolarHBondContact CA-OG1 3.35Å; Y475-T478 WeakPolarHBondContact CB-OG1 3.3Å; Y475-T478 PolarHBondContact O-N 3.5Å; Y475-T478 PolarHBondContact O-OG1 3.44Å; T478-V480 VanDerWaalsContact C-N 3.34Å; T478-V480 PolarHBondContact O-N 2.9Å; T478-D502 PolarHBondContact OG1-O 2.93Å
479	S	89.4	Confident	95.2	Very high	46 Å²	46	39.4 Å²	39.4	32%	0.322	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-0.3	-179.8	-53.6	0	0	0	0	114.8	D454 F477 P481	D454-S479 VanDerWaalsContact OD1-CB 3.31Å; D454-S479 WeakPolarHBondContact OD1-CB 3.41Å; D454-S479 PolarHBondContact OD1-OG 3.11Å; F477-S479 PolarHBondContact O-N 2.81Å; F477-S479 VanDerWaalsContact O-N 3.15Å; S479-P481 WeakPolarHBondContact O-CD 3.26Å
480	V	94.2	Very high	95.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.223	C	C	.	.			trans	-121.5	61.3	179.1	-69.2	0	0	0	0	112.2	F453 L456 M459 F477 T478 N482 L483 L504	F453-V480 HydrophobicContact CB-CG1 3.69Å; F453-V480 HydrophobicContact CG-CG1 4.49Å; L456-V480 HydrophobicContact CB-CG1 4.22Å; M459-V480 HydrophobicContact CB-CB 4.47Å; M459-V480 HydrophobicContact CB-CG1 4.03Å; M459-V480 HydrophobicContact SD-CG1 4.05Å; F477-V480 HydrophobicContact CB-CG2 4.06Å; F477-V480 HydrophobicContact CD1-CG2 4.49Å; F477-V480 WeakPolarHBondContact O-CG2 3.47Å; F477-V480 PolarHBondContact O-N 3.46Å; F477-V480 VanDerWaalsContact O-N 3.16Å; T478-V480 VanDerWaalsContact C-N 3.34Å; T478-V480 PolarHBondContact O-N 2.9Å; V480-N482 PolarHBondContact O-N 2.57Å; V480-N482 VanDerWaalsContact O-N 3.15Å; V480-L483 HydrophobicContact CG2-CB 4.44Å; V480-L483 HydrophobicContact CG2-CD2 4.37Å; V480-L483 WeakPolarHBondContact O-CB 3.43Å; V480-L483 PolarHBondContact O-N 3.41Å; V480-L483 VanDerWaalsContact O-N 3.15Å; V480-L504 HydrophobicContact CG2-CD2 3.99Å
481	P	92.7	Very high	95.3	Very high	47 Å²	47	38.8 Å²	38.8	31%	0.305	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-18.1	-173.5	28.8	-37.2	0	0	0	114.4	S479 L483 G503 T505 N506	S479-P481 WeakPolarHBondContact O-CD 3.26Å; P481-L483 VanDerWaalsContact C-N 3.33Å; P481-G503 WeakPolarHBondContact CA-O 3.3Å; P481-T505 PolarHBondContact O-OG1 2.88Å; P481-N506 WeakPolarHBondContact O-CB 3.45Å; P481-N506 PolarHBondContact O-N 3Å; P481-N506 PolarHBondContact O-ND2 2.97Å
482	N	95.3	Very high	95.3	Very high	78 Å²	78	38.5 Å²	38.5	42%	0.417	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	3.5	178.7	-69.4	-40.5	0	0	0	113.6	P457 M459 V480 V484 N506	P457-N482 WeakPolarHBondContact O-CB 3.37Å; P457-N482 PolarHBondContact O-ND2 3.29Å; M459-N482 CarbonylContact O-C 3.55Å; V480-N482 PolarHBondContact O-N 2.57Å; V480-N482 VanDerWaalsContact O-N 3.15Å; N482-V484 PolarHBondContact O-N 3.18Å; N482-N506 PolarHBondContact OD1-ND2 2.83Å
483	L	97.1	Very high	95.4	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.2	C	C	.	.			trans	-62	124.6	178.7	-159.6	72.5	0	0	0	109.7	M459 L462 V480 P481 L486 L504 N506 L507	M459-L483 HydrophobicContact CG-CD1 3.78Å; M459-L483 VanDerWaalsContact O-CA 3.32Å; M459-L483 WeakPolarHBondContact O-CA 3.45Å; M459-L483 PolarHBondContact O-N 2.83Å; M459-L483 VanDerWaalsContact O-N 3.09Å; M459-L483 HydrophobicContact SD-CD1 4.2Å; L462-L483 HydrophobicContact CB-CD1 3.85Å; L462-L483 HydrophobicContact CB-CD2 4.37Å; V480-L483 HydrophobicContact CG2-CB 4.44Å; V480-L483 HydrophobicContact CG2-CD2 4.37Å; V480-L483 WeakPolarHBondContact O-CB 3.43Å; V480-L483 PolarHBondContact O-N 3.41Å; V480-L483 VanDerWaalsContact O-N 3.15Å; P481-L483 VanDerWaalsContact C-N 3.33Å; L483-L486 HydrophobicContact CD2-CB 3.85Å; L483-L486 HydrophobicContact CD2-CD1 4.19Å; L483-L486 HydrophobicContact CD2-CD2 4.42Å; L483-L486 HydrophobicContact CD2-CG 4.37Å; L483-L504 HydrophobicContact CB-CD2 3.84Å; L483-L504 HydrophobicContact CD2-CD1 4.5Å; L483-L504 HydrophobicContact CD2-CD2 3.84Å; L483-N506 CarbonylContact O-C 3.57Å; L483-L507 HydrophobicContact CB-CD1 4.43Å; L483-L507 HydrophobicContact CD2-CD1 4.15Å; L483-L507 HydrophobicContact CG-CD1 4.18Å; L483-L507 WeakPolarHBondContact O-CA 3.42Å; L483-L507 PolarHBondContact O-N 3.34Å
484	V	98.2	Very high	95.6	Very high	54 Å²	54	37.8 Å²	37.8	33%	0.327	20%	0.202	S	C	.	.			trans	-100.3	-36	179.5	178.3	0	0	0	0	110.4	S460 N482 R508 R509	S460-V484 WeakPolarHBondContact O-CA 3.47Å; S460-V484 PolarHBondContact O-N 2.71Å; N482-V484 PolarHBondContact O-N 3.18Å; V484-R508 HydrophobicContact CG1-CB 4.03Å; V484-R508 HydrophobicContact CG1-CG 4.04Å; V484-R508 PolarHBondContact O-N 3.37Å; V484-R509 PolarHBondContact O-N 3.32Å
485	E	98.5	Very high	95.6	Very high	62 Å²	62	37.4 Å²	37.4	29%	0.29	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	125.6	-177.2	-176	154.9	-179.6	0	0	111.3	S460 G461 L462 R509 H511	S460-E485 PolarHBondContact O-N 2.9Å; G461-E485 WeakPolarHBondContact CA-O 3.12Å; L462-E485 PolarHBondContact N-O 3.26Å; E485-R509 WeakPolarHBondContact CA-O 3.46Å; E485-R509 HydrophobicContact CB-CB 4.29Å; E485-R509 HydrophobicContact CG-CB 3.95Å; E485-R509 IonicContact OE2-NH1 3.04Å; E485-R509 PolarHBondContact OE2-NH1 2.87Å; E485-H511 IonicContact OE1-CD2 2.78Å; E485-H511 IonicContact OE1-CE1 2.91Å; E485-H511 IonicContact OE1-NE2 3.34Å; E485-H511 PolarHBondContact OE1-NE2 2.9Å
486	L	98.4	Very high	95.8	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	120.2	176.9	176.9	57.2	0	0	0	109.3	L462 F477 L483 L488 F501 L504 L507 R509 L510 H511	L462-L486 HydrophobicContact CB-CD1 4.08Å; L462-L486 HydrophobicContact CD2-CD1 3.89Å; L462-L486 HydrophobicContact CG-CD1 4.03Å; F477-L486 HydrophobicContact CD2-CD2 4.17Å; F477-L486 HydrophobicContact CE1-CD1 4.13Å; F477-L486 HydrophobicContact CE1-CD2 4.31Å; F477-L486 HydrophobicContact CE2-CD2 3.83Å; F477-L486 HydrophobicContact CZ-CD1 4.19Å; F477-L486 HydrophobicContact CZ-CD2 3.91Å; L483-L486 HydrophobicContact CD2-CB 3.85Å; L483-L486 HydrophobicContact CD2-CD1 4.19Å; L483-L486 HydrophobicContact CD2-CD2 4.42Å; L483-L486 HydrophobicContact CD2-CG 4.37Å; L486-L488 HydrophobicContact CD1-CD1 4.41Å; L486-L488 HydrophobicContact CD1-CG 4.17Å; L486-L488 HydrophobicContact CD2-CD1 3.96Å; L486-L488 HydrophobicContact CG-CD1 4.09Å; L486-L488 HydrophobicContact CG-CG 4.17Å; L486-F501 HydrophobicContact CD2-CD1 4.08Å; L486-F501 HydrophobicContact CD2-CE1 3.93Å; L486-L504 HydrophobicContact CD2-CD1 4Å; L486-L507 HydrophobicContact CB-CD1 3.81Å; L486-R509 PolarHBondContact N-O 2.9Å; L486-L510 HydrophobicContact CB-CD1 4.04Å; L486-L510 HydrophobicContact CD2-CD1 3.93Å; L486-L510 HydrophobicContact CG-CD1 4Å; L486-L510 WeakPolarHBondContact O-CA 3.47Å; L486-H511 PolarHBondContact O-N 3.44Å
487	N	98.6	Very high	95.8	Very high	28 Å²	28	34.4 Å²	34.4	15%	0.15	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	114.6	177.8	-169.5	-7.6	0	0	0	112	L462 N463 L464 A465 A489 H511	L462-N487 PolarHBondContact O-N 3.12Å; N463-N487 HydrophobicContact CB-CB 4.42Å; N463-N487 PolarHBondContact OD1-ND2 2.82Å; L464-N487 CarbonylContact C-O 3.55Å; L464-N487 WeakPolarHBondContact CA-O 3.47Å; L464-N487 PolarHBondContact N-O 2.74Å; A465-N487 PolarHBondContact N-O 2.79Å; N487-A489 WeakPolarHBondContact OD1-CB 3.33Å; N487-A489 PolarHBondContact OD1-N 3.47Å; N487-H511 HydrophobicContact CB-CB 4.19Å; N487-H511 WeakPolarHBondContact OD1-CB 3.26Å
488	L	98.4	Very high	95.6	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.222	C	C	.	.			trans	-122.6	18.5	178.7	-69.7	166.7	0	0	0	111.3	I448 L464 I469 I472 F477 L486 N491 I493 F501 H511 L512 N515	I448-L488 HydrophobicContact CD1-CD2 4.22Å; L464-L488 HydrophobicContact CB-CD2 4.01Å; L464-L488 HydrophobicContact CD1-CD2 4.1Å; I469-L488 HydrophobicContact CD1-CD2 4.21Å; I472-L488 HydrophobicContact CD1-CD1 4.23Å; I472-L488 HydrophobicContact CD1-CD2 4.25Å; I472-L488 HydrophobicContact CG1-CD1 4.49Å; F477-L488 HydrophobicContact CZ-CD1 4.39Å; L486-L488 HydrophobicContact CD1-CD1 4.41Å; L486-L488 HydrophobicContact CD1-CG 4.17Å; L486-L488 HydrophobicContact CD2-CD1 3.96Å; L486-L488 HydrophobicContact CG-CD1 4.09Å; L486-L488 HydrophobicContact CG-CG 4.17Å; L488-N491 PolarHBondContact O-ND2 2.78Å; L488-N491 VanDerWaalsContact O-ND2 3.11Å; L488-I493 HydrophobicContact CB-CD1 4.01Å; L488-F501 HydrophobicContact CD1-CE1 4Å; L488-F501 HydrophobicContact CD1-CZ 4.38Å; L488-H511 CarbonylContact C-O 3.46Å; L488-H511 WeakPolarHBondContact CA-O 3.48Å; L488-H511 PolarHBondContact N-O 3.48Å; L488-L512 HydrophobicContact CB-CD2 4.02Å; L488-L512 HydrophobicContact CD1-CD2 4.08Å; L488-N515 PolarHBondContact O-ND2 3.32Å
489	A	98.5	Very high	95.6	Very high	2 Å²	2	37.3 Å²	37.3	2%	0.017	22%	0.216	C	C	.	.			trans	-61.6	154.4	-176.8	0	0	0	0	0	113	A465 N466 N487 N491 H511 Q513	A465-A489 CarbonylContact C-O 3.25Å; A465-A489 WeakPolarHBondContact CA-O 3.22Å; A465-A489 HydrophobicContact CB-CB 4.19Å; N466-A489 PolarHBondContact N-O 3.15Å; N487-A489 WeakPolarHBondContact OD1-CB 3.33Å; N487-A489 PolarHBondContact OD1-N 3.47Å; A489-N491 VanDerWaalsContact C-N 3.33Å; A489-N491 PolarHBondContact O-N 2.82Å; A489-N491 PolarHBondContact O-ND2 3.03Å; A489-N491 VanDerWaalsContact O-ND2 3.13Å; A489-H511 HydrophobicContact CB-CB 4.47Å; A489-H511 PolarHBondContact N-O 2.99Å; A489-Q513 CarbonylContact C-O 3.59Å; A489-Q513 WeakPolarHBondContact CA-O 3.38Å; A489-Q513 VanDerWaalsContact CB-CD 3.42Å; A489-Q513 HydrophobicContact CB-CG 3.82Å
490	N	98.3	Very high	95.8	Very high	52 Å²	52	35.1 Å²	35.1	28%	0.278	20%	0.201	S	C	.	.	S	Bend	trans	51.7	48.4	174.5	-57.3	-27	0	0	0	113.1	N466 Q513 G514	N466-N490 VanDerWaalsContact CA-O 3.25Å; N466-N490 WeakPolarHBondContact CA-O 3.36Å; N466-N490 PolarHBondContact N-O 3.22Å; N466-N490 WeakPolarHBondContact OD1-CB 3.45Å; N466-N490 PolarHBondContact OD1-ND2 3.03Å; N490-Q513 PolarHBondContact N-O 3.47Å; N490-G514 WeakPolarHBondContact CA-O 3.33Å
491	N	98.2	Very high	95.8	Very high	12 Å²	12	35.2 Å²	35.2	6%	0.064	20%	0.201	C	C	.	.	S	Bend	trans	-110.7	-170.6	170.1	-83.9	-85.8	0	0	0	109	L464 N467 H468 I469 L488 A489 I493 N515	L464-N491 PolarHBondContact O-ND2 2.76Å; N467-N491 VanDerWaalsContact CA-OD1 3.26Å; N467-N491 WeakPolarHBondContact CA-OD1 3.32Å; N467-N491 WeakPolarHBondContact CB-OD1 3.31Å; N467-N491 PolarHBondContact N-OD1 3.02Å; N467-N491 PolarHBondContact O-OD1 3.37Å; H468-N491 PolarHBondContact N-OD1 2.84Å; I469-N491 HydrophobicContact CB-CB 4.17Å; I469-N491 WeakPolarHBondContact CB-OD1 3.4Å; I469-N491 WeakPolarHBondContact CG1-OD1 3.41Å; I469-N491 PolarHBondContact N-OD1 3.49Å; L488-N491 PolarHBondContact O-ND2 2.78Å; L488-N491 VanDerWaalsContact O-ND2 3.11Å; A489-N491 VanDerWaalsContact C-N 3.33Å; A489-N491 PolarHBondContact O-N 2.82Å; A489-N491 PolarHBondContact O-ND2 3.03Å; A489-N491 VanDerWaalsContact O-ND2 3.13Å; N491-I493 HydrophobicContact CB-CD1 4.06Å; N491-I493 HydrophobicContact CB-CG1 3.87Å; N491-N515 VanDerWaalsContact CA-OD1 3.26Å; N491-N515 WeakPolarHBondContact CA-OD1 3.43Å; N491-N515 WeakPolarHBondContact CB-OD1 3.48Å; N491-N515 PolarHBondContact N-OD1 3.47Å; N491-N515 PolarHBondContact O-OD1 3.43Å
492	A	97	Very high	95.8	Very high	34 Å²	34	34.5 Å²	34.5	28%	0.281	19%	0.194	S	C	.	.			trans	-101	25.6	175.6	0	0	0	0	0	112.1	I469 V470 S494	I469-A492 CarbonylContact O-C 3.29Å; I469-A492 WeakPolarHBondContact O-CA 3.35Å; I469-A492 PolarHBondContact O-N 3.18Å; V470-A492 HydrophobicContact CG2-CB 4.24Å; A492-S494 PolarHBondContact O-N 3.38Å
493	I	97.6	Very high	95.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.188	C	C	.	.			trans	-67.9	110.2	-167.2	-58.7	167.6	0	0	0	109.9	I469 V470 I472 L488 N491 L496 N515 N516 I517	I469-I493 HydrophobicContact CB-CG1 4.34Å; I469-I493 HydrophobicContact CG2-CD1 4.44Å; I469-I493 HydrophobicContact CG2-CG1 4.12Å; I469-I493 WeakPolarHBondContact O-CG1 3.29Å; I469-I493 PolarHBondContact O-N 2.97Å; I469-I493 VanDerWaalsContact O-N 3.11Å; V470-I493 WeakPolarHBondContact O-CA 3.35Å; I472-I493 HydrophobicContact CD1-CD1 3.97Å; I472-I493 HydrophobicContact CG1-CD1 4.09Å; I472-I493 HydrophobicContact CG1-CG2 4.29Å; L488-I493 HydrophobicContact CB-CD1 4.01Å; N491-I493 HydrophobicContact CB-CD1 4.06Å; N491-I493 HydrophobicContact CB-CG1 3.87Å; I493-L496 HydrophobicContact CG2-CD2 3.67Å; I493-L496 HydrophobicContact CG2-CG 4.08Å; I493-N515 HydrophobicContact CB-CB 4.11Å; I493-N515 VanDerWaalsContact CB-OD1 3.24Å; I493-N515 WeakPolarHBondContact CB-OD1 3.28Å; I493-N515 VanDerWaalsContact CG1-OD1 3.27Å; I493-N515 WeakPolarHBondContact CG1-OD1 2.92Å; I493-N515 PolarHBondContact N-OD1 3.23Å; I493-N516 CarbonylContact O-C 3.48Å; I493-N516 WeakPolarHBondContact O-CA 3.48Å; I493-N516 PolarHBondContact O-N 2.96Å; I493-I517 HydrophobicContact CG2-CG1 4.43Å; I493-I517 PolarHBondContact O-N 2.83Å
494	S	95.5	Very high	95.4	Very high	56 Å²	56	32.3 Å²	32.3	39%	0.392	19%	0.189	S	C	.	.			trans	-109.1	-17.1	173.8	59.5	0	0	0	0	113.4	V470 A492	V470-S494 PolarHBondContact O-N 2.86Å; A492-S494 PolarHBondContact O-N 3.38Å
495	Q	92.9	Very high	95.1	Very high	133 Å²	133	33.2 Å²	33.2	62%	0.621	20%	0.195	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-127.6	114	-176	-65.6	178.5	2.7	0	0	110.5	A471 I472	A471-Q495 WeakPolarHBondContact CA-O 3.24Å; A471-Q495 HydrophobicContact CB-CB 4.01Å; I472-Q495 PolarHBondContact N-O 3.47Å
496	L	94.9	Very high	95	Very high	21 Å²	21	31.9 Å²	31.9	11%	0.11	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	119.7	169.2	-66	175	0	0	0	108.1	I472 I493 F501 I517 V523	I472-L496 HydrophobicContact CB-CD2 3.9Å; I472-L496 HydrophobicContact CG1-CD2 3.66Å; I493-L496 HydrophobicContact CG2-CD2 3.67Å; I493-L496 HydrophobicContact CG2-CG 4.08Å; L496-F501 HydrophobicContact CD2-CE2 4.44Å; L496-F501 HydrophobicContact CD2-CZ 4.15Å; L496-I517 HydrophobicContact CD1-CD1 3.83Å; L496-I517 HydrophobicContact CD1-CG1 4.15Å; L496-I517 HydrophobicContact CD1-CG2 4.24Å; L496-V523 HydrophobicContact CB-CG1 4.11Å; L496-V523 HydrophobicContact CD1-CG2 4.2Å
497	S	92.8	Very high	95	Very high	34 Å²	34	31.9 Å²	31.9	24%	0.238	19%	0.19	C	C	.	.			trans	-72.1	147.8	172.5	61.3	0	0	0	0	111	I472 R474 N499 C500	I472-S497 PolarHBondContact O-N 3.4Å; I472-S497 PolarHBondContact O-OG 3.21Å; R474-S497 WeakPolarHBondContact CA-OG 3.07Å; R474-S497 PolarHBondContact N-OG 3.11Å; S497-N499 PolarHBondContact O-N 3.49Å; S497-C500 WeakPolarHBondContact O-CB 3.3Å; S497-C500 PolarHBondContact O-N 3.36Å; S497-C500 PolarHBondContact O-SG 3.13Å; S497-C500 WeakPolarHBondContact OG-CB 3.43Å
498	V	89.3	Confident	95	Very high	75 Å²	75	37.3 Å²	37.3	46%	0.455	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-33.9	-174.1	-177.8	0	0	0	0	113.2
499	N	91.6	Very high	95	Very high	50 Å²	50	43.1 Å²	43.1	27%	0.267	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	26	-175.9	-59.9	-1.9	0	0	0	112.3	Y475 S497 D502	Y475-N499 HydrophobicContact CD1-CB 4.23Å; Y475-N499 HydrophobicContact CE1-CB 3.57Å; Y475-N499 PolarHBondContact N-O 3.48Å; Y475-N499 PolarHBondContact OH-ND2 3.37Å; S497-N499 PolarHBondContact O-N 3.49Å; N499-D502 HydrophobicContact CB-CB 4.39Å; N499-D502 VanDerWaalsContact CB-OD2 3.26Å; N499-D502 WeakPolarHBondContact CB-OD2 3.16Å
500	C	93.8	Very high	95	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-36.2	-178.7	58	0	0	0	0	113.4	I472 S497	I472-C500 HydrophobicContact CB-CB 4.11Å; I472-C500 HydrophobicContact CG2-CB 3.61Å; S497-C500 WeakPolarHBondContact O-CB 3.3Å; S497-C500 PolarHBondContact O-N 3.36Å; S497-C500 PolarHBondContact O-SG 3.13Å; S497-C500 WeakPolarHBondContact OG-CB 3.43Å
501	F	95	Very high	95	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.009	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	7.2	-179	-57.3	-56.3	0	0	0	113.6	F477 L486 L488 L496 L504 L510 L512 V523 L524 L527	F477-F501 HydrophobicContact CD2-CD1 4.02Å; F477-F501 HydrophobicContact CD2-CE1 4.44Å; F477-F501 HydrophobicContact CE2-CD1 4.07Å; F477-F501 HydrophobicContact CE2-CE1 4.03Å; L486-F501 HydrophobicContact CD2-CD1 4.08Å; L486-F501 HydrophobicContact CD2-CE1 3.93Å; L488-F501 HydrophobicContact CD1-CE1 4Å; L488-F501 HydrophobicContact CD1-CZ 4.38Å; L496-F501 HydrophobicContact CD2-CE2 4.44Å; L496-F501 HydrophobicContact CD2-CZ 4.15Å; F501-L504 HydrophobicContact CB-CD1 4.13Å; F501-L504 HydrophobicContact CD1-CD1 4.09Å; F501-L504 VanDerWaalsContact O-CB 3.3Å; F501-L504 WeakPolarHBondContact O-CB 3.13Å; F501-L504 WeakPolarHBondContact O-CG 3.46Å; F501-L504 PolarHBondContact O-N 2.99Å; F501-L510 HydrophobicContact CD2-CD2 4.4Å; F501-L510 HydrophobicContact CE1-CD1 4.23Å; F501-L510 HydrophobicContact CE2-CD2 4.12Å; F501-L510 HydrophobicContact CZ-CD1 4.35Å; F501-L510 HydrophobicContact CZ-CD2 4.26Å; F501-L512 HydrophobicContact CE2-CD1 4.4Å; F501-L512 HydrophobicContact CZ-CD1 4.32Å; F501-L512 HydrophobicContact CZ-CD2 4.18Å; F501-V523 HydrophobicContact CD2-CB 4.41Å; F501-V523 HydrophobicContact CD2-CG2 4.27Å; F501-V523 HydrophobicContact CE2-CG2 4.09Å; F501-L524 HydrophobicContact CD2-CD2 4.39Å; F501-L524 HydrophobicContact CE2-CD2 4.42Å; F501-L527 HydrophobicContact CB-CD1 4.33Å; F501-L527 HydrophobicContact CB-CD2 4.08Å
502	D	91.9	Very high	95	Very high	31 Å²	31	41.1 Å²	41.1	17%	0.166	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	137.2	178.2	-81.9	4.5	0	0	0	111.7	Y475 T478 N499 N526	Y475-D502 HydrophobicContact CD1-CB 3.98Å; Y475-D502 HydrophobicContact CE1-CB 4.13Å; T478-D502 PolarHBondContact OG1-O 2.93Å; N499-D502 HydrophobicContact CB-CB 4.39Å; N499-D502 VanDerWaalsContact CB-OD2 3.26Å; N499-D502 WeakPolarHBondContact CB-OD2 3.16Å; D502-N526 PolarHBondContact OD1-ND2 3.06Å
503	G	89.6	Confident	95	Very high	28 Å²	28	41.4 Å²	41.4	29%	0.289	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.7	-14.5	-175.6	0	0	0	0	0	114.2	P481 T505	P481-G503 WeakPolarHBondContact CA-O 3.3Å; G503-T505 PolarHBondContact O-N 3.32Å
504	L	95	Very high	95.1	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.021	23%	0.227	C	C	.	.			trans	-77.1	54.7	177.9	-65.6	-175.5	0	0	0	113.4	F477 V480 L483 L486 F501 N506 L507 L527	F477-L504 HydrophobicContact CB-CD1 3.95Å; F477-L504 HydrophobicContact CB-CD2 3.68Å; F477-L504 HydrophobicContact CB-CG 3.83Å; F477-L504 HydrophobicContact CD2-CD1 4.23Å; F477-L504 HydrophobicContact CG-CD1 4.24Å; V480-L504 HydrophobicContact CG2-CD2 3.99Å; L483-L504 HydrophobicContact CB-CD2 3.84Å; L483-L504 HydrophobicContact CD2-CD1 4.5Å; L483-L504 HydrophobicContact CD2-CD2 3.84Å; L486-L504 HydrophobicContact CD2-CD1 4Å; F501-L504 HydrophobicContact CB-CD1 4.13Å; F501-L504 HydrophobicContact CD1-CD1 4.09Å; F501-L504 VanDerWaalsContact O-CB 3.3Å; F501-L504 WeakPolarHBondContact O-CB 3.13Å; F501-L504 WeakPolarHBondContact O-CG 3.46Å; F501-L504 PolarHBondContact O-N 2.99Å; L504-N506 PolarHBondContact O-N 3.29Å; L504-N506 VanDerWaalsContact O-N 3.13Å; L504-L507 HydrophobicContact CB-CB 4.02Å; L504-L507 HydrophobicContact CB-CD2 4.44Å; L504-L507 HydrophobicContact CD1-CD1 4.48Å; L504-L507 HydrophobicContact CD1-CD2 3.95Å; L504-L507 WeakPolarHBondContact O-CB 3.27Å; L504-L507 PolarHBondContact O-N 2.75Å; L504-L507 VanDerWaalsContact O-N 3.15Å; L504-L527 HydrophobicContact CB-CD2 3.92Å
505	T	91.8	Very high	95.2	Very high	74 Å²	74	40.1 Å²	40.1	45%	0.454	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-20.3	-172.6	56.9	0	0	0	0	115.1	P481 G503 R529	P481-T505 PolarHBondContact O-OG1 2.88Å; G503-T505 PolarHBondContact O-N 3.32Å; T505-R529 WeakPolarHBondContact O-CD 3.3Å
506	N	95.9	Very high	95.4	Very high	34 Å²	34	36.5 Å²	36.5	18%	0.182	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	3	178.9	-70.5	-63.7	0	0	0	114.9	P481 N482 L483 L504 R508 R529	P481-N506 WeakPolarHBondContact O-CB 3.45Å; P481-N506 PolarHBondContact O-N 3Å; P481-N506 PolarHBondContact O-ND2 2.97Å; N482-N506 PolarHBondContact OD1-ND2 2.83Å; L483-N506 CarbonylContact O-C 3.57Å; L504-N506 PolarHBondContact O-N 3.29Å; L504-N506 VanDerWaalsContact O-N 3.13Å; N506-R508 PolarHBondContact O-N 2.87Å; N506-R529 PolarHBondContact OD1-NH1 3.45Å
507	L	97.9	Very high	95.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.189	C	C	.	.			trans	-66.2	126.9	-173.7	-164.6	75.8	0	0	0	110.6	L483 L486 L504 L510 L527 R529 L530	L483-L507 HydrophobicContact CB-CD1 4.43Å; L483-L507 HydrophobicContact CD2-CD1 4.15Å; L483-L507 HydrophobicContact CG-CD1 4.18Å; L483-L507 WeakPolarHBondContact O-CA 3.42Å; L483-L507 PolarHBondContact O-N 3.34Å; L486-L507 HydrophobicContact CB-CD1 3.81Å; L504-L507 HydrophobicContact CB-CB 4.02Å; L504-L507 HydrophobicContact CB-CD2 4.44Å; L504-L507 HydrophobicContact CD1-CD1 4.48Å; L504-L507 HydrophobicContact CD1-CD2 3.95Å; L504-L507 WeakPolarHBondContact O-CB 3.27Å; L504-L507 PolarHBondContact O-N 2.75Å; L504-L507 VanDerWaalsContact O-N 3.15Å; L507-L510 HydrophobicContact CD2-CB 4.13Å; L507-L510 HydrophobicContact CD2-CD1 4.41Å; L507-L527 HydrophobicContact CB-CD2 4.46Å; L507-L527 HydrophobicContact CD2-CD1 4.19Å; L507-L527 HydrophobicContact CD2-CD2 4.15Å; L507-R529 CarbonylContact O-C 3.51Å; L507-L530 HydrophobicContact CD2-CD1 4.17Å; L507-L530 HydrophobicContact CG-CD1 4.33Å; L507-L530 VanDerWaalsContact O-CA 3.29Å; L507-L530 WeakPolarHBondContact O-CA 3.34Å; L507-L530 PolarHBondContact O-N 2.82Å; L507-L530 VanDerWaalsContact O-N 3.12Å
508	R	98.2	Very high	95.6	Very high	142 Å²	142	36 Å²	36	54%	0.536	20%	0.198	S	C	.	.			trans	-111.2	-32.7	178.2	-63.8	-171.7	-178.7	-153.9	-0.7	112.3	V484 N506 D531 Y532	V484-R508 HydrophobicContact CG1-CB 4.03Å; V484-R508 HydrophobicContact CG1-CG 4.04Å; V484-R508 PolarHBondContact O-N 3.37Å; N506-R508 PolarHBondContact O-N 2.87Å; R508-D531 PolarHBondContact O-N 3.24Å; R508-Y532 PolarHBondContact O-N 3.24Å
509	R	98.6	Very high	95.6	Very high	122 Å²	122	36.3 Å²	36.3	46%	0.46	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	128.2	-177.3	-53.9	-163.3	-175.9	138	-7.8	111.3	V484 E485 L486 Y532	V484-R509 PolarHBondContact O-N 3.32Å; E485-R509 WeakPolarHBondContact CA-O 3.46Å; E485-R509 HydrophobicContact CB-CB 4.29Å; E485-R509 HydrophobicContact CG-CB 3.95Å; E485-R509 IonicContact OE2-NH1 3.04Å; E485-R509 PolarHBondContact OE2-NH1 2.87Å; L486-R509 PolarHBondContact N-O 2.9Å; R509-Y532 WeakPolarHBondContact CA-O 3.25Å; R509-Y532 HydrophobicContact CB-CD1 4.33Å
510	L	98.4	Very high	95.5	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	121	177.6	178.6	60.6	0	0	0	110.4	L486 F501 L507 L512 L524 L527 L530 Y532 V533 N534	L486-L510 HydrophobicContact CB-CD1 4.04Å; L486-L510 HydrophobicContact CD2-CD1 3.93Å; L486-L510 HydrophobicContact CG-CD1 4Å; L486-L510 WeakPolarHBondContact O-CA 3.47Å; F501-L510 HydrophobicContact CD2-CD2 4.4Å; F501-L510 HydrophobicContact CE1-CD1 4.23Å; F501-L510 HydrophobicContact CE2-CD2 4.12Å; F501-L510 HydrophobicContact CZ-CD1 4.35Å; F501-L510 HydrophobicContact CZ-CD2 4.26Å; L507-L510 HydrophobicContact CD2-CB 4.13Å; L507-L510 HydrophobicContact CD2-CD1 4.41Å; L510-L512 HydrophobicContact CD1-CD1 4.47Å; L510-L512 HydrophobicContact CD1-CG 4.21Å; L510-L512 HydrophobicContact CD2-CD1 3.81Å; L510-L512 HydrophobicContact CD2-CG 4.4Å; L510-L512 HydrophobicContact CG-CD1 3.97Å; L510-L512 HydrophobicContact CG-CG 4.02Å; L510-L524 HydrophobicContact CD2-CD2 3.54Å; L510-L527 HydrophobicContact CD2-CD1 4.17Å; L510-L530 HydrophobicContact CB-CD1 3.84Å; L510-Y532 PolarHBondContact N-O 3.03Å; L510-V533 HydrophobicContact CB-CG2 4.21Å; L510-V533 HydrophobicContact CD2-CG2 4.37Å; L510-V533 HydrophobicContact CG-CG2 4.39Å; L510-V533 WeakPolarHBondContact O-CA 3.09Å; L510-N534 PolarHBondContact O-N 3.45Å
511	H	98.6	Very high	94.8	Very high	23 Å²	23	40.5 Å²	40.5	11%	0.106	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	116.2	179.1	-52.8	-88.8	0	0	0	109.8	E485 L486 N487 L488 A489 Q513 Y532	E485-H511 IonicContact OE1-CD2 2.78Å; E485-H511 IonicContact OE1-CE1 2.91Å; E485-H511 IonicContact OE1-NE2 3.34Å; E485-H511 PolarHBondContact OE1-NE2 2.9Å; L486-H511 PolarHBondContact O-N 3.44Å; N487-H511 HydrophobicContact CB-CB 4.19Å; N487-H511 WeakPolarHBondContact OD1-CB 3.26Å; L488-H511 CarbonylContact C-O 3.46Å; L488-H511 WeakPolarHBondContact CA-O 3.48Å; L488-H511 PolarHBondContact N-O 3.48Å; A489-H511 HydrophobicContact CB-CB 4.47Å; A489-H511 PolarHBondContact N-O 2.99Å; H511-Q513 VanDerWaalsContact CB-OE1 3.3Å; H511-Y532 AromaticContact CE1-CE1 3.73Å; H511-Y532 AromaticContact ND1-CE1 3.77Å
512	L	98.3	Very high	94.2	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.223	C	C	.	.			trans	-128	9.5	-178.6	-71.9	169.2	0	0	0	111.8	L488 F501 L510 N515 I517 N534 V535 N538	L488-L512 HydrophobicContact CB-CD2 4.02Å; L488-L512 HydrophobicContact CD1-CD2 4.08Å; F501-L512 HydrophobicContact CE2-CD1 4.4Å; F501-L512 HydrophobicContact CZ-CD1 4.32Å; F501-L512 HydrophobicContact CZ-CD2 4.18Å; L510-L512 HydrophobicContact CD1-CD1 4.47Å; L510-L512 HydrophobicContact CD1-CG 4.21Å; L510-L512 HydrophobicContact CD2-CD1 3.81Å; L510-L512 HydrophobicContact CD2-CG 4.4Å; L510-L512 HydrophobicContact CG-CD1 3.97Å; L510-L512 HydrophobicContact CG-CG 4.02Å; L512-N515 PolarHBondContact O-ND2 2.86Å; L512-I517 HydrophobicContact CB-CD1 3.99Å; L512-I517 HydrophobicContact CD1-CD1 4.39Å; L512-I517 HydrophobicContact CD2-CD1 4.26Å; L512-I517 HydrophobicContact CG-CD1 4.46Å; L512-N534 CarbonylContact C-O 3.46Å; L512-N534 WeakPolarHBondContact CA-O 3.48Å; L512-N534 WeakPolarHBondContact CB-O 3.35Å; L512-N534 PolarHBondContact N-O 2.79Å; L512-V535 HydrophobicContact CB-CG1 4.32Å; L512-V535 HydrophobicContact CD1-CG1 4.39Å; L512-N538 PolarHBondContact O-ND2 3.16Å
513	Q	98.3	Very high	94.1	Very high	40 Å²	40	39.9 Å²	39.9	19%	0.187	22%	0.217	C	C	.	.			trans	-63.5	153.1	-177.2	66.6	-82.4	15.7	0	0	113.3	A489 N490 H511 N515 N534 S536	A489-Q513 CarbonylContact C-O 3.59Å; A489-Q513 WeakPolarHBondContact CA-O 3.38Å; A489-Q513 VanDerWaalsContact CB-CD 3.42Å; A489-Q513 HydrophobicContact CB-CG 3.82Å; N490-Q513 PolarHBondContact N-O 3.47Å; H511-Q513 VanDerWaalsContact CB-OE1 3.3Å; Q513-N515 VanDerWaalsContact C-N 3.34Å; Q513-N515 PolarHBondContact O-N 3.48Å; Q513-N515 PolarHBondContact O-ND2 3.08Å; Q513-N534 WeakPolarHBondContact CB-OD1 3.29Å; Q513-N534 PolarHBondContact N-O 2.73Å; Q513-S536 CarbonylContact C-O 3.42Å; Q513-S536 WeakPolarHBondContact CA-O 3.44Å; Q513-S536 VanDerWaalsContact CB-O 3.27Å; Q513-S536 WeakPolarHBondContact CB-O 3.36Å; Q513-S536 WeakPolarHBondContact CB-OG 3.33Å
514	G	98.1	Very high	94.3	Very high	27 Å²	27	38.8 Å²	38.8	28%	0.278	20%	0.204	S	C	.	.	S	Bend	trans	66.6	33	176.4	0	0	0	0	0	113.8	N490 S536	N490-G514 WeakPolarHBondContact CA-O 3.33Å; G514-S536 PolarHBondContact N-O 3.03Å
515	N	98.3	Very high	93.9	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.011	22%	0.219	C	C	.	.	S	Bend	trans	-110.9	-173	174.2	-80	-75.7	0	0	0	110.5	L488 N491 I493 L512 Q513 I517 N538	L488-N515 PolarHBondContact O-ND2 3.32Å; N491-N515 VanDerWaalsContact CA-OD1 3.26Å; N491-N515 WeakPolarHBondContact CA-OD1 3.43Å; N491-N515 WeakPolarHBondContact CB-OD1 3.48Å; N491-N515 PolarHBondContact N-OD1 3.47Å; N491-N515 PolarHBondContact O-OD1 3.43Å; I493-N515 HydrophobicContact CB-CB 4.11Å; I493-N515 VanDerWaalsContact CB-OD1 3.24Å; I493-N515 WeakPolarHBondContact CB-OD1 3.28Å; I493-N515 VanDerWaalsContact CG1-OD1 3.27Å; I493-N515 WeakPolarHBondContact CG1-OD1 2.92Å; I493-N515 PolarHBondContact N-OD1 3.23Å; L512-N515 PolarHBondContact O-ND2 2.86Å; Q513-N515 VanDerWaalsContact C-N 3.34Å; Q513-N515 PolarHBondContact O-N 3.48Å; Q513-N515 PolarHBondContact O-ND2 3.08Å; N515-I517 HydrophobicContact CB-CD1 4.08Å; N515-I517 HydrophobicContact CB-CG1 4.05Å; N515-N538 VanDerWaalsContact CA-OD1 3.31Å; N515-N538 WeakPolarHBondContact CA-OD1 3.45Å; N515-N538 WeakPolarHBondContact CB-OD1 3.31Å; N515-N538 PolarHBondContact N-OD1 3.49Å; N515-N538 PolarHBondContact O-OD1 2.93Å
516	N	97.5	Very high	93.7	Very high	57 Å²	57	41.5 Å²	41.5	31%	0.305	22%	0.22	S	C	.	.			trans	-107.3	31.9	-179.6	-64.3	-16	0	0	0	112	I493 G518 N538 W539	I493-N516 CarbonylContact O-C 3.48Å; I493-N516 WeakPolarHBondContact O-CA 3.48Å; I493-N516 PolarHBondContact O-N 2.96Å; N516-G518 PolarHBondContact O-N 3.02Å; N516-N538 PolarHBondContact N-OD1 3.08Å; N516-W539 HydrophobicContact CB-CE3 4.35Å; N516-W539 HydrophobicContact CB-CH2 4.18Å; N516-W539 HydrophobicContact CB-CZ2 4.38Å; N516-W539 HydrophobicContact CB-CZ3 4.16Å
517	I	96.8	Very high	93.6	Very high	3 Å²	3	40.1 Å²	40.1	2%	0.015	21%	0.212	C	C	.	.			trans	-74.7	123	-173.4	-58.6	163.4	0	0	0	110	I493 L496 L512 N515 D519 L520 N538 W539 I540	I493-I517 HydrophobicContact CG2-CG1 4.43Å; I493-I517 PolarHBondContact O-N 2.83Å; L496-I517 HydrophobicContact CD1-CD1 3.83Å; L496-I517 HydrophobicContact CD1-CG1 4.15Å; L496-I517 HydrophobicContact CD1-CG2 4.24Å; L512-I517 HydrophobicContact CB-CD1 3.99Å; L512-I517 HydrophobicContact CD1-CD1 4.39Å; L512-I517 HydrophobicContact CD2-CD1 4.26Å; L512-I517 HydrophobicContact CG-CD1 4.46Å; N515-I517 HydrophobicContact CB-CD1 4.08Å; N515-I517 HydrophobicContact CB-CG1 4.05Å; I517-D519 VanDerWaalsContact CG2-O 3.28Å; I517-D519 WeakPolarHBondContact CG2-O 3.38Å; I517-L520 HydrophobicContact CG2-CD2 4.28Å; I517-N538 HydrophobicContact CB-CB 4.2Å; I517-N538 WeakPolarHBondContact CB-OD1 3.41Å; I517-N538 WeakPolarHBondContact CD1-OD1 3.32Å; I517-N538 VanDerWaalsContact CG1-OD1 3.29Å; I517-N538 WeakPolarHBondContact CG1-OD1 3.36Å; I517-N538 PolarHBondContact N-OD1 2.91Å; I517-W539 CarbonylContact O-C 3.43Å; I517-W539 WeakPolarHBondContact O-CA 3.48Å; I517-W539 PolarHBondContact O-N 3.06Å; I517-I540 PolarHBondContact O-N 3.02Å
518	G	94.2	Very high	93.2	Very high	41 Å²	41	45.8 Å²	45.8	42%	0.423	24%	0.242	S	C	.	.			trans	-90.8	-27	179.2	0	0	0	0	0	115.4	N516 I540	N516-G518 PolarHBondContact O-N 3.02Å; G518-I540 WeakPolarHBondContact O-CA 3.38Å
519	D	89.9	Confident	93.1	Very high	83 Å²	83	45.6 Å²	45.6	44%	0.444	24%	0.242	S	C	.	.			trans	-158.1	156.4	178.7	179.6	25.9	0	0	0	109.3	I517 Q521	I517-D519 VanDerWaalsContact CG2-O 3.28Å; I517-D519 WeakPolarHBondContact CG2-O 3.38Å; D519-Q521 HydrophobicContact CB-CG 4.32Å; D519-Q521 PolarHBondContact OD1-N 2.86Å; D519-Q521 WeakPolarHBondContact OD2-CG 3.17Å; D519-Q521 PolarHBondContact OD2-N 2.9Å
520	L	89	Confident	93	Very high	11 Å²	11	39.8 Å²	39.8	6%	0.058	22%	0.22	C	C	.	.			trans	-94.1	-5	178.1	-65.2	174.6	0	0	0	113.6	I517 G522 V523 L524 V535 I540 L543 L548	I517-L520 HydrophobicContact CG2-CD2 4.28Å; L520-G522 CarbonylContact O-C 3.56Å; L520-G522 PolarHBondContact O-N 2.86Å; L520-V523 WeakPolarHBondContact O-CG1 3.31Å; L520-V523 VanDerWaalsContact O-CG2 3.3Å; L520-V523 WeakPolarHBondContact O-CG2 3.41Å; L520-V523 PolarHBondContact O-N 2.88Å; L520-L524 HydrophobicContact CD1-CD1 4.03Å; L520-V535 HydrophobicContact CD1-CG1 4.34Å; L520-V535 HydrophobicContact CD2-CG1 4.11Å; L520-I540 HydrophobicContact CD1-CD1 4.3Å; L520-I540 HydrophobicContact CD2-CD1 4.41Å; L520-I540 HydrophobicContact CG-CD1 4.14Å; L520-L543 HydrophobicContact CD1-CD1 4.03Å; L520-L548 HydrophobicContact CD1-CD2 4.48Å
521	Q	78.4	Confident	92.9	Very high	127 Å²	127	42.9 Å²	42.9	59%	0.593	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	35.9	29.7	171.2	-66.6	-168.5	4	0	0	117.5	D519 V523	D519-Q521 HydrophobicContact CB-CG 4.32Å; D519-Q521 PolarHBondContact OD1-N 2.86Å; D519-Q521 WeakPolarHBondContact OD2-CG 3.17Å; D519-Q521 PolarHBondContact OD2-N 2.9Å; Q521-V523 VanDerWaalsContact C-N 3.26Å; Q521-V523 PolarHBondContact O-N 2.73Å
522	G	82.9	Confident	92.9	Very high	16 Å²	16	44.6 Å²	44.6	17%	0.165	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.5	11.7	-172.4	0	0	0	0	0	116.1	L520 L524 S525	L520-G522 CarbonylContact O-C 3.56Å; L520-G522 PolarHBondContact O-N 2.86Å; G522-L524 PolarHBondContact O-N 2.8Å; G522-S525 WeakPolarHBondContact O-CB 3.36Å; G522-S525 PolarHBondContact O-N 2.73Å; G522-S525 PolarHBondContact O-OG 3.42Å
523	V	91.3	Very high	92.9	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.024	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-19.8	179.2	-51.4	0	0	0	0	113.7	L496 F501 L520 Q521	L496-V523 HydrophobicContact CB-CG1 4.11Å; L496-V523 HydrophobicContact CD1-CG2 4.2Å; F501-V523 HydrophobicContact CD2-CB 4.41Å; F501-V523 HydrophobicContact CD2-CG2 4.27Å; F501-V523 HydrophobicContact CE2-CG2 4.09Å; L520-V523 WeakPolarHBondContact O-CG1 3.31Å; L520-V523 VanDerWaalsContact O-CG2 3.3Å; L520-V523 WeakPolarHBondContact O-CG2 3.41Å; L520-V523 PolarHBondContact O-N 2.88Å; Q521-V523 VanDerWaalsContact C-N 3.26Å; Q521-V523 PolarHBondContact O-N 2.73Å
524	L	92.9	Very high	92.9	Very high	4 Å²	4	43.3 Å²	43.3	2%	0.021	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-4.9	177.8	-53.5	-177.7	0	0	0	113.3	F501 L510 L520 G522 N526 L527 V533 L548 P549	F501-L524 HydrophobicContact CD2-CD2 4.39Å; F501-L524 HydrophobicContact CE2-CD2 4.42Å; L510-L524 HydrophobicContact CD2-CD2 3.54Å; L520-L524 HydrophobicContact CD1-CD1 4.03Å; G522-L524 PolarHBondContact O-N 2.8Å; L524-N526 VanDerWaalsContact C-N 3.34Å; L524-N526 PolarHBondContact O-N 2.94Å; L524-L527 HydrophobicContact CB-CD1 4.49Å; L524-L527 HydrophobicContact CD2-CD1 3.92Å; L524-L527 PolarHBondContact O-N 2.97Å; L524-V533 HydrophobicContact CD1-CG2 4.17Å; L524-L548 HydrophobicContact CD1-CD2 4.02Å; L524-P549 WeakPolarHBondContact O-CD 3.18Å; L524-P549 WeakPolarHBondContact O-CG 3.5Å
525	S	86.9	Confident	92.9	Very high	49 Å²	49	42 Å²	42	34%	0.343	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-32	-168	58.9	0	0	0	0	113.9	G522	G522-S525 WeakPolarHBondContact O-CB 3.36Å; G522-S525 PolarHBondContact O-N 2.73Å; G522-S525 PolarHBondContact O-OG 3.42Å
526	N	86.7	Confident	92.9	Very high	87 Å²	87	42.7 Å²	42.7	47%	0.465	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	5.8	-179.2	-64.8	-22.6	0	0	0	114	D502 L524 D528	D502-N526 PolarHBondContact OD1-ND2 3.06Å; L524-N526 VanDerWaalsContact C-N 3.34Å; L524-N526 PolarHBondContact O-N 2.94Å; N526-D528 PolarHBondContact O-N 3.3Å
527	L	93.9	Very high	92.9	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.021	23%	0.229	C	C	.	.			trans	-92.3	74.6	-177.9	-62.1	174	0	0	0	111.2	F501 L504 L507 L510 L524 R529 L530 P549 S551	F501-L527 HydrophobicContact CB-CD1 4.33Å; F501-L527 HydrophobicContact CB-CD2 4.08Å; L504-L527 HydrophobicContact CB-CD2 3.92Å; L507-L527 HydrophobicContact CB-CD2 4.46Å; L507-L527 HydrophobicContact CD2-CD1 4.19Å; L507-L527 HydrophobicContact CD2-CD2 4.15Å; L510-L527 HydrophobicContact CD2-CD1 4.17Å; L524-L527 HydrophobicContact CB-CD1 4.49Å; L524-L527 HydrophobicContact CD2-CD1 3.92Å; L524-L527 PolarHBondContact O-N 2.97Å; L527-R529 PolarHBondContact O-N 2.9Å; L527-R529 VanDerWaalsContact O-N 3.07Å; L527-L530 HydrophobicContact CB-CB 3.83Å; L527-L530 HydrophobicContact CB-CD2 4.28Å; L527-L530 HydrophobicContact CD1-CD1 4.48Å; L527-L530 HydrophobicContact CD1-CD2 3.93Å; L527-L530 WeakPolarHBondContact O-CB 3.38Å; L527-L530 PolarHBondContact O-N 2.71Å; L527-L530 VanDerWaalsContact O-N 3.13Å; L527-P549 WeakPolarHBondContact O-CB 3.48Å; L527-S551 PolarHBondContact O-OG 3.4Å
528	D	90.7	Very high	93	Very high	119 Å²	119	41.5 Å²	41.5	64%	0.636	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-21	-169.3	-64.1	-35.9	0	0	0	115.3	N526 S551	N526-D528 PolarHBondContact O-N 3.3Å; D528-S551 WeakPolarHBondContact O-CB 3.31Å; D528-S551 PolarHBondContact O-OG 3.11Å
529	R	95.6	Very high	93.1	Very high	138 Å²	138	45.6 Å²	45.6	52%	0.521	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.6	7.1	-179.5	-64.1	-172.3	-179.7	-175.7	-2.7	114.1	T505 N506 L507 L527 D531	T505-R529 WeakPolarHBondContact O-CD 3.3Å; N506-R529 PolarHBondContact OD1-NH1 3.45Å; L507-R529 CarbonylContact O-C 3.51Å; L527-R529 PolarHBondContact O-N 2.9Å; L527-R529 VanDerWaalsContact O-N 3.07Å; R529-D531 PolarHBondContact O-N 3.31Å
530	L	96.8	Very high	93.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.211	C	C	.	.			trans	-66.9	117.7	-176.8	-169.7	70.7	0	0	0	110.3	L507 L510 L527 V533 P549 S551 L552	L507-L530 HydrophobicContact CD2-CD1 4.17Å; L507-L530 HydrophobicContact CG-CD1 4.33Å; L507-L530 VanDerWaalsContact O-CA 3.29Å; L507-L530 WeakPolarHBondContact O-CA 3.34Å; L507-L530 PolarHBondContact O-N 2.82Å; L507-L530 VanDerWaalsContact O-N 3.12Å; L510-L530 HydrophobicContact CB-CD1 3.84Å; L527-L530 HydrophobicContact CB-CB 3.83Å; L527-L530 HydrophobicContact CB-CD2 4.28Å; L527-L530 HydrophobicContact CD1-CD1 4.48Å; L527-L530 HydrophobicContact CD1-CD2 3.93Å; L527-L530 WeakPolarHBondContact O-CB 3.38Å; L527-L530 PolarHBondContact O-N 2.71Å; L527-L530 VanDerWaalsContact O-N 3.13Å; L530-V533 HydrophobicContact CD2-CB 4.2Å; L530-P549 HydrophobicContact CB-CG 4.04Å; L530-P549 HydrophobicContact CD2-CG 3.9Å; L530-S551 PolarHBondContact N-OG 3.33Å; L530-S551 CarbonylContact O-C 3.56Å; L530-S551 WeakPolarHBondContact O-CB 3.37Å; L530-S551 PolarHBondContact O-OG 2.8Å; L530-L552 HydrophobicContact CD2-CD1 4.07Å; L530-L552 HydrophobicContact CG-CD1 4.01Å; L530-L552 WeakPolarHBondContact O-CA 3.3Å; L530-L552 PolarHBondContact O-N 2.92Å
531	D	96.7	Very high	93.7	Very high	65 Å²	65	44.1 Å²	44.1	35%	0.348	23%	0.229	S	C	.	.			trans	-103.1	-36.1	-177.2	179	62.1	0	0	0	111.5	R508 R529 S553 H554	R508-D531 PolarHBondContact O-N 3.24Å; R529-D531 PolarHBondContact O-N 3.31Å; D531-S553 VanDerWaalsContact CG-OG 3.25Å; D531-S553 PolarHBondContact O-N 2.74Å; D531-S553 PolarHBondContact O-OG 3.02Å; D531-S553 VanDerWaalsContact OD1-CB 3.3Å; D531-S553 WeakPolarHBondContact OD1-CB 3.36Å; D531-S553 PolarHBondContact OD1-OG 3.07Å; D531-H554 PolarHBondContact O-N 2.86Å
532	Y	98.2	Very high	94.5	Very high	60 Å²	60	41.3 Å²	41.3	24%	0.235	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	132.5	-176.6	177.1	-84.2	0	0	0	111	R508 R509 L510 H511 N534 H554	R508-Y532 PolarHBondContact O-N 3.24Å; R509-Y532 WeakPolarHBondContact CA-O 3.25Å; R509-Y532 HydrophobicContact CB-CD1 4.33Å; L510-Y532 PolarHBondContact N-O 3.03Å; H511-Y532 AromaticContact CE1-CE1 3.73Å; H511-Y532 AromaticContact ND1-CE1 3.77Å; Y532-N534 HydrophobicContact CE1-CB 3.84Å; Y532-N534 PolarHBondContact OH-ND2 3.09Å; Y532-H554 WeakPolarHBondContact CA-O 3.32Å; Y532-H554 HydrophobicContact CD2-CB 3.6Å; Y532-H554 HydrophobicContact CE2-CB 4.34Å; Y532-H554 HydrophobicContact CG-CB 4.38Å
533	V	97.7	Very high	95	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	133.8	169.6	73.9	0	0	0	0	111.1	L510 L524 L530 V535 L552 H554 L555 D556	L510-V533 HydrophobicContact CB-CG2 4.21Å; L510-V533 HydrophobicContact CD2-CG2 4.37Å; L510-V533 HydrophobicContact CG-CG2 4.39Å; L510-V533 WeakPolarHBondContact O-CA 3.09Å; L524-V533 HydrophobicContact CD1-CG2 4.17Å; L530-V533 HydrophobicContact CD2-CB 4.2Å; V533-V535 HydrophobicContact CG2-CG1 3.99Å; V533-L552 HydrophobicContact CB-CD1 4Å; V533-L552 HydrophobicContact CG1-CD1 3.73Å; V533-L552 HydrophobicContact CG1-CD2 3.8Å; V533-L552 HydrophobicContact CG1-CG 4.39Å; V533-H554 PolarHBondContact N-O 2.78Å; V533-L555 HydrophobicContact CG1-CD1 3.42Å; V533-L555 VanDerWaalsContact CG1-CD1 3.42Å; V533-L555 WeakPolarHBondContact O-CA 3.06Å; V533-D556 PolarHBondContact O-N 3.45Å
534	N	98.4	Very high	95.1	Very high	13 Å²	13	42.3 Å²	42.3	7%	0.07	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	115	171.4	-164.8	-27.4	0	0	0	110	L510 L512 Q513 Y532 S536 D556	L510-N534 PolarHBondContact O-N 3.45Å; L512-N534 CarbonylContact C-O 3.46Å; L512-N534 WeakPolarHBondContact CA-O 3.48Å; L512-N534 WeakPolarHBondContact CB-O 3.35Å; L512-N534 PolarHBondContact N-O 2.79Å; Q513-N534 WeakPolarHBondContact CB-OD1 3.29Å; Q513-N534 PolarHBondContact N-O 2.73Å; Y532-N534 HydrophobicContact CE1-CB 3.84Å; Y532-N534 PolarHBondContact OH-ND2 3.09Å; N534-S536 VanDerWaalsContact OD1-CB 3.25Å; N534-S536 WeakPolarHBondContact OD1-CB 3.09Å; N534-S536 PolarHBondContact OD1-N 3.31Å; N534-S536 PolarHBondContact OD1-OG 2.77Å; N534-D556 HydrophobicContact CB-CB 4.27Å; N534-D556 PolarHBondContact ND2-OD2 3.45Å; N534-D556 PolarHBondContact OD1-OD2 2.78Å
535	V	97.9	Very high	95	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.224	C	C	.	.			trans	-119.2	19.6	176.7	-61.3	0	0	0	0	111.1	L512 L520 V533 N538 I540 L555 D556 A557 N560	L512-V535 HydrophobicContact CB-CG1 4.32Å; L512-V535 HydrophobicContact CD1-CG1 4.39Å; L520-V535 HydrophobicContact CD1-CG1 4.34Å; L520-V535 HydrophobicContact CD2-CG1 4.11Å; V533-V535 HydrophobicContact CG2-CG1 3.99Å; V535-N538 PolarHBondContact O-ND2 2.88Å; V535-I540 HydrophobicContact CB-CD1 3.95Å; V535-I540 HydrophobicContact CG2-CD1 3.82Å; V535-L555 HydrophobicContact CG2-CD1 4.23Å; V535-D556 WeakPolarHBondContact CG2-O 3.33Å; V535-D556 PolarHBondContact N-O 3.36Å; V535-A557 HydrophobicContact CG2-CB 3.94Å; V535-N560 PolarHBondContact O-ND2 3.02Å
536	S	98.4	Very high	95.1	Very high	15 Å²	15	41.5 Å²	41.5	11%	0.105	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	156.6	-177.3	64	0	0	0	0	113.2	Q513 G514 N534 N538 D556 S558	Q513-S536 CarbonylContact C-O 3.42Å; Q513-S536 WeakPolarHBondContact CA-O 3.44Å; Q513-S536 VanDerWaalsContact CB-O 3.27Å; Q513-S536 WeakPolarHBondContact CB-O 3.36Å; Q513-S536 WeakPolarHBondContact CB-OG 3.33Å; G514-S536 PolarHBondContact N-O 3.03Å; N534-S536 VanDerWaalsContact OD1-CB 3.25Å; N534-S536 WeakPolarHBondContact OD1-CB 3.09Å; N534-S536 PolarHBondContact OD1-N 3.31Å; N534-S536 PolarHBondContact OD1-OG 2.77Å; S536-N538 VanDerWaalsContact C-N 3.29Å; S536-N538 PolarHBondContact O-N 3.15Å; S536-N538 PolarHBondContact O-ND2 3.37Å; S536-N538 VanDerWaalsContact O-ND2 3.17Å; S536-D556 WeakPolarHBondContact CB-OD1 3.25Å; S536-D556 PolarHBondContact N-O 3.25Å; S536-S558 CarbonylContact C-O 3.59Å; S536-S558 WeakPolarHBondContact CA-O 3.24Å; S536-S558 WeakPolarHBondContact CB-O 3.49Å; S536-S558 VanDerWaalsContact CB-OG 3.25Å; S536-S558 WeakPolarHBondContact CB-OG 3.12Å
537	G	97.9	Very high	95.1	Very high	31 Å²	31	41 Å²	41	32%	0.32	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	31.6	176.6	0	0	0	0	0	114.2	S558 R559	G537-S558 PolarHBondContact N-O 3.15Å; G537-R559 VanDerWaalsContact CA-O 3.22Å; G537-R559 WeakPolarHBondContact CA-O 3.48Å; G537-R559 PolarHBondContact N-O 3.09Å
538	N	98.2	Very high	95	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.021	21%	0.214	C	C	.	.	S	Bend	trans	-110.7	-169.5	174.7	-81.5	-82.6	0	0	0	110.6	L512 N515 N516 I517 V535 S536 I540 N560	L512-N538 PolarHBondContact O-ND2 3.16Å; N515-N538 VanDerWaalsContact CA-OD1 3.31Å; N515-N538 WeakPolarHBondContact CA-OD1 3.45Å; N515-N538 WeakPolarHBondContact CB-OD1 3.31Å; N515-N538 PolarHBondContact N-OD1 3.49Å; N515-N538 PolarHBondContact O-OD1 2.93Å; N516-N538 PolarHBondContact N-OD1 3.08Å; I517-N538 HydrophobicContact CB-CB 4.2Å; I517-N538 WeakPolarHBondContact CB-OD1 3.41Å; I517-N538 WeakPolarHBondContact CD1-OD1 3.32Å; I517-N538 VanDerWaalsContact CG1-OD1 3.29Å; I517-N538 WeakPolarHBondContact CG1-OD1 3.36Å; I517-N538 PolarHBondContact N-OD1 2.91Å; V535-N538 PolarHBondContact O-ND2 2.88Å; S536-N538 VanDerWaalsContact C-N 3.29Å; S536-N538 PolarHBondContact O-N 3.15Å; S536-N538 PolarHBondContact O-ND2 3.37Å; S536-N538 VanDerWaalsContact O-ND2 3.17Å; N538-I540 HydrophobicContact CB-CD1 4.47Å; N538-I540 HydrophobicContact CB-CG1 4.26Å; N538-N560 VanDerWaalsContact CA-OD1 3.29Å; N538-N560 WeakPolarHBondContact CA-OD1 2.95Å; N538-N560 WeakPolarHBondContact CB-OD1 3.42Å; N538-N560 PolarHBondContact N-OD1 3.49Å; N538-N560 PolarHBondContact O-OD1 3.04Å; N538-N560 VanDerWaalsContact O-OD1 3.11Å
539	W	96.5	Very high	95	Very high	128 Å²	128	36 Å²	36	49%	0.485	19%	0.185	S	C	.	.			trans	-107.7	24.7	-179.3	-61.6	-12.1	0	0	0	113.4	N516 I517 S541	N516-W539 HydrophobicContact CB-CE3 4.35Å; N516-W539 HydrophobicContact CB-CH2 4.18Å; N516-W539 HydrophobicContact CB-CZ2 4.38Å; N516-W539 HydrophobicContact CB-CZ3 4.16Å; I517-W539 CarbonylContact O-C 3.43Å; I517-W539 WeakPolarHBondContact O-CA 3.48Å; I517-W539 PolarHBondContact O-N 3.06Å; W539-S541 PolarHBondContact O-N 3.46Å; W539-S541 PolarHBondContact O-OG 2.98Å
540	I	96.7	Very high	94.7	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	18%	0.178	C	C	.	.			trans	-64.8	124.5	-177.2	-57.8	171.6	0	0	0	109.7	I517 G518 L520 V535 N538 S542 N560 R561 I562	I517-I540 PolarHBondContact O-N 3.02Å; G518-I540 WeakPolarHBondContact O-CA 3.38Å; L520-I540 HydrophobicContact CD1-CD1 4.3Å; L520-I540 HydrophobicContact CD2-CD1 4.41Å; L520-I540 HydrophobicContact CG-CD1 4.14Å; V535-I540 HydrophobicContact CB-CD1 3.95Å; V535-I540 HydrophobicContact CG2-CD1 3.82Å; N538-I540 HydrophobicContact CB-CD1 4.47Å; N538-I540 HydrophobicContact CB-CG1 4.26Å; I540-S542 VanDerWaalsContact CG2-O 3.25Å; I540-S542 WeakPolarHBondContact CG2-O 3.36Å; I540-N560 HydrophobicContact CB-CB 4.26Å; I540-N560 WeakPolarHBondContact CB-OD1 3.35Å; I540-N560 WeakPolarHBondContact CG1-OD1 3.34Å; I540-N560 PolarHBondContact N-OD1 3.28Å; I540-R561 CarbonylContact O-C 3.47Å; I540-R561 VanDerWaalsContact O-CA 3.3Å; I540-R561 WeakPolarHBondContact O-CA 3.34Å; I540-R561 PolarHBondContact O-N 3.41Å; I540-I562 HydrophobicContact CB-CG1 4.37Å; I540-I562 HydrophobicContact CG2-CD1 4.4Å; I540-I562 HydrophobicContact CG2-CG1 4.07Å; I540-I562 WeakPolarHBondContact O-CG1 3.43Å; I540-I562 PolarHBondContact O-N 3.46Å; I540-I562 VanDerWaalsContact O-N 3.1Å
541	S	95.8	Very high	94.6	Very high	61 Å²	61	33.5 Å²	33.5	43%	0.427	19%	0.189	S	C	.	.			trans	-101.4	-23.4	-174.3	-61.4	0	0	0	0	114.4	W539 R561 I562 S563	W539-S541 PolarHBondContact O-N 3.46Å; W539-S541 PolarHBondContact O-OG 2.98Å; S541-R561 WeakPolarHBondContact CA-O 3.22Å; S541-I562 WeakPolarHBondContact O-CA 3.2Å; S541-S563 PolarHBondContact O-N 3.18Å; S541-S563 PolarHBondContact O-OG 3.15Å
542	S	94.4	Very high	94.5	Very high	69 Å²	69	30.6 Å²	30.6	48%	0.483	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	152.3	174.8	59	0	0	0	0	109.5	I540	I540-S542 VanDerWaalsContact CG2-O 3.25Å; I540-S542 WeakPolarHBondContact CG2-O 3.36Å
543	L	93.9	Very high	94.4	Very high	12 Å²	12	28.4 Å²	28.4	6%	0.063	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	127.8	178.9	-174.5	70.5	0	0	0	111	L520 L545 L555 A557 I562 K564 V565 T566 F583	L520-L543 HydrophobicContact CD1-CD1 4.03Å; L543-L545 HydrophobicContact CD2-CD2 3.82Å; L543-L545 HydrophobicContact CG-CD2 4.27Å; L543-L555 HydrophobicContact CD2-CD2 3.86Å; L543-A557 HydrophobicContact CD2-CB 4.38Å; L543-I562 HydrophobicContact CB-CD1 4.24Å; L543-I562 HydrophobicContact CD2-CD1 4.46Å; L543-K564 PolarHBondContact N-O 3.48Å; L543-K564 VanDerWaalsContact N-O 3.11Å; L543-V565 WeakPolarHBondContact O-CA 3.43Å; L543-T566 PolarHBondContact O-N 2.67Å; L543-F583 HydrophobicContact CD2-CE1 3.77Å
544	N	92.1	Very high	94.4	Very high	28 Å²	28	30.7 Å²	30.7	15%	0.15	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	110.7	171.2	-168.7	-33	0	0	0	110.7	K546 I547 T566 F568 L569	N544-K546 PolarHBondContact O-N 3.13Å; N544-K546 VanDerWaalsContact O-N 3.17Å; N544-K546 WeakPolarHBondContact OD1-CB 3.3Å; N544-K546 PolarHBondContact OD1-N 3.02Å; N544-I547 HydrophobicContact CB-CD1 3.85Å; N544-I547 HydrophobicContact CB-CG1 4.02Å; N544-I547 PolarHBondContact O-N 2.69Å; N544-I547 VanDerWaalsContact O-N 3.16Å; N544-T566 CarbonylContact C-O 3.43Å; N544-T566 VanDerWaalsContact CA-O 3.3Å; N544-T566 WeakPolarHBondContact CA-O 3.41Å; N544-T566 WeakPolarHBondContact CB-OG1 3.41Å; N544-T566 VanDerWaalsContact CG-OG1 3.29Å; N544-T566 PolarHBondContact ND2-OG1 3.28Å; N544-T566 PolarHBondContact OD1-O 3.24Å; N544-F568 PolarHBondContact ND2-O 2.97Å; N544-L569 WeakPolarHBondContact ND2-CD2 3.36Å; N544-L569 WeakPolarHBondContact ND2-CG 3.31Å
545	L	91.6	Very high	94.3	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.016	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-22.6	-177.9	-55.4	-176.7	0	0	0	112.8	L543 I547 L548 L555 V565 T566 N567 L578 F583 A597	L543-L545 HydrophobicContact CD2-CD2 3.82Å; L543-L545 HydrophobicContact CG-CD2 4.27Å; L545-I547 VanDerWaalsContact C-N 3.32Å; L545-I547 PolarHBondContact O-N 3.05Å; L545-L548 HydrophobicContact CD2-CD1 4Å; L545-L548 WeakPolarHBondContact O-CB 3.49Å; L545-L548 PolarHBondContact O-N 3.31Å; L545-L555 HydrophobicContact CD2-CD2 4.09Å; L545-V565 HydrophobicContact CD1-CG1 3.98Å; L545-V565 HydrophobicContact CD2-CG1 4.13Å; L545-V565 HydrophobicContact CG-CG1 3.91Å; L545-T566 PolarHBondContact N-O 2.67Å; L545-N567 HydrophobicContact CB-CB 4.42Å; L545-N567 HydrophobicContact CD1-CB 4.31Å; L545-L578 HydrophobicContact CD2-CD2 4.49Å; L545-F583 HydrophobicContact CD2-CE1 4.39Å; L545-F583 HydrophobicContact CD2-CZ 3.92Å; L545-A597 HydrophobicContact CD1-CB 4.38Å
546	K	88.1	Confident	94.4	Very high	33 Å²	33	31.9 Å²	31.9	14%	0.143	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-18.9	-179.8	-151.5	67.6	149.8	-166.4	0	113.4	N544 L569 L572 K574 T576	N544-K546 PolarHBondContact O-N 3.13Å; N544-K546 VanDerWaalsContact O-N 3.17Å; N544-K546 WeakPolarHBondContact OD1-CB 3.3Å; N544-K546 PolarHBondContact OD1-N 3.02Å; K546-L569 HydrophobicContact CB-CB 4.33Å; K546-L569 HydrophobicContact CB-CD1 3.6Å; K546-L569 HydrophobicContact CB-CG 3.76Å; K546-L569 HydrophobicContact CG-CB 4.09Å; K546-L569 HydrophobicContact CG-CD1 3.85Å; K546-L569 HydrophobicContact CG-CG 4.05Å; K546-L572 VanDerWaalsContact CE-O 3.29Å; K546-L572 WeakPolarHBondContact CE-O 3.38Å; K546-K574 HydrophobicContact CD-CB 4.26Å; K546-K574 VanDerWaalsContact CD-O 3.32Å; K546-K574 WeakPolarHBondContact CD-O 3.35Å; K546-K574 WeakPolarHBondContact CE-O 3.21Å; K546-K574 HydrophobicContact CG-CB 4.49Å; K546-K574 PolarHBondContact NZ-O 3.42Å; K546-T576 HydrophobicContact CD-CG2 4.12Å
547	I	87.7	Confident	94.3	Very high	77 Å²	77	31.2 Å²	31.2	40%	0.395	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-25.9	175.2	-60.2	178.6	0	0	0	111	N544 L545 L569	N544-I547 HydrophobicContact CB-CD1 3.85Å; N544-I547 HydrophobicContact CB-CG1 4.02Å; N544-I547 PolarHBondContact O-N 2.69Å; N544-I547 VanDerWaalsContact O-N 3.16Å; L545-I547 VanDerWaalsContact C-N 3.32Å; L545-I547 PolarHBondContact O-N 3.05Å; I547-L569 HydrophobicContact CG1-CD1 3.88Å
548	L	91.4	Very high	94.4	Very high	12 Å²	12	30.2 Å²	30.2	6%	0.063	17%	0.167	C	C	.	.	S	Bend	trans	-64.1	153.3	179.4	-58.5	176	0	0	0	111.4	L520 L524 L545 L552 L555 K574	L520-L548 HydrophobicContact CD1-CD2 4.48Å; L524-L548 HydrophobicContact CD1-CD2 4.02Å; L545-L548 HydrophobicContact CD2-CD1 4Å; L545-L548 WeakPolarHBondContact O-CB 3.49Å; L545-L548 PolarHBondContact O-N 3.31Å; L548-L552 HydrophobicContact CB-CD2 4.09Å; L548-L552 HydrophobicContact CD1-CD2 3.82Å; L548-L552 HydrophobicContact CG-CD2 4.36Å; L548-L555 HydrophobicContact CD1-CD2 3.92Å; L548-K574 PolarHBondContact O-NZ 3.17Å
549	P	91.4	Very high	94.4	Very high	5 Å²	5	36.7 Å²	36.7	3%	0.032	19%	0.191	C	C	.	.			trans	-62.8	145.3	177.6	23.9	-30.3	0	0	0	110.9	L524 L527 L530 S551 L552	L524-P549 WeakPolarHBondContact O-CD 3.18Å; L524-P549 WeakPolarHBondContact O-CG 3.5Å; L527-P549 WeakPolarHBondContact O-CB 3.48Å; L530-P549 HydrophobicContact CB-CG 4.04Å; L530-P549 HydrophobicContact CD2-CG 3.9Å; P549-S551 PolarHBondContact O-N 2.87Å; P549-L552 HydrophobicContact CG-CB 4.29Å; P549-L552 WeakPolarHBondContact O-CB 3.21Å; P549-L552 PolarHBondContact O-N 2.8Å
550	S	89.8	Confident	94.4	Very high	53 Å²	53	31.1 Å²	31.1	37%	0.371	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-15.6	-175.6	43.3	0	0	0	0	113.6	L552 W577	S550-L552 VanDerWaalsContact C-N 3.33Å; S550-W577 VanDerWaalsContact O-CB 3.28Å; S550-W577 WeakPolarHBondContact O-CB 3.38Å; S550-W577 VanDerWaalsContact O-CD1 3.32Å
551	S	93	Very high	94.5	Very high	33 Å²	33	37.9 Å²	37.9	23%	0.231	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-14.4	174.6	39.2	0	0	0	0	114	L527 D528 L530 P549 S553	L527-S551 PolarHBondContact O-OG 3.4Å; D528-S551 WeakPolarHBondContact O-CB 3.31Å; D528-S551 PolarHBondContact O-OG 3.11Å; L530-S551 PolarHBondContact N-OG 3.33Å; L530-S551 CarbonylContact O-C 3.56Å; L530-S551 WeakPolarHBondContact O-CB 3.37Å; L530-S551 PolarHBondContact O-OG 2.8Å; P549-S551 PolarHBondContact O-N 2.87Å; S551-S553 PolarHBondContact O-N 2.8Å
552	L	95.5	Very high	94.5	Very high	5 Å²	5	35 Å²	35	3%	0.026	18%	0.176	C	C	.	.			trans	-66.9	120.8	-172.7	-168.4	72.4	0	0	0	111.2	L530 V533 L548 P549 S550 L555 W577 L578	L530-L552 HydrophobicContact CD2-CD1 4.07Å; L530-L552 HydrophobicContact CG-CD1 4.01Å; L530-L552 WeakPolarHBondContact O-CA 3.3Å; L530-L552 PolarHBondContact O-N 2.92Å; V533-L552 HydrophobicContact CB-CD1 4Å; V533-L552 HydrophobicContact CG1-CD1 3.73Å; V533-L552 HydrophobicContact CG1-CD2 3.8Å; V533-L552 HydrophobicContact CG1-CG 4.39Å; L548-L552 HydrophobicContact CB-CD2 4.09Å; L548-L552 HydrophobicContact CD1-CD2 3.82Å; L548-L552 HydrophobicContact CG-CD2 4.36Å; P549-L552 HydrophobicContact CG-CB 4.29Å; P549-L552 WeakPolarHBondContact O-CB 3.21Å; P549-L552 PolarHBondContact O-N 2.8Å; S550-L552 VanDerWaalsContact C-N 3.33Å; L552-L555 HydrophobicContact CD2-CB 4.32Å; L552-W577 CarbonylContact O-C 3.28Å; L552-W577 VanDerWaalsContact O-C 3.23Å; L552-L578 HydrophobicContact CD2-CD1 4.16Å; L552-L578 HydrophobicContact CG-CD1 4.15Å; L552-L578 WeakPolarHBondContact O-CA 3.2Å; L552-L578 PolarHBondContact O-N 2.84Å
553	S	95.8	Very high	94.6	Very high	13 Å²	13	34.9 Å²	34.9	9%	0.091	18%	0.175	C	C	.	.			trans	-109.3	-27.7	179.2	78.5	0	0	0	0	112.9	D531 S551 R579 Q580	D531-S553 VanDerWaalsContact CG-OG 3.25Å; D531-S553 PolarHBondContact O-N 2.74Å; D531-S553 PolarHBondContact O-OG 3.02Å; D531-S553 VanDerWaalsContact OD1-CB 3.3Å; D531-S553 WeakPolarHBondContact OD1-CB 3.36Å; D531-S553 PolarHBondContact OD1-OG 3.07Å; S551-S553 PolarHBondContact O-N 2.8Å; S553-R579 WeakPolarHBondContact O-CA 3.44Å; S553-R579 PolarHBondContact O-N 3.49Å; S553-Q580 PolarHBondContact O-N 2.77Å
554	H	97.8	Very high	94.6	Very high	49 Å²	49	40.2 Å²	40.2	23%	0.227	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	127.4	179.4	-60.7	78.5	0	0	0	111.5	D531 Y532 V533 Q580	D531-H554 PolarHBondContact O-N 2.86Å; Y532-H554 WeakPolarHBondContact CA-O 3.32Å; Y532-H554 HydrophobicContact CD2-CB 3.6Å; Y532-H554 HydrophobicContact CE2-CB 4.34Å; Y532-H554 HydrophobicContact CG-CB 4.38Å; V533-H554 PolarHBondContact N-O 2.78Å; H554-Q580 WeakPolarHBondContact CA-O 3.47Å; H554-Q580 PolarHBondContact CD2-OE1 2.04Å; H554-Q580 PolarHBondContact NE2-NE2 3.03Å
555	L	97.5	Very high	94.7	Very high	6 Å²	6	39 Å²	39	3%	0.031	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	122.2	176.5	171.1	65	0	0	0	110.1	V533 V535 L543 L545 L548 L552 A557 L578 Q580 A581 D582 F583	V533-L555 HydrophobicContact CG1-CD1 3.42Å; V533-L555 VanDerWaalsContact CG1-CD1 3.42Å; V533-L555 WeakPolarHBondContact O-CA 3.06Å; V535-L555 HydrophobicContact CG2-CD1 4.23Å; L543-L555 HydrophobicContact CD2-CD2 3.86Å; L545-L555 HydrophobicContact CD2-CD2 4.09Å; L548-L555 HydrophobicContact CD1-CD2 3.92Å; L552-L555 HydrophobicContact CD2-CB 4.32Å; L555-A557 HydrophobicContact CD1-CB 4.25Å; L555-A557 HydrophobicContact CD2-CB 4.46Å; L555-A557 HydrophobicContact CG-CB 4.22Å; L555-L578 HydrophobicContact CB-CD1 3.69Å; L555-L578 HydrophobicContact CB-CD2 4.33Å; L555-L578 HydrophobicContact CD2-CD2 4.3Å; L555-Q580 PolarHBondContact N-O 2.82Å; L555-A581 CarbonylContact O-C 3.4Å; L555-A581 VanDerWaalsContact O-CA 3.3Å; L555-A581 WeakPolarHBondContact O-CA 3.47Å; L555-D582 PolarHBondContact O-N 2.89Å; L555-F583 HydrophobicContact CD2-CE1 3.89Å; L555-F583 HydrophobicContact CD2-CZ 4.03Å
556	D	98.4	Very high	94.7	Very high	32 Å²	32	39.8 Å²	39.8	17%	0.171	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	109.2	163.9	-179.4	1.7	0	0	0	109.2	V533 N534 V535 S536 S558	V533-D556 PolarHBondContact O-N 3.45Å; N534-D556 HydrophobicContact CB-CB 4.27Å; N534-D556 PolarHBondContact ND2-OD2 3.45Å; N534-D556 PolarHBondContact OD1-OD2 2.78Å; V535-D556 WeakPolarHBondContact CG2-O 3.33Å; V535-D556 PolarHBondContact N-O 3.36Å; S536-D556 WeakPolarHBondContact CB-OD1 3.25Å; S536-D556 PolarHBondContact N-O 3.25Å; D556-S558 VanDerWaalsContact OD1-CB 3.26Å; D556-S558 WeakPolarHBondContact OD1-CB 3.45Å; D556-S558 PolarHBondContact OD1-N 3.14Å; D556-S558 PolarHBondContact OD1-OG 3.05Å
557	A	97.8	Very high	94.7	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.194	C	C	.	.			trans	-119.1	23.9	176.1	0	0	0	0	0	111.3	V535 L543 L555 N560 I562 D582 F583 N586	V535-A557 HydrophobicContact CG2-CB 3.94Å; L543-A557 HydrophobicContact CD2-CB 4.38Å; L555-A557 HydrophobicContact CD1-CB 4.25Å; L555-A557 HydrophobicContact CD2-CB 4.46Å; L555-A557 HydrophobicContact CG-CB 4.22Å; A557-N560 PolarHBondContact O-ND2 2.91Å; A557-I562 HydrophobicContact CB-CD1 3.96Å; A557-D582 CarbonylContact C-O 3.59Å; A557-D582 WeakPolarHBondContact CA-O 3.5Å; A557-D582 PolarHBondContact N-O 3Å; A557-F583 HydrophobicContact CB-CD1 4.02Å; A557-F583 HydrophobicContact CB-CE1 4.14Å; A557-N586 PolarHBondContact O-ND2 3.17Å
558	S	98.3	Very high	94.5	Very high	11 Å²	11	39.3 Å²	39.3	8%	0.077	19%	0.192	C	C	.	.			trans	-65.5	162	-179.8	65.6	0	0	0	0	112.4	S536 G537 D556 N560 D582 S584	S536-S558 CarbonylContact C-O 3.59Å; S536-S558 WeakPolarHBondContact CA-O 3.24Å; S536-S558 WeakPolarHBondContact CB-O 3.49Å; S536-S558 VanDerWaalsContact CB-OG 3.25Å; S536-S558 WeakPolarHBondContact CB-OG 3.12Å; G537-S558 PolarHBondContact N-O 3.15Å; D556-S558 VanDerWaalsContact OD1-CB 3.26Å; D556-S558 WeakPolarHBondContact OD1-CB 3.45Å; D556-S558 PolarHBondContact OD1-N 3.14Å; D556-S558 PolarHBondContact OD1-OG 3.05Å; S558-N560 VanDerWaalsContact C-N 3.26Å; S558-N560 PolarHBondContact O-N 3.29Å; S558-N560 PolarHBondContact O-ND2 2.95Å; S558-D582 PolarHBondContact N-O 2.95Å; S558-S584 CarbonylContact C-O 3.52Å; S558-S584 WeakPolarHBondContact CA-O 3.31Å; S558-S584 WeakPolarHBondContact CB-O 3.33Å; S558-S584 WeakPolarHBondContact CB-OG 3.27Å
559	R	98.3	Very high	93.9	Very high	140 Å²	140	41.3 Å²	41.3	53%	0.528	20%	0.203	S	C	.	.	S	Bend	trans	54.7	39.6	174.6	-59.2	178.7	177.9	-79	-7.1	113.7	G537 S584 F585	G537-R559 VanDerWaalsContact CA-O 3.22Å; G537-R559 WeakPolarHBondContact CA-O 3.48Å; G537-R559 PolarHBondContact N-O 3.09Å; R559-S584 PolarHBondContact N-O 2.73Å; R559-F585 VanDerWaalsContact CA-O 3.22Å; R559-F585 WeakPolarHBondContact CA-O 3.26Å; R559-F585 HydrophobicContact CB-CB 4.34Å; R559-F585 HydrophobicContact CG-CB 3.69Å; R559-F585 HydrophobicContact CG-CD2 4.26Å; R559-F585 HydrophobicContact CG-CG 4.08Å; R559-F585 PolarHBondContact N-O 3.09Å
560	N	98.1	Very high	93	Very high	10 Å²	10	49.7 Å²	49.7	5%	0.053	24%	0.241	C	C	.	.	S	Bend	trans	-108.8	-163.1	173.1	-86.2	-83.6	0	0	0	109.6	V535 N538 I540 A557 S558 I562 F585 N586	V535-N560 PolarHBondContact O-ND2 3.02Å; N538-N560 VanDerWaalsContact CA-OD1 3.29Å; N538-N560 WeakPolarHBondContact CA-OD1 2.95Å; N538-N560 WeakPolarHBondContact CB-OD1 3.42Å; N538-N560 PolarHBondContact N-OD1 3.49Å; N538-N560 PolarHBondContact O-OD1 3.04Å; N538-N560 VanDerWaalsContact O-OD1 3.11Å; I540-N560 HydrophobicContact CB-CB 4.26Å; I540-N560 WeakPolarHBondContact CB-OD1 3.35Å; I540-N560 WeakPolarHBondContact CG1-OD1 3.34Å; I540-N560 PolarHBondContact N-OD1 3.28Å; A557-N560 PolarHBondContact O-ND2 2.91Å; S558-N560 VanDerWaalsContact C-N 3.26Å; S558-N560 PolarHBondContact O-N 3.29Å; S558-N560 PolarHBondContact O-ND2 2.95Å; N560-I562 HydrophobicContact CB-CD1 4.11Å; N560-I562 HydrophobicContact CB-CG1 3.91Å; N560-F585 PolarHBondContact N-O 3.24Å; N560-N586 VanDerWaalsContact CA-OD1 3.26Å; N560-N586 WeakPolarHBondContact CA-OD1 3.35Å; N560-N586 WeakPolarHBondContact CB-OD1 3.33Å; N560-N586 PolarHBondContact N-OD1 3.11Å; N560-N586 PolarHBondContact O-OD1 2.99Å
561	R	97.1	Very high	92.2	Very high	144 Å²	144	51.3 Å²	51.3	54%	0.543	27%	0.267	S	S	.	.			trans	-112.7	26.2	174.8	-60.6	-176.1	-179.1	-173.4	2.4	111.5	I540 S541 S563 N586	I540-R561 CarbonylContact O-C 3.47Å; I540-R561 VanDerWaalsContact O-CA 3.3Å; I540-R561 WeakPolarHBondContact O-CA 3.34Å; I540-R561 PolarHBondContact O-N 3.41Å; S541-R561 WeakPolarHBondContact CA-O 3.22Å; R561-S563 PolarHBondContact O-N 2.84Å; R561-S563 VanDerWaalsContact O-N 3.07Å; R561-N586 PolarHBondContact N-OD1 2.8Å
562	I	97.3	Very high	91	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.279	C	S	.	.			trans	-65.3	114.6	-171.3	-60.4	169.8	0	0	0	108.6	I540 S541 L543 A557 N560 V565 N586 N587 I588	I540-I562 HydrophobicContact CB-CG1 4.37Å; I540-I562 HydrophobicContact CG2-CD1 4.4Å; I540-I562 HydrophobicContact CG2-CG1 4.07Å; I540-I562 WeakPolarHBondContact O-CG1 3.43Å; I540-I562 PolarHBondContact O-N 3.46Å; I540-I562 VanDerWaalsContact O-N 3.1Å; S541-I562 WeakPolarHBondContact O-CA 3.2Å; L543-I562 HydrophobicContact CB-CD1 4.24Å; L543-I562 HydrophobicContact CD2-CD1 4.46Å; A557-I562 HydrophobicContact CB-CD1 3.96Å; N560-I562 HydrophobicContact CB-CD1 4.11Å; N560-I562 HydrophobicContact CB-CG1 3.91Å; I562-V565 HydrophobicContact CG2-CG2 3.69Å; I562-N586 HydrophobicContact CB-CB 4.17Å; I562-N586 VanDerWaalsContact CB-OD1 3.25Å; I562-N586 WeakPolarHBondContact CB-OD1 3.42Å; I562-N586 WeakPolarHBondContact CG1-OD1 3.4Å; I562-N586 PolarHBondContact N-OD1 3.06Å; I562-N587 CarbonylContact O-C 3.33Å; I562-N587 VanDerWaalsContact O-C 3.25Å; I562-N587 WeakPolarHBondContact O-CA 3.42Å; I562-N587 PolarHBondContact O-N 2.66Å; I562-I588 HydrophobicContact CG2-CG1 4.4Å; I562-I588 WeakPolarHBondContact O-CG1 3.16Å; I562-I588 PolarHBondContact O-N 3.49Å
563	S	96	Very high	89.7	Confident	67 Å²	67	62 Å²	62	47%	0.469	32%	0.321	S	S	.	.			trans	-96.8	-21.5	175.1	57.8	0	0	0	0	112.5	S541 R561	S541-S563 PolarHBondContact O-N 3.18Å; S541-S563 PolarHBondContact O-OG 3.15Å; R561-S563 PolarHBondContact O-N 2.84Å; R561-S563 VanDerWaalsContact O-N 3.07Å
564	K	93.3	Very high	88.7	Confident	124 Å²	124	64.2 Å²	64.2	54%	0.539	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	126.3	-177.3	-170	179.7	-177.2	-178.9	0	111.5	L543 T566	L543-K564 PolarHBondContact N-O 3.48Å; L543-K564 VanDerWaalsContact N-O 3.11Å; K564-T566 HydrophobicContact CD-CG2 4.14Å; K564-T566 HydrophobicContact CG-CG2 4.06Å
565	V	94.2	Very high	87.7	Confident	3 Å²	3	68.3 Å²	68.3	2%	0.018	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	131.9	168.7	-176.5	0	0	0	0	108.6	L543 L545 I562 F583 I588 S595	L543-V565 WeakPolarHBondContact O-CA 3.43Å; L545-V565 HydrophobicContact CD1-CG1 3.98Å; L545-V565 HydrophobicContact CD2-CG1 4.13Å; L545-V565 HydrophobicContact CG-CG1 3.91Å; I562-V565 HydrophobicContact CG2-CG2 3.69Å; V565-F583 HydrophobicContact CG1-CZ 4.28Å; V565-F583 HydrophobicContact CG2-CD1 4.26Å; V565-F583 HydrophobicContact CG2-CE1 4.37Å; V565-I588 HydrophobicContact CG2-CD1 3.79Å; V565-I588 HydrophobicContact CG2-CG1 4.48Å; V565-S595 WeakPolarHBondContact CG1-O 3.3Å; V565-S595 WeakPolarHBondContact O-CA 3.41Å; V565-S595 PolarHBondContact O-OG 3.22Å
566	T	92.5	Very high	86.9	Confident	18 Å²	18	69 Å²	69	11%	0.11	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	143	177.2	57	0	0	0	0	111.9	L543 N544 L545 K564 F568 D594	L543-T566 PolarHBondContact O-N 2.67Å; N544-T566 CarbonylContact C-O 3.43Å; N544-T566 VanDerWaalsContact CA-O 3.3Å; N544-T566 WeakPolarHBondContact CA-O 3.41Å; N544-T566 WeakPolarHBondContact CB-OG1 3.41Å; N544-T566 VanDerWaalsContact CG-OG1 3.29Å; N544-T566 PolarHBondContact ND2-OG1 3.28Å; N544-T566 PolarHBondContact OD1-O 3.24Å; L545-T566 PolarHBondContact N-O 2.67Å; K564-T566 HydrophobicContact CD-CG2 4.14Å; K564-T566 HydrophobicContact CG-CG2 4.06Å; T566-F568 HydrophobicContact CG2-CE1 3.98Å; T566-F568 HydrophobicContact CG2-CZ 4.49Å; T566-D594 CarbonylContact C-O 3.47Å; T566-D594 VanDerWaalsContact CA-O 3.29Å; T566-D594 WeakPolarHBondContact CA-O 3.34Å
567	N	88.6	Confident	86.3	Confident	18 Å²	18	73.6 Å²	73.6	10%	0.096	37%	0.367	C	S	.	.			trans	-118.7	16.2	178.2	-172.4	37.5	0	0	0	112.9	L545 T576 D594 V596 A597	L545-N567 HydrophobicContact CB-CB 4.42Å; L545-N567 HydrophobicContact CD1-CB 4.31Å; N567-T576 PolarHBondContact OD1-OG1 2.91Å; N567-D594 WeakPolarHBondContact CB-O 3.37Å; N567-D594 PolarHBondContact N-O 3.5Å; N567-V596 WeakPolarHBondContact CB-O 3.39Å; N567-V596 PolarHBondContact ND2-O 3Å; N567-A597 WeakPolarHBondContact ND2-CA 3.42Å
568	F	82.3	Confident	86.1	Confident	83 Å²	83	73.9 Å²	73.9	36%	0.364	37%	0.369	S	S	.	.			trans	-120.2	148.2	175.1	70.5	-88.7	0	0	0	111.6	N544 T566 D594	N544-F568 PolarHBondContact ND2-O 2.97Å; T566-F568 HydrophobicContact CG2-CE1 3.98Å; T566-F568 HydrophobicContact CG2-CZ 4.49Å; F568-D594 HydrophobicContact CD1-CB 3.8Å; F568-D594 HydrophobicContact CE1-CB 3.97Å
569	L	78.7	Confident	85.9	Confident	54 Å²	54	76.3 Å²	76.3	28%	0.283	38%	0.376	S	S	.	.			trans	-140.2	124.4	167	-78.7	173.7	0	0	0	107.7	N544 K546 I547 G571 L572	N544-L569 WeakPolarHBondContact ND2-CD2 3.36Å; N544-L569 WeakPolarHBondContact ND2-CG 3.31Å; K546-L569 HydrophobicContact CB-CB 4.33Å; K546-L569 HydrophobicContact CB-CD1 3.6Å; K546-L569 HydrophobicContact CB-CG 3.76Å; K546-L569 HydrophobicContact CG-CB 4.09Å; K546-L569 HydrophobicContact CG-CD1 3.85Å; K546-L569 HydrophobicContact CG-CG 4.05Å; I547-L569 HydrophobicContact CG1-CD1 3.88Å; L569-G571 PolarHBondContact O-N 2.96Å; L569-L572 HydrophobicContact CB-CB 3.96Å; L569-L572 HydrophobicContact CB-CD1 4.38Å; L569-L572 HydrophobicContact CD1-CD1 4.25Å; L569-L572 PolarHBondContact O-N 3.03Å; L569-L572 VanDerWaalsContact O-N 3.14Å
570	H	73.6	Confident	85.8	Confident	180 Å²	180	73.4 Å²	73.4	83%	0.833	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	126.3	178.2	-75.6	-76.8	0	0	0	110.5
571	G	71	Confident	85.8	Confident	88 Å²	88	73.2 Å²	73.2	91%	0.907	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.7	0.9	179.5	0	0	0	0	0	116	L569	L569-G571 PolarHBondContact O-N 2.96Å
572	L	69.9	Low	85.8	Confident	94 Å²	94	68.5 Å²	68.5	49%	0.492	35%	0.354	S	S	.	.			trans	-123.6	99.8	-176	-96.9	144.5	0	0	0	112.5	K546 L569 K574	K546-L572 VanDerWaalsContact CE-O 3.29Å; K546-L572 WeakPolarHBondContact CE-O 3.38Å; L569-L572 HydrophobicContact CB-CB 3.96Å; L569-L572 HydrophobicContact CB-CD1 4.38Å; L569-L572 HydrophobicContact CD1-CD1 4.25Å; L569-L572 PolarHBondContact O-N 3.03Å; L569-L572 VanDerWaalsContact O-N 3.14Å; L572-K574 VanDerWaalsContact C-N 3.25Å; L572-K574 PolarHBondContact O-N 3.15Å; L572-K574 VanDerWaalsContact O-N 3.16Å
573	N	66.9	Low	85.9	Confident	169 Å²	169	68.5 Å²	68.5	90%	0.904	35%	0.354	S	S	*	.			trans	-86.8	52.4	172.3	-71.9	-6.1	0	0	0	111.9
574	K	75.5	Confident	86	Confident	58 Å²	58	65.6 Å²	65.6	25%	0.252	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-82.1	125.3	176.8	-172.9	-177.6	-176.4	-176.2	0	111	K546 L548 L572	K546-K574 HydrophobicContact CD-CB 4.26Å; K546-K574 VanDerWaalsContact CD-O 3.32Å; K546-K574 WeakPolarHBondContact CD-O 3.35Å; K546-K574 WeakPolarHBondContact CE-O 3.21Å; K546-K574 HydrophobicContact CG-CB 4.49Å; K546-K574 PolarHBondContact NZ-O 3.42Å; L548-K574 PolarHBondContact O-NZ 3.17Å; L572-K574 VanDerWaalsContact C-N 3.25Å; L572-K574 PolarHBondContact O-N 3.15Å; L572-K574 VanDerWaalsContact O-N 3.16Å
575	E	76.3	Confident	86.2	Confident	136 Å²	136	63.4 Å²	63.4	64%	0.636	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-71.7	137	173.2	-67.8	-174.4	169.6	0	0	111.4
576	T	81.3	Confident	86.4	Confident	19 Å²	19	63.5 Å²	63.5	12%	0.117	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-104	130.9	172.5	50	0	0	0	0	109	K546 N567 T599	K546-T576 HydrophobicContact CD-CG2 4.12Å; N567-T576 PolarHBondContact OD1-OG1 2.91Å; T576-T599 VanDerWaalsContact O-CG2 3.3Å; T576-T599 WeakPolarHBondContact O-CG2 3.36Å; T576-T599 PolarHBondContact O-OG1 3.31Å
577	W	85.2	Confident	86.7	Confident	129 Å²	129	66.7 Å²	66.7	49%	0.489	34%	0.341	S	S	.	.			trans	-106.6	22.7	-175.4	-70.6	61.1	0	0	0	113	S550 L552 R579 T599	S550-W577 VanDerWaalsContact O-CB 3.28Å; S550-W577 WeakPolarHBondContact O-CB 3.38Å; S550-W577 VanDerWaalsContact O-CD1 3.32Å; L552-W577 CarbonylContact O-C 3.28Å; L552-W577 VanDerWaalsContact O-C 3.23Å; W577-R579 PolarHBondContact O-N 2.85Å; W577-T599 WeakPolarHBondContact CA-OG1 3.01Å
578	L	93.2	Very high	87.1	Confident	6 Å²	6	66 Å²	66	3%	0.031	34%	0.337	C	S	.	.			trans	-65.9	117.1	-176.9	-163.7	66.4	0	0	0	110.5	L545 L552 L555 A581 A597 T599 L600	L545-L578 HydrophobicContact CD2-CD2 4.49Å; L552-L578 HydrophobicContact CD2-CD1 4.16Å; L552-L578 HydrophobicContact CG-CD1 4.15Å; L552-L578 WeakPolarHBondContact O-CA 3.2Å; L552-L578 PolarHBondContact O-N 2.84Å; L555-L578 HydrophobicContact CB-CD1 3.69Å; L555-L578 HydrophobicContact CB-CD2 4.33Å; L555-L578 HydrophobicContact CD2-CD2 4.3Å; L578-A581 HydrophobicContact CD2-CB 3.73Å; L578-A581 HydrophobicContact CG-CB 4.31Å; L578-A597 HydrophobicContact CB-CB 4.33Å; L578-T599 PolarHBondContact N-OG1 3.27Å; L578-T599 CarbonylContact O-C 3.22Å; L578-T599 PolarHBondContact O-OG1 2.96Å; L578-L600 HydrophobicContact CB-CD2 4.31Å; L578-L600 HydrophobicContact CD2-CD2 4.12Å; L578-L600 HydrophobicContact CG-CD2 3.95Å; L578-L600 VanDerWaalsContact O-CA 3.24Å; L578-L600 WeakPolarHBondContact O-CA 3.2Å; L578-L600 PolarHBondContact O-N 3.4Å; L578-L600 VanDerWaalsContact O-N 3.13Å
579	R	94.8	Very high	87.7	Confident	63 Å²	63	68 Å²	68	24%	0.238	35%	0.348	C	S	.	.			trans	-96.9	-35.6	178.7	-59.5	-54.5	-171.8	177.9	-2.2	111.9	S553 W577 T599 R601 L602	S553-R579 WeakPolarHBondContact O-CA 3.44Å; S553-R579 PolarHBondContact O-N 3.49Å; W577-R579 PolarHBondContact O-N 2.85Å; R579-T599 VanDerWaalsContact CD-O 3.23Å; R579-T599 WeakPolarHBondContact CD-O 3.1Å; R579-T599 PolarHBondContact NH1-O 3.26Å; R579-R601 WeakPolarHBondContact O-CA 3.49Å; R579-R601 WeakPolarHBondContact O-CB 3.38Å; R579-R601 PolarHBondContact O-N 3.15Å; R579-L602 PolarHBondContact O-N 3.36Å
580	Q	96.8	Very high	88.5	Confident	79 Å²	79	71.3 Å²	71.3	37%	0.369	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	131.7	-178.7	-53.3	-169.9	19.6	0	0	110.3	S553 H554 L555 L602	S553-Q580 PolarHBondContact O-N 2.77Å; H554-Q580 WeakPolarHBondContact CA-O 3.47Å; H554-Q580 PolarHBondContact CD2-OE1 2.04Å; H554-Q580 PolarHBondContact NE2-NE2 3.03Å; L555-Q580 PolarHBondContact N-O 2.82Å; Q580-L602 VanDerWaalsContact CA-O 3.31Å; Q580-L602 WeakPolarHBondContact CA-O 3.38Å; Q580-L602 HydrophobicContact CB-CB 4.48Å; Q580-L602 HydrophobicContact CG-CB 4.15Å; Q580-L602 HydrophobicContact CG-CD1 4.1Å; Q580-L602 HydrophobicContact CG-CG 4.34Å
581	A	97	Very high	89.6	Confident	6 Å²	6	62.8 Å²	62.8	5%	0.05	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	126.6	178.5	0	0	0	0	0	111.8	L555 L578 F583 L600 L602 V603 N604	L555-A581 CarbonylContact O-C 3.4Å; L555-A581 VanDerWaalsContact O-CA 3.3Å; L555-A581 WeakPolarHBondContact O-CA 3.47Å; L578-A581 HydrophobicContact CD2-CB 3.73Å; L578-A581 HydrophobicContact CG-CB 4.31Å; A581-F583 HydrophobicContact CB-CD2 4.22Å; A581-F583 HydrophobicContact CB-CE2 3.49Å; A581-F583 VanDerWaalsContact CB-CE2 3.49Å; A581-F583 HydrophobicContact CB-CZ 3.8Å; A581-L600 HydrophobicContact CB-CD2 3.82Å; A581-L602 PolarHBondContact N-O 3.5Å; A581-V603 HydrophobicContact CB-CG2 4.36Å; A581-V603 WeakPolarHBondContact O-CA 3.14Å; A581-N604 PolarHBondContact O-N 2.97Å
582	D	98.3	Very high	90.7	Very high	44 Å²	44	59.6 Å²	59.6	24%	0.235	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	115.7	172	-161.2	-36.6	0	0	0	110.6	L555 A557 S558 S584 N604	L555-D582 PolarHBondContact O-N 2.89Å; A557-D582 CarbonylContact C-O 3.59Å; A557-D582 WeakPolarHBondContact CA-O 3.5Å; A557-D582 PolarHBondContact N-O 3Å; S558-D582 PolarHBondContact N-O 2.95Å; D582-S584 WeakPolarHBondContact OD1-CB 3.38Å; D582-S584 PolarHBondContact OD1-N 3.47Å; D582-S584 PolarHBondContact OD1-OG 3.05Å; D582-N604 HydrophobicContact CB-CB 4.42Å; D582-N604 PolarHBondContact OD1-ND2 3.34Å; D582-N604 PolarHBondContact OD2-ND2 3.37Å
583	F	98.3	Very high	91.6	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.281	C	S	.	.			trans	-116.1	18.2	175.2	-58.9	-64.1	0	0	0	111.7	L543 L545 L555 A557 V565 A581 N586 I588 V603 N604 F605 N608	L543-F583 HydrophobicContact CD2-CE1 3.77Å; L545-F583 HydrophobicContact CD2-CE1 4.39Å; L545-F583 HydrophobicContact CD2-CZ 3.92Å; L555-F583 HydrophobicContact CD2-CE1 3.89Å; L555-F583 HydrophobicContact CD2-CZ 4.03Å; A557-F583 HydrophobicContact CB-CD1 4.02Å; A557-F583 HydrophobicContact CB-CE1 4.14Å; V565-F583 HydrophobicContact CG1-CZ 4.28Å; V565-F583 HydrophobicContact CG2-CD1 4.26Å; V565-F583 HydrophobicContact CG2-CE1 4.37Å; A581-F583 HydrophobicContact CB-CD2 4.22Å; A581-F583 HydrophobicContact CB-CE2 3.49Å; A581-F583 VanDerWaalsContact CB-CE2 3.49Å; A581-F583 HydrophobicContact CB-CZ 3.8Å; F583-N586 WeakPolarHBondContact O-CB 3.43Å; F583-N586 PolarHBondContact O-ND2 3.3Å; F583-I588 HydrophobicContact CB-CD1 4.01Å; F583-V603 HydrophobicContact CD2-CG2 4.15Å; F583-V603 HydrophobicContact CE2-CG2 4.3Å; F583-N604 CarbonylContact C-O 3.6Å; F583-N604 WeakPolarHBondContact CA-O 3.45Å; F583-N604 PolarHBondContact N-O 2.85Å; F583-F605 HydrophobicContact CB-CD1 3.8Å; F583-F605 HydrophobicContact CB-CE1 3.91Å; F583-F605 AromaticContact CD2-CD1 3.97Å; F583-F605 HydrophobicContact CD2-CD1 3.97Å; F583-F605 AromaticContact CD2-CE1 3.33Å; F583-F605 HydrophobicContact CD2-CE1 3.33Å; F583-F605 AromaticContact CD2-CZ 3.68Å; F583-F605 HydrophobicContact CD2-CZ 3.68Å; F583-F605 HydrophobicContact CE2-CE1 4.13Å; F583-F605 HydrophobicContact CE2-CZ 4.12Å; F583-F605 HydrophobicContact CG-CD1 4.29Å; F583-F605 AromaticContact CG-CE1 3.89Å; F583-F605 HydrophobicContact CG-CE1 3.89Å; F583-N608 PolarHBondContact O-ND2 3.49Å
584	S	98.2	Very high	92.7	Very high	6 Å²	6	53.3 Å²	53.3	4%	0.042	26%	0.259	C	S	.	.			trans	-66.2	157.8	-177	64.7	0	0	0	0	113	S558 R559 D582 N586 N604 S606	S558-S584 CarbonylContact C-O 3.52Å; S558-S584 WeakPolarHBondContact CA-O 3.31Å; S558-S584 WeakPolarHBondContact CB-O 3.33Å; S558-S584 WeakPolarHBondContact CB-OG 3.27Å; R559-S584 PolarHBondContact N-O 2.73Å; D582-S584 WeakPolarHBondContact OD1-CB 3.38Å; D582-S584 PolarHBondContact OD1-N 3.47Å; D582-S584 PolarHBondContact OD1-OG 3.05Å; S584-N586 PolarHBondContact O-N 2.82Å; S584-N586 PolarHBondContact O-ND2 2.74Å; S584-N586 VanDerWaalsContact O-ND2 3.14Å; S584-N604 PolarHBondContact N-O 3.34Å; S584-S606 WeakPolarHBondContact CA-O 3.22Å; S584-S606 WeakPolarHBondContact CB-O 3.47Å; S584-S606 WeakPolarHBondContact CB-OG 3.31Å
585	F	98.4	Very high	93.4	Very high	79 Å²	79	51 Å²	51	35%	0.346	25%	0.251	S	S	.	.	S	Bend	trans	55.1	48.7	-178.7	-62.3	-88	0	0	0	112.8	R559 N560 S606 H607	R559-F585 VanDerWaalsContact CA-O 3.22Å; R559-F585 WeakPolarHBondContact CA-O 3.26Å; R559-F585 HydrophobicContact CB-CB 4.34Å; R559-F585 HydrophobicContact CG-CB 3.69Å; R559-F585 HydrophobicContact CG-CD2 4.26Å; R559-F585 HydrophobicContact CG-CG 4.08Å; R559-F585 PolarHBondContact N-O 3.09Å; N560-F585 PolarHBondContact N-O 3.24Å; F585-S606 PolarHBondContact N-O 3.05Å; F585-H607 WeakPolarHBondContact CA-O 3.5Å; F585-H607 HydrophobicContact CD1-CB 3.72Å; F585-H607 AromaticContact CD1-CG 3.98Å; F585-H607 HydrophobicContact CD2-CB 4.1Å; F585-H607 HydrophobicContact CE1-CB 3.84Å; F585-H607 AromaticContact CE1-CD2 3.87Å; F585-H607 AromaticContact CE1-CG 3.54Å; F585-H607 AromaticContact CE1-ND1 3.68Å; F585-H607 HydrophobicContact CE2-CB 4.2Å; F585-H607 AromaticContact CE2-CD2 3.57Å; F585-H607 AromaticContact CE2-CG 3.95Å; F585-H607 HydrophobicContact CG-CB 3.86Å; F585-H607 HydrophobicContact CZ-CB 4.07Å; F585-H607 AromaticContact CZ-CD2 3.32Å; F585-H607 WeakPolarHBondContact CZ-CD2 3.21Å; F585-H607 AromaticContact CZ-CE1 3.92Å; F585-H607 AromaticContact CZ-CG 3.51Å; F585-H607 AromaticContact CZ-ND1 3.88Å; F585-H607 AromaticContact CZ-NE2 3.58Å; F585-H607 PolarHBondContact N-O 3.07Å
586	N	98.4	Very high	94.2	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.021	22%	0.222	C	C	.	.	S	Bend	trans	-124.5	-170.2	175.5	-84	-75	0	0	0	110.3	A557 N560 R561 I562 F583 S584 I588 H607 N608	A557-N586 PolarHBondContact O-ND2 3.17Å; N560-N586 VanDerWaalsContact CA-OD1 3.26Å; N560-N586 WeakPolarHBondContact CA-OD1 3.35Å; N560-N586 WeakPolarHBondContact CB-OD1 3.33Å; N560-N586 PolarHBondContact N-OD1 3.11Å; N560-N586 PolarHBondContact O-OD1 2.99Å; R561-N586 PolarHBondContact N-OD1 2.8Å; I562-N586 HydrophobicContact CB-CB 4.17Å; I562-N586 VanDerWaalsContact CB-OD1 3.25Å; I562-N586 WeakPolarHBondContact CB-OD1 3.42Å; I562-N586 WeakPolarHBondContact CG1-OD1 3.4Å; I562-N586 PolarHBondContact N-OD1 3.06Å; F583-N586 WeakPolarHBondContact O-CB 3.43Å; F583-N586 PolarHBondContact O-ND2 3.3Å; S584-N586 PolarHBondContact O-N 2.82Å; S584-N586 PolarHBondContact O-ND2 2.74Å; S584-N586 VanDerWaalsContact O-ND2 3.14Å; N586-I588 HydrophobicContact CB-CG1 4.4Å; N586-H607 PolarHBondContact N-O 3.35Å; N586-N608 WeakPolarHBondContact CA-OD1 3.29Å; N586-N608 WeakPolarHBondContact CB-OD1 3.39Å; N586-N608 PolarHBondContact O-OD1 3.38Å
587	N	97.2	Very high	94.6	Very high	86 Å²	86	43.8 Å²	43.8	46%	0.46	22%	0.216	S	C	.	.			trans	-113.4	28.7	-176	-67.6	-0.1	0	0	0	112.4	I562 Q589 N608	I562-N587 CarbonylContact O-C 3.33Å; I562-N587 VanDerWaalsContact O-C 3.25Å; I562-N587 WeakPolarHBondContact O-CA 3.42Å; I562-N587 PolarHBondContact O-N 2.66Å; N587-Q589 PolarHBondContact O-N 2.88Å; N587-N608 PolarHBondContact N-OD1 3.47Å
588	I	97.5	Very high	94.8	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	21%	0.213	C	C	.	.			trans	-69.7	131	-178.2	-57.4	170.3	0	0	0	109.2	I562 V565 F583 N586 L591 F605 N608 S609 I610	I562-I588 HydrophobicContact CG2-CG1 4.4Å; I562-I588 WeakPolarHBondContact O-CG1 3.16Å; I562-I588 PolarHBondContact O-N 3.49Å; V565-I588 HydrophobicContact CG2-CD1 3.79Å; V565-I588 HydrophobicContact CG2-CG1 4.48Å; F583-I588 HydrophobicContact CB-CD1 4.01Å; N586-I588 HydrophobicContact CB-CG1 4.4Å; I588-L591 HydrophobicContact CG2-CD2 3.91Å; I588-F605 HydrophobicContact CD1-CD1 3.89Å; I588-F605 HydrophobicContact CD1-CE1 3.94Å; I588-N608 HydrophobicContact CB-CB 4.3Å; I588-N608 VanDerWaalsContact CB-OD1 3.32Å; I588-N608 WeakPolarHBondContact CB-OD1 3.14Å; I588-N608 WeakPolarHBondContact CG1-OD1 3.04Å; I588-N608 PolarHBondContact N-OD1 2.87Å; I588-S609 CarbonylContact O-C 3.53Å; I588-S609 VanDerWaalsContact O-CA 3.31Å; I588-S609 WeakPolarHBondContact O-CA 3.37Å; I588-S609 PolarHBondContact O-N 2.98Å; I588-I610 HydrophobicContact CB-CG1 4.3Å; I588-I610 HydrophobicContact CG2-CD1 4.4Å; I588-I610 HydrophobicContact CG2-CG1 4.06Å; I588-I610 WeakPolarHBondContact O-CG1 3.35Å; I588-I610 PolarHBondContact O-N 3.05Å; I588-I610 VanDerWaalsContact O-N 3.11Å
589	Q	95.9	Very high	94.7	Very high	126 Å²	126	42.6 Å²	42.6	59%	0.589	22%	0.22	S	C	*	.			trans	-105.6	-25.8	-175.6	-66.3	179.4	5.3	0	0	114.4	N587 S609 I610 E611	N587-Q589 PolarHBondContact O-N 2.88Å; Q589-S609 WeakPolarHBondContact CA-O 3.37Å; Q589-I610 CarbonylContact O-C 3.52Å; Q589-I610 WeakPolarHBondContact O-CA 3.38Å; Q589-E611 PolarHBondContact O-N 2.72Å
590	Q	95.1	Very high	94.5	Very high	123 Å²	123	39.6 Å²	39.6	58%	0.575	21%	0.209	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-149.8	150.9	-178.5	61	-178.4	-8.7	0	0	110.2	R612	Q590-R612 WeakPolarHBondContact CA-O 3.16Å
591	L	95.7	Very high	94.3	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.01	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	138.6	174	-63.8	-178.8	0	0	0	110.6	I588 F605 I610 R612 V613 Q614 S617 F618 L629	I588-L591 HydrophobicContact CG2-CD2 3.91Å; L591-F605 HydrophobicContact CD1-CD2 3.85Å; L591-F605 HydrophobicContact CD1-CE2 4.1Å; L591-F605 HydrophobicContact CD1-CG 4.07Å; L591-F605 HydrophobicContact CD2-CD1 3.99Å; L591-F605 HydrophobicContact CD2-CE1 3.75Å; L591-F605 HydrophobicContact CD2-CE2 4.27Å; L591-F605 HydrophobicContact CD2-CG 4.37Å; L591-F605 HydrophobicContact CD2-CZ 3.9Å; L591-I610 HydrophobicContact CD1-CD1 3.81Å; L591-I610 HydrophobicContact CD2-CD1 4.19Å; L591-I610 HydrophobicContact CG-CD1 3.87Å; L591-I610 HydrophobicContact CG-CG1 4.43Å; L591-I610 HydrophobicContact CG-CG2 4.3Å; L591-R612 PolarHBondContact N-O 2.94Å; L591-V613 HydrophobicContact CB-CG1 4.19Å; L591-V613 HydrophobicContact CB-CG2 4.42Å; L591-V613 HydrophobicContact CD1-CG2 4.26Å; L591-Q614 WeakPolarHBondContact O-CG 3.27Å; L591-Q614 PolarHBondContact O-N 2.94Å; L591-S617 PolarHBondContact O-OG 3.05Å; L591-F618 HydrophobicContact CD1-CZ 4.37Å; L591-L629 HydrophobicContact CD1-CD2 3.74Å
592	S	93.9	Very high	94.2	Very high	20 Å²	20	43.9 Å²	43.9	14%	0.14	23%	0.225	C	C	.	.			trans	-135	174.9	171	68.7	0	0	0	0	110.4	D594 S595 S617	S592-D594 PolarHBondContact O-N 3.37Å; S592-D594 VanDerWaalsContact O-N 3.15Å; S592-D594 PolarHBondContact OG-N 2.83Å; S592-S595 WeakPolarHBondContact O-CB 3.46Å; S592-S595 PolarHBondContact O-N 2.96Å; S592-S617 WeakPolarHBondContact CA-OG 3.17Å
593	A	90.6	Very high	94.1	Very high	46 Å²	46	42 Å²	42	38%	0.38	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-57.3	-26.7	172.9	0	0	0	0	0	112.8	S595 S617	A593-S595 VanDerWaalsContact C-N 3.25Å; A593-S595 PolarHBondContact O-N 3.03Å; A593-S617 WeakPolarHBondContact CA-O 3.43Å
594	D	89.7	Confident	94	Very high	85 Å²	85	43.6 Å²	43.6	46%	0.455	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-74.7	-12.2	176.6	-66.7	-35.8	0	0	0	113.4	T566 N567 F568 S592	T566-D594 CarbonylContact C-O 3.47Å; T566-D594 VanDerWaalsContact CA-O 3.29Å; T566-D594 WeakPolarHBondContact CA-O 3.34Å; N567-D594 WeakPolarHBondContact CB-O 3.37Å; N567-D594 PolarHBondContact N-O 3.5Å; F568-D594 HydrophobicContact CD1-CB 3.8Å; F568-D594 HydrophobicContact CE1-CB 3.97Å; S592-D594 PolarHBondContact O-N 3.37Å; S592-D594 VanDerWaalsContact O-N 3.15Å; S592-D594 PolarHBondContact OG-N 2.83Å
595	S	90.3	Very high	94	Very high	11 Å²	11	43.3 Å²	43.3	8%	0.077	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-91.2	-8.1	-178.1	-59.6	0	0	0	0	113.8	V565 S592 A593	V565-S595 WeakPolarHBondContact CG1-O 3.3Å; V565-S595 WeakPolarHBondContact O-CA 3.41Å; V565-S595 PolarHBondContact O-OG 3.22Å; S592-S595 WeakPolarHBondContact O-CB 3.46Å; S592-S595 PolarHBondContact O-N 2.96Å; A593-S595 VanDerWaalsContact C-N 3.25Å; A593-S595 PolarHBondContact O-N 3.03Å
596	V	91.8	Very high	93.9	Very high	3 Å²	3	40 Å²	40	2%	0.018	21%	0.208	C	C	.	.	S	Bend	trans	-126.3	153.1	-173.4	-66	0	0	0	0	111.5	N567 L600 F605 S617 F618	N567-V596 WeakPolarHBondContact CB-O 3.39Å; N567-V596 PolarHBondContact ND2-O 3Å; V596-L600 HydrophobicContact CB-CD1 4.1Å; V596-F605 HydrophobicContact CG1-CE2 3.98Å; V596-F605 HydrophobicContact CG1-CZ 4.02Å; V596-S617 WeakPolarHBondContact CG2-O 3.29Å; V596-F618 HydrophobicContact CG1-CD1 4.18Å; V596-F618 HydrophobicContact CG1-CE1 3.75Å
597	A	90.6	Very high	93.9	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.221	C	C	.	.			trans	-93.3	137	173.3	0	0	0	0	0	111.4	L545 N567 L578 T599 L600 C621	L545-A597 HydrophobicContact CD1-CB 4.38Å; N567-A597 WeakPolarHBondContact ND2-CA 3.42Å; L578-A597 HydrophobicContact CB-CB 4.33Å; A597-T599 PolarHBondContact O-N 2.81Å; A597-T599 VanDerWaalsContact O-N 3.1Å; A597-L600 HydrophobicContact CB-CD1 4.2Å; A597-L600 HydrophobicContact CB-CG 4.09Å; A597-L600 WeakPolarHBondContact O-CB 3.48Å; A597-L600 WeakPolarHBondContact O-CG 3.25Å; A597-L600 PolarHBondContact O-N 3.05Å; A597-C621 PolarHBondContact O-SG 3.49Å; A597-C621 VanDerWaalsContact O-SG 3.41Å
598	D	89.3	Confident	94	Very high	78 Å²	78	39.1 Å²	39.1	42%	0.417	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-22.4	-175.5	-62.1	-21.5	0	0	0	113.4	N620 C621	D598-N620 HydrophobicContact CB-CB 4.26Å; D598-N620 WeakPolarHBondContact OD1-CB 3.33Å; D598-C621 WeakPolarHBondContact O-CA 3.26Å
599	T	90.5	Very high	94	Very high	31 Å²	31	41.3 Å²	41.3	19%	0.19	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-1.9	-176.9	51.8	0	0	0	0	114.5	T576 W577 L578 R579 A597	T576-T599 VanDerWaalsContact O-CG2 3.3Å; T576-T599 WeakPolarHBondContact O-CG2 3.36Å; T576-T599 PolarHBondContact O-OG1 3.31Å; W577-T599 WeakPolarHBondContact CA-OG1 3.01Å; L578-T599 PolarHBondContact N-OG1 3.27Å; L578-T599 CarbonylContact O-C 3.22Å; L578-T599 PolarHBondContact O-OG1 2.96Å; R579-T599 VanDerWaalsContact CD-O 3.23Å; R579-T599 WeakPolarHBondContact CD-O 3.1Å; R579-T599 PolarHBondContact NH1-O 3.26Å; A597-T599 PolarHBondContact O-N 2.81Å; A597-T599 VanDerWaalsContact O-N 3.1Å
600	L	91.7	Very high	94	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	19%	0.189	C	C	.	.			trans	-60.5	137.5	-177.3	-77.7	168.3	0	0	0	112.4	L578 A581 V596 A597 V603 Q623 L624	L578-L600 HydrophobicContact CB-CD2 4.31Å; L578-L600 HydrophobicContact CD2-CD2 4.12Å; L578-L600 HydrophobicContact CG-CD2 3.95Å; L578-L600 VanDerWaalsContact O-CA 3.24Å; L578-L600 WeakPolarHBondContact O-CA 3.2Å; L578-L600 PolarHBondContact O-N 3.4Å; L578-L600 VanDerWaalsContact O-N 3.13Å; A581-L600 HydrophobicContact CB-CD2 3.82Å; V596-L600 HydrophobicContact CB-CD1 4.1Å; A597-L600 HydrophobicContact CB-CD1 4.2Å; A597-L600 HydrophobicContact CB-CG 4.09Å; A597-L600 WeakPolarHBondContact O-CB 3.48Å; A597-L600 WeakPolarHBondContact O-CG 3.25Å; A597-L600 PolarHBondContact O-N 3.05Å; L600-V603 HydrophobicContact CD1-CB 4.41Å; L600-V603 HydrophobicContact CD1-CG2 4.39Å; L600-Q623 CarbonylContact O-C 3.58Å; L600-L624 HydrophobicContact CB-CD1 4.35Å; L600-L624 PolarHBondContact O-N 2.91Å
601	R	92.4	Very high	94.1	Very high	110 Å²	110	34.4 Å²	34.4	42%	0.415	19%	0.185	S	C	.	.	S	Bend	trans	-108.6	-42.9	171.5	-66.8	-174.1	170.8	174.5	-3.1	111.4	R579 Q623 S625 S626	R579-R601 WeakPolarHBondContact O-CA 3.49Å; R579-R601 WeakPolarHBondContact O-CB 3.38Å; R579-R601 PolarHBondContact O-N 3.15Å; R601-Q623 WeakPolarHBondContact CA-O 3.03Å; R601-Q623 HydrophobicContact CG-CB 3.97Å; R601-Q623 WeakPolarHBondContact CG-O 3.27Å; R601-S625 WeakPolarHBondContact O-CA 3.31Å; R601-S625 PolarHBondContact O-N 3.13Å; R601-S626 PolarHBondContact O-N 2.89Å; R601-S626 VanDerWaalsContact O-N 3.1Å
602	L	94.1	Very high	94.1	Very high	64 Å²	64	42 Å²	42	34%	0.335	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	130.7	-179.9	-54.1	175.4	0	0	0	108.8	R579 Q580 A581	R579-L602 PolarHBondContact O-N 3.36Å; Q580-L602 VanDerWaalsContact CA-O 3.31Å; Q580-L602 WeakPolarHBondContact CA-O 3.38Å; Q580-L602 HydrophobicContact CB-CB 4.48Å; Q580-L602 HydrophobicContact CG-CB 4.15Å; Q580-L602 HydrophobicContact CG-CD1 4.1Å; Q580-L602 HydrophobicContact CG-CG 4.34Å; A581-L602 PolarHBondContact N-O 3.5Å
603	V	95.6	Very high	94.2	Very high	5 Å²	5	42 Å²	42	3%	0.03	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	131.1	175.3	68	0	0	0	0	111.6	A581 F583 L600 F605 F618 L624 S626 V627 D628	A581-V603 HydrophobicContact CB-CG2 4.36Å; A581-V603 WeakPolarHBondContact O-CA 3.14Å; F583-V603 HydrophobicContact CD2-CG2 4.15Å; F583-V603 HydrophobicContact CE2-CG2 4.3Å; L600-V603 HydrophobicContact CD1-CB 4.41Å; L600-V603 HydrophobicContact CD1-CG2 4.39Å; V603-F605 HydrophobicContact CB-CE2 4.3Å; V603-F605 HydrophobicContact CG1-CD2 4.22Å; V603-F605 HydrophobicContact CG1-CE2 4.06Å; V603-F605 HydrophobicContact CG2-CD2 3.69Å; V603-F605 HydrophobicContact CG2-CE2 3.25Å; V603-F605 HydrophobicContact CG2-CZ 3.78Å; V603-F618 HydrophobicContact CG1-CE1 4.08Å; V603-L624 HydrophobicContact CG1-CD1 4.21Å; V603-S626 PolarHBondContact N-O 3.05Å; V603-S626 VanDerWaalsContact N-O 3.08Å; V603-V627 HydrophobicContact CG1-CB 4.41Å; V603-V627 HydrophobicContact CG1-CG1 4.18Å; V603-V627 HydrophobicContact CG1-CG2 4.09Å; V603-V627 WeakPolarHBondContact O-CA 3.25Å; V603-D628 PolarHBondContact O-N 3.03Å
604	N	97.5	Very high	94.4	Very high	34 Å²	34	44.7 Å²	44.7	18%	0.182	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	112	178.9	-175.4	3.7	0	0	0	110.3	A581 D582 F583 S584 S606 D628	A581-N604 PolarHBondContact O-N 2.97Å; D582-N604 HydrophobicContact CB-CB 4.42Å; D582-N604 PolarHBondContact OD1-ND2 3.34Å; D582-N604 PolarHBondContact OD2-ND2 3.37Å; F583-N604 CarbonylContact C-O 3.6Å; F583-N604 WeakPolarHBondContact CA-O 3.45Å; F583-N604 PolarHBondContact N-O 2.85Å; S584-N604 PolarHBondContact N-O 3.34Å; N604-S606 VanDerWaalsContact OD1-CB 3.24Å; N604-S606 WeakPolarHBondContact OD1-CB 3.3Å; N604-S606 PolarHBondContact OD1-N 2.99Å; N604-S606 PolarHBondContact OD1-OG 3.01Å; N604-D628 HydrophobicContact CB-CB 4.46Å
605	F	97.8	Very high	94.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.218	C	C	.	.			trans	-113.2	17	174.3	-74	-69.2	0	0	0	111.8	F583 I588 L591 V596 V603 N608 I610 F618 D628 L629 N632	F583-F605 HydrophobicContact CB-CD1 3.8Å; F583-F605 HydrophobicContact CB-CE1 3.91Å; F583-F605 AromaticContact CD2-CD1 3.97Å; F583-F605 HydrophobicContact CD2-CD1 3.97Å; F583-F605 AromaticContact CD2-CE1 3.33Å; F583-F605 HydrophobicContact CD2-CE1 3.33Å; F583-F605 AromaticContact CD2-CZ 3.68Å; F583-F605 HydrophobicContact CD2-CZ 3.68Å; F583-F605 HydrophobicContact CE2-CE1 4.13Å; F583-F605 HydrophobicContact CE2-CZ 4.12Å; F583-F605 HydrophobicContact CG-CD1 4.29Å; F583-F605 AromaticContact CG-CE1 3.89Å; F583-F605 HydrophobicContact CG-CE1 3.89Å; I588-F605 HydrophobicContact CD1-CD1 3.89Å; I588-F605 HydrophobicContact CD1-CE1 3.94Å; L591-F605 HydrophobicContact CD1-CD2 3.85Å; L591-F605 HydrophobicContact CD1-CE2 4.1Å; L591-F605 HydrophobicContact CD1-CG 4.07Å; L591-F605 HydrophobicContact CD2-CD1 3.99Å; L591-F605 HydrophobicContact CD2-CE1 3.75Å; L591-F605 HydrophobicContact CD2-CE2 4.27Å; L591-F605 HydrophobicContact CD2-CG 4.37Å; L591-F605 HydrophobicContact CD2-CZ 3.9Å; V596-F605 HydrophobicContact CG1-CE2 3.98Å; V596-F605 HydrophobicContact CG1-CZ 4.02Å; V603-F605 HydrophobicContact CB-CE2 4.3Å; V603-F605 HydrophobicContact CG1-CD2 4.22Å; V603-F605 HydrophobicContact CG1-CE2 4.06Å; V603-F605 HydrophobicContact CG2-CD2 3.69Å; V603-F605 HydrophobicContact CG2-CE2 3.25Å; V603-F605 HydrophobicContact CG2-CZ 3.78Å; F605-N608 PolarHBondContact O-ND2 3.35Å; F605-N608 VanDerWaalsContact O-ND2 3.14Å; F605-I610 HydrophobicContact CB-CD1 3.86Å; F605-I610 HydrophobicContact CG-CD1 4.4Å; F605-F618 HydrophobicContact CE2-CE1 4.4Å; F605-F618 HydrophobicContact CE2-CZ 4.49Å; F605-D628 CarbonylContact C-O 3.54Å; F605-D628 WeakPolarHBondContact CA-O 3.37Å; F605-D628 WeakPolarHBondContact CB-O 3.47Å; F605-D628 PolarHBondContact N-O 3Å; F605-L629 HydrophobicContact CB-CD2 3.91Å; F605-N632 PolarHBondContact O-ND2 2.7Å
606	S	97.2	Very high	94.5	Very high	8 Å²	8	50.1 Å²	50.1	6%	0.056	24%	0.242	C	C	.	.			trans	-63.5	161.3	-178.6	65.4	0	0	0	0	112.7	S584 F585 N604 N608 D628 R630	S584-S606 WeakPolarHBondContact CA-O 3.22Å; S584-S606 WeakPolarHBondContact CB-O 3.47Å; S584-S606 WeakPolarHBondContact CB-OG 3.31Å; F585-S606 PolarHBondContact N-O 3.05Å; N604-S606 VanDerWaalsContact OD1-CB 3.24Å; N604-S606 WeakPolarHBondContact OD1-CB 3.3Å; N604-S606 PolarHBondContact OD1-N 2.99Å; N604-S606 PolarHBondContact OD1-OG 3.01Å; S606-N608 VanDerWaalsContact C-N 3.29Å; S606-N608 PolarHBondContact O-N 3.18Å; S606-N608 PolarHBondContact O-ND2 3.31Å; S606-D628 PolarHBondContact N-O 3Å; S606-R630 CarbonylContact C-O 3.15Å; S606-R630 WeakPolarHBondContact CA-O 3.17Å; S606-R630 WeakPolarHBondContact CB-O 3.49Å
607	H	98.1	Very high	94.5	Very high	65 Å²	65	50 Å²	50	30%	0.301	24%	0.241	S	C	.	.	S	Bend	trans	53.2	43.7	178.1	-66	-81.7	0	0	0	113.7	F585 N586 R630 Y631	F585-H607 WeakPolarHBondContact CA-O 3.5Å; F585-H607 HydrophobicContact CD1-CB 3.72Å; F585-H607 AromaticContact CD1-CG 3.98Å; F585-H607 HydrophobicContact CD2-CB 4.1Å; F585-H607 HydrophobicContact CE1-CB 3.84Å; F585-H607 AromaticContact CE1-CD2 3.87Å; F585-H607 AromaticContact CE1-CG 3.54Å; F585-H607 AromaticContact CE1-ND1 3.68Å; F585-H607 HydrophobicContact CE2-CB 4.2Å; F585-H607 AromaticContact CE2-CD2 3.57Å; F585-H607 AromaticContact CE2-CG 3.95Å; F585-H607 HydrophobicContact CG-CB 3.86Å; F585-H607 HydrophobicContact CZ-CB 4.07Å; F585-H607 AromaticContact CZ-CD2 3.32Å; F585-H607 WeakPolarHBondContact CZ-CD2 3.21Å; F585-H607 AromaticContact CZ-CE1 3.92Å; F585-H607 AromaticContact CZ-CG 3.51Å; F585-H607 AromaticContact CZ-ND1 3.88Å; F585-H607 AromaticContact CZ-NE2 3.58Å; F585-H607 PolarHBondContact N-O 3.07Å; N586-H607 PolarHBondContact N-O 3.35Å; H607-R630 PolarHBondContact N-O 3.19Å; H607-Y631 WeakPolarHBondContact CA-O 3.21Å; H607-Y631 AromaticContact CD2-CD2 3.92Å; H607-Y631 AromaticContact CE1-CD1 3.74Å; H607-Y631 AromaticContact CE1-CD2 3.41Å; H607-Y631 VanDerWaalsContact CE1-CD2 3.41Å; H607-Y631 WeakPolarHBondContact CE1-CD2 3.48Å; H607-Y631 AromaticContact CE1-CE2 3.89Å; H607-Y631 AromaticContact CE1-CG 3.33Å; H607-Y631 PolarHBondContact N-O 2.95Å; H607-Y631 AromaticContact ND1-CG 3.69Å; H607-Y631 AromaticContact NE2-CD2 3.3Å; H607-Y631 VanDerWaalsContact NE2-CD2 3.3Å; H607-Y631 WeakPolarHBondContact NE2-CD2 3.39Å; H607-Y631 AromaticContact NE2-CE2 3.71Å; H607-Y631 AromaticContact NE2-CG 3.73Å
608	N	98.3	Very high	94.5	Very high	8 Å²	8	50.1 Å²	50.1	4%	0.043	24%	0.242	C	C	.	.	S	Bend	trans	-113.4	-168.3	172.4	-86.3	-89	0	0	0	110.2	F583 N586 N587 I588 F605 S606 I610 N632	F583-N608 PolarHBondContact O-ND2 3.49Å; N586-N608 WeakPolarHBondContact CA-OD1 3.29Å; N586-N608 WeakPolarHBondContact CB-OD1 3.39Å; N586-N608 PolarHBondContact O-OD1 3.38Å; N587-N608 PolarHBondContact N-OD1 3.47Å; I588-N608 HydrophobicContact CB-CB 4.3Å; I588-N608 VanDerWaalsContact CB-OD1 3.32Å; I588-N608 WeakPolarHBondContact CB-OD1 3.14Å; I588-N608 WeakPolarHBondContact CG1-OD1 3.04Å; I588-N608 PolarHBondContact N-OD1 2.87Å; F605-N608 PolarHBondContact O-ND2 3.35Å; F605-N608 VanDerWaalsContact O-ND2 3.14Å; S606-N608 VanDerWaalsContact C-N 3.29Å; S606-N608 PolarHBondContact O-N 3.18Å; S606-N608 PolarHBondContact O-ND2 3.31Å; N608-I610 HydrophobicContact CB-CD1 4.09Å; N608-I610 HydrophobicContact CB-CG1 3.97Å; N608-N632 VanDerWaalsContact CA-OD1 3.29Å; N608-N632 WeakPolarHBondContact CA-OD1 3.26Å; N608-N632 WeakPolarHBondContact CB-OD1 3.4Å; N608-N632 PolarHBondContact N-OD1 2.96Å; N608-N632 PolarHBondContact O-OD1 2.96Å
609	S	97.1	Very high	94.6	Very high	48 Å²	48	49.1 Å²	49.1	34%	0.336	23%	0.234	S	C	.	.			trans	-110.4	31.3	175.7	-62.9	0	0	0	0	111.7	I588 Q589 E611	I588-S609 CarbonylContact O-C 3.53Å; I588-S609 VanDerWaalsContact O-CA 3.31Å; I588-S609 WeakPolarHBondContact O-CA 3.37Å; I588-S609 PolarHBondContact O-N 2.98Å; Q589-S609 WeakPolarHBondContact CA-O 3.37Å; S609-E611 PolarHBondContact O-N 2.89Å
610	I	97.5	Very high	94.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.244	C	C	.	.			trans	-69.8	116.3	-170.8	-59.5	164.7	0	0	0	109.9	I588 Q589 L591 F605 N608 V613 L629 N632 K633 L634	I588-I610 HydrophobicContact CB-CG1 4.3Å; I588-I610 HydrophobicContact CG2-CD1 4.4Å; I588-I610 HydrophobicContact CG2-CG1 4.06Å; I588-I610 WeakPolarHBondContact O-CG1 3.35Å; I588-I610 PolarHBondContact O-N 3.05Å; I588-I610 VanDerWaalsContact O-N 3.11Å; Q589-I610 CarbonylContact O-C 3.52Å; Q589-I610 WeakPolarHBondContact O-CA 3.38Å; L591-I610 HydrophobicContact CD1-CD1 3.81Å; L591-I610 HydrophobicContact CD2-CD1 4.19Å; L591-I610 HydrophobicContact CG-CD1 3.87Å; L591-I610 HydrophobicContact CG-CG1 4.43Å; L591-I610 HydrophobicContact CG-CG2 4.3Å; F605-I610 HydrophobicContact CB-CD1 3.86Å; F605-I610 HydrophobicContact CG-CD1 4.4Å; N608-I610 HydrophobicContact CB-CD1 4.09Å; N608-I610 HydrophobicContact CB-CG1 3.97Å; I610-V613 HydrophobicContact CG2-CG2 4.11Å; I610-L629 HydrophobicContact CD1-CD2 4.08Å; I610-N632 HydrophobicContact CB-CB 4.14Å; I610-N632 VanDerWaalsContact CB-OD1 3.27Å; I610-N632 WeakPolarHBondContact CB-OD1 3.38Å; I610-N632 VanDerWaalsContact CG1-OD1 3.29Å; I610-N632 WeakPolarHBondContact CG1-OD1 3.38Å; I610-N632 PolarHBondContact N-OD1 3.47Å; I610-K633 CarbonylContact O-C 3.32Å; I610-K633 VanDerWaalsContact O-CA 3.29Å; I610-K633 WeakPolarHBondContact O-CA 3.48Å; I610-K633 PolarHBondContact O-N 3.35Å; I610-L634 HydrophobicContact CG2-CD2 3.94Å; I610-L634 PolarHBondContact O-N 3.07Å; I610-L634 VanDerWaalsContact O-N 3.15Å
611	E	96.5	Very high	94.3	Very high	104 Å²	104	51.2 Å²	51.2	49%	0.486	24%	0.244	S	C	.	.			trans	-94.9	-29.9	175.8	-65.4	-175.6	-178	0	0	112.6	Q589 S609 K633	Q589-E611 PolarHBondContact O-N 2.72Å; S609-E611 PolarHBondContact O-N 2.89Å; E611-K633 HydrophobicContact CG-CB 4.07Å
612	R	95.1	Very high	94	Very high	162 Å²	162	48.5 Å²	48.5	61%	0.611	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-141.9	134.6	-174.3	-63.5	-178.2	-178.7	76.5	0.7	111.6	Q590 L591	Q590-R612 WeakPolarHBondContact CA-O 3.16Å; L591-R612 PolarHBondContact N-O 2.94Å
613	V	96.1	Very high	93.5	Very high	20 Å²	20	49.8 Å²	49.8	12%	0.121	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	118.6	166.5	-174.9	0	0	0	0	107.2	L591 I610 F618 L629 L634 A641	L591-V613 HydrophobicContact CB-CG1 4.19Å; L591-V613 HydrophobicContact CB-CG2 4.42Å; L591-V613 HydrophobicContact CD1-CG2 4.26Å; I610-V613 HydrophobicContact CG2-CG2 4.11Å; V613-F618 HydrophobicContact CG1-CE2 4.18Å; V613-L629 HydrophobicContact CG2-CD1 4.44Å; V613-L634 HydrophobicContact CG2-CD2 3.99Å; V613-A641 HydrophobicContact CB-CB 4.21Å; V613-A641 HydrophobicContact CG1-CB 3.94Å
614	Q	94.5	Very high	93.1	Very high	102 Å²	102	49.8 Å²	49.8	48%	0.477	24%	0.244	S	C	.	.			trans	-66.8	150.9	-178.4	-69.1	-177.8	-9.9	0	0	111.5	L591 R616 S617	L591-Q614 WeakPolarHBondContact O-CG 3.27Å; L591-Q614 PolarHBondContact O-N 2.94Å; Q614-R616 PolarHBondContact O-N 3.31Å; Q614-S617 PolarHBondContact N-OG 3.08Å; Q614-S617 WeakPolarHBondContact O-CB 3.45Å; Q614-S617 PolarHBondContact O-N 3.26Å; Q614-S617 PolarHBondContact O-OG 2.95Å
615	A	91.3	Very high	92.7	Very high	58 Å²	58	50.6 Å²	50.6	48%	0.479	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	139.8	171.6	0	0	0	0	0	110.4	S617 S640	A615-S617 PolarHBondContact O-N 2.79Å; A615-S640 WeakPolarHBondContact CB-OG 3.26Å
616	R	91.2	Very high	92.3	Very high	151 Å²	151	51.7 Å²	51.7	57%	0.57	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	22.2	179.4	-61.5	-177.6	-178.3	153.9	1.7	114.9	Q614 F618 F619 S640	Q614-R616 PolarHBondContact O-N 3.31Å; R616-F618 PolarHBondContact O-N 3.29Å; R616-F619 HydrophobicContact CB-CB 3.64Å; R616-F619 HydrophobicContact CB-CD2 4.46Å; R616-F619 HydrophobicContact CB-CG 4.18Å; R616-F619 HydrophobicContact CG-CB 4.21Å; R616-F619 HydrophobicContact CG-CD2 4.09Å; R616-F619 HydrophobicContact CG-CG 4.28Å; R616-F619 VanDerWaalsContact O-CB 3.24Å; R616-F619 WeakPolarHBondContact O-CB 3.43Å; R616-F619 PolarHBondContact O-N 2.75Å; R616-F619 VanDerWaalsContact O-N 3.1Å; R616-S640 PolarHBondContact N-O 3.5Å
617	S	92	Very high	92.1	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.014	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-37.9	176.7	-69.3	0	0	0	0	112.6	L591 S592 A593 V596 Q614 A615	L591-S617 PolarHBondContact O-OG 3.05Å; S592-S617 WeakPolarHBondContact CA-OG 3.17Å; A593-S617 WeakPolarHBondContact CA-O 3.43Å; V596-S617 WeakPolarHBondContact CG2-O 3.29Å; Q614-S617 PolarHBondContact N-OG 3.08Å; Q614-S617 WeakPolarHBondContact O-CB 3.45Å; Q614-S617 PolarHBondContact O-N 3.26Å; Q614-S617 PolarHBondContact O-OG 2.95Å; A615-S617 PolarHBondContact O-N 2.79Å
618	F	91.7	Very high	91.9	Very high	1 Å²	1	48.9 Å²	48.9	0%	0.004	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	11.2	179.4	-58.4	-78.9	0	0	0	113.7	L591 V596 V603 F605 V613 R616 N620 C621 L624 V627 A641 L642 L644	L591-F618 HydrophobicContact CD1-CZ 4.37Å; V596-F618 HydrophobicContact CG1-CD1 4.18Å; V596-F618 HydrophobicContact CG1-CE1 3.75Å; V603-F618 HydrophobicContact CG1-CE1 4.08Å; F605-F618 HydrophobicContact CE2-CE1 4.4Å; F605-F618 HydrophobicContact CE2-CZ 4.49Å; V613-F618 HydrophobicContact CG1-CE2 4.18Å; R616-F618 PolarHBondContact O-N 3.29Å; F618-N620 VanDerWaalsContact C-N 3.27Å; F618-N620 PolarHBondContact O-N 3.3Å; F618-N620 VanDerWaalsContact O-N 3.15Å; F618-C621 HydrophobicContact CB-CB 4.49Å; F618-C621 WeakPolarHBondContact O-CB 3.09Å; F618-C621 PolarHBondContact O-N 3.46Å; F618-L624 HydrophobicContact CB-CD2 3.84Å; F618-L624 HydrophobicContact CD1-CD2 3.73Å; F618-L624 HydrophobicContact CG-CD2 3.91Å; F618-V627 HydrophobicContact CE1-CG1 4.28Å; F618-V627 HydrophobicContact CE1-CG2 4.35Å; F618-V627 HydrophobicContact CE2-CG1 4.25Å; F618-V627 HydrophobicContact CZ-CG1 3.8Å; F618-A641 WeakPolarHBondContact CD2-O 3.47Å; F618-L642 HydrophobicContact CD2-CD2 4.01Å; F618-L642 HydrophobicContact CE2-CD2 3.94Å; F618-L644 HydrophobicContact CB-CD2 3.99Å; F618-L644 WeakPolarHBondContact O-CD2 3.1Å
619	F	90	Very high	91.8	Very high	57 Å²	57	48.5 Å²	48.5	25%	0.25	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-36.8	-168.3	-176.7	-100.1	0	0	0	113.9	R616 Q643 R645	R616-F619 HydrophobicContact CB-CB 3.64Å; R616-F619 HydrophobicContact CB-CD2 4.46Å; R616-F619 HydrophobicContact CB-CG 4.18Å; R616-F619 HydrophobicContact CG-CB 4.21Å; R616-F619 HydrophobicContact CG-CD2 4.09Å; R616-F619 HydrophobicContact CG-CG 4.28Å; R616-F619 VanDerWaalsContact O-CB 3.24Å; R616-F619 WeakPolarHBondContact O-CB 3.43Å; R616-F619 PolarHBondContact O-N 2.75Å; R616-F619 VanDerWaalsContact O-N 3.1Å; F619-Q643 VanDerWaalsContact CA-O 3.25Å; F619-Q643 WeakPolarHBondContact CA-O 3.05Å; F619-Q643 HydrophobicContact CD2-CG 4.47Å; F619-Q643 PolarHBondContact N-O 3.02Å; F619-R645 HydrophobicContact CD1-CB 4.37Å; F619-R645 HydrophobicContact CD2-CB 4.49Å; F619-R645 HydrophobicContact CE1-CB 4.11Å; F619-R645 HydrophobicContact CE1-CG 4.23Å; F619-R645 HydrophobicContact CE2-CB 4.23Å; F619-R645 HydrophobicContact CZ-CB 4.03Å; F619-R645 HydrophobicContact CZ-CG 4.1Å; F619-R645 WeakPolarHBondContact O-CB 3.42Å; F619-R645 PolarHBondContact O-N 2.92Å
620	N	87.8	Confident	91.7	Very high	75 Å²	75	48.6 Å²	48.6	40%	0.401	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-11.3	178.8	-68.1	-19.9	0	0	0	113.9	D598 F618 T622	D598-N620 HydrophobicContact CB-CB 4.26Å; D598-N620 WeakPolarHBondContact OD1-CB 3.33Å; F618-N620 VanDerWaalsContact C-N 3.27Å; F618-N620 PolarHBondContact O-N 3.3Å; F618-N620 VanDerWaalsContact O-N 3.15Å; N620-T622 PolarHBondContact O-N 3.02Å
621	C	89.5	Confident	91.6	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.007	26%	0.256	C	S	.	.			trans	-77.8	62.5	-177.8	-56.7	0	0	0	0	112	A597 D598 F618 Q623 L624 L644	A597-C621 PolarHBondContact O-SG 3.49Å; A597-C621 VanDerWaalsContact O-SG 3.41Å; D598-C621 WeakPolarHBondContact O-CA 3.26Å; F618-C621 HydrophobicContact CB-CB 4.49Å; F618-C621 WeakPolarHBondContact O-CB 3.09Å; F618-C621 PolarHBondContact O-N 3.46Å; C621-Q623 PolarHBondContact O-N 2.94Å; C621-L624 HydrophobicContact CB-CB 3.97Å; C621-L624 HydrophobicContact CB-CD2 4.17Å; C621-L624 HydrophobicContact CB-CG 4.49Å; C621-L624 WeakPolarHBondContact O-CB 3.22Å; C621-L624 PolarHBondContact O-N 2.99Å; C621-L644 HydrophobicContact CB-CD2 4.49Å
622	T	84.6	Confident	91.7	Very high	53 Å²	53	48.7 Å²	48.7	33%	0.325	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-13.7	-173	57.3	0	0	0	0	115.4	N620 R645 T647	N620-T622 PolarHBondContact O-N 3.02Å; T622-R645 HydrophobicContact CG2-CB 4.3Å; T622-T647 HydrophobicContact CG2-CG2 3.69Å
623	Q	84	Confident	91.8	Very high	91 Å²	91	46.6 Å²	46.6	43%	0.425	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105	5.8	179.9	-60.7	-69.5	-54.4	0	0	112.6	L600 R601 C621 S625	L600-Q623 CarbonylContact O-C 3.58Å; R601-Q623 WeakPolarHBondContact CA-O 3.03Å; R601-Q623 HydrophobicContact CG-CB 3.97Å; R601-Q623 WeakPolarHBondContact CG-O 3.27Å; C621-Q623 PolarHBondContact O-N 2.94Å; Q623-S625 PolarHBondContact O-N 3.17Å; Q623-S625 PolarHBondContact O-OG 3.38Å
624	L	88.2	Confident	91.7	Very high	5 Å²	5	45.6 Å²	45.6	3%	0.026	22%	0.224	C	C	.	.			trans	-65	120.3	-174.1	-164.1	66	0	0	0	110.8	L600 V603 F618 C621 V627 L644 S655	L600-L624 HydrophobicContact CB-CD1 4.35Å; L600-L624 PolarHBondContact O-N 2.91Å; V603-L624 HydrophobicContact CG1-CD1 4.21Å; F618-L624 HydrophobicContact CB-CD2 3.84Å; F618-L624 HydrophobicContact CD1-CD2 3.73Å; F618-L624 HydrophobicContact CG-CD2 3.91Å; C621-L624 HydrophobicContact CB-CB 3.97Å; C621-L624 HydrophobicContact CB-CD2 4.17Å; C621-L624 HydrophobicContact CB-CG 4.49Å; C621-L624 WeakPolarHBondContact O-CB 3.22Å; C621-L624 PolarHBondContact O-N 2.99Å; L624-V627 HydrophobicContact CD1-CG2 4.02Å; L624-V627 HydrophobicContact CD2-CG2 3.32Å; L624-V627 HydrophobicContact CG-CG2 3.74Å; L624-L644 HydrophobicContact CB-CD1 4.28Å; L624-L644 HydrophobicContact CB-CD2 4.18Å; L624-L644 HydrophobicContact CD2-CD2 3.97Å; L624-S655 PolarHBondContact O-OG 2.86Å
625	S	88.1	Confident	91.7	Very high	52 Å²	52	48.9 Å²	48.9	36%	0.364	23%	0.232	S	C	.	.			trans	-107.9	-28	-179.9	-53.1	0	0	0	0	111.9	R601 Q623 S655 L656	R601-S625 WeakPolarHBondContact O-CA 3.31Å; R601-S625 PolarHBondContact O-N 3.13Å; Q623-S625 PolarHBondContact O-N 3.17Å; Q623-S625 PolarHBondContact O-OG 3.38Å; S625-S655 CarbonylContact O-C 3.43Å; S625-S655 VanDerWaalsContact O-CA 3.3Å; S625-S655 WeakPolarHBondContact O-CA 3.42Å; S625-L656 PolarHBondContact O-N 3.29Å
626	S	90	Very high	91.8	Very high	22 Å²	22	48.6 Å²	48.6	15%	0.154	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	138.9	-179.8	-168.7	0	0	0	0	113	R601 V603 L656	R601-S626 PolarHBondContact O-N 2.89Å; R601-S626 VanDerWaalsContact O-N 3.1Å; V603-S626 PolarHBondContact N-O 3.05Å; V603-S626 VanDerWaalsContact N-O 3.08Å; S626-L656 CarbonylContact C-O 3.54Å; S626-L656 VanDerWaalsContact CA-O 3.25Å; S626-L656 WeakPolarHBondContact CA-O 3.29Å
627	V	92.4	Very high	91.8	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.012	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	119.2	173.2	-176.6	0	0	0	0	109.2	V603 F618 L624 L629 L656 V657 Y658	V603-V627 HydrophobicContact CG1-CB 4.41Å; V603-V627 HydrophobicContact CG1-CG1 4.18Å; V603-V627 HydrophobicContact CG1-CG2 4.09Å; V603-V627 WeakPolarHBondContact O-CA 3.25Å; F618-V627 HydrophobicContact CE1-CG1 4.28Å; F618-V627 HydrophobicContact CE1-CG2 4.35Å; F618-V627 HydrophobicContact CE2-CG1 4.25Å; F618-V627 HydrophobicContact CZ-CG1 3.8Å; L624-V627 HydrophobicContact CD1-CG2 4.02Å; L624-V627 HydrophobicContact CD2-CG2 3.32Å; L624-V627 HydrophobicContact CG-CG2 3.74Å; V627-L629 HydrophobicContact CG1-CD1 4.04Å; V627-L629 HydrophobicContact CG1-CG 4Å; V627-L656 PolarHBondContact N-O 3.22Å; V627-V657 WeakPolarHBondContact O-CA 3.12Å; V627-Y658 PolarHBondContact O-N 3.29Å
628	D	94.4	Very high	91.7	Very high	12 Å²	12	46 Å²	46	6%	0.064	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	118	174.4	-167.8	-15.7	0	0	0	111.1	V603 N604 F605 S606 R630 Y658	V603-D628 PolarHBondContact O-N 3.03Å; N604-D628 HydrophobicContact CB-CB 4.46Å; F605-D628 CarbonylContact C-O 3.54Å; F605-D628 WeakPolarHBondContact CA-O 3.37Å; F605-D628 WeakPolarHBondContact CB-O 3.47Å; F605-D628 PolarHBondContact N-O 3Å; S606-D628 PolarHBondContact N-O 3Å; D628-R630 VanDerWaalsContact OD1-CB 3.28Å; D628-R630 WeakPolarHBondContact OD1-CB 3.34Å; D628-R630 VanDerWaalsContact OD1-CG 3.23Å; D628-R630 WeakPolarHBondContact OD1-CG 3.43Å; D628-R630 PolarHBondContact OD1-N 3.21Å; D628-R630 IonicContact OD1-NE 3.99Å; D628-R630 PolarHBondContact OD1-NE 2.69Å; D628-R630 VanDerWaalsContact OD1-NE 3.14Å; D628-R630 IonicContact OD2-CZ 3.21Å; D628-R630 VanDerWaalsContact OD2-CZ 3.28Å; D628-R630 IonicContact OD2-NE 2.79Å; D628-R630 PolarHBondContact OD2-NE 2.89Å; D628-R630 IonicContact OD2-NH2 3.99Å; D628-R630 PolarHBondContact OD2-NH2 3.31Å; D628-Y658 HydrophobicContact CB-CD2 4.27Å
629	L	95.6	Very high	91.4	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.238	C	C	.	.			trans	-120.8	16.8	178.2	-72.1	165.2	0	0	0	111.9	L591 F605 I610 V613 V627 N632 L634 I637 L642 Y658 L659 N662	L591-L629 HydrophobicContact CD1-CD2 3.74Å; F605-L629 HydrophobicContact CB-CD2 3.91Å; I610-L629 HydrophobicContact CD1-CD2 4.08Å; V613-L629 HydrophobicContact CG2-CD1 4.44Å; V627-L629 HydrophobicContact CG1-CD1 4.04Å; V627-L629 HydrophobicContact CG1-CG 4Å; L629-N632 PolarHBondContact O-ND2 3.48Å; L629-L634 HydrophobicContact CB-CD1 4.33Å; L629-I637 HydrophobicContact CD1-CD1 4.36Å; L629-L642 HydrophobicContact CD1-CD2 4.35Å; L629-Y658 WeakPolarHBondContact CA-O 3.28Å; L629-Y658 PolarHBondContact N-O 3.13Å; L629-L659 HydrophobicContact CB-CD2 3.97Å; L629-L659 HydrophobicContact CD1-CD2 4.01Å; L629-N662 PolarHBondContact O-ND2 3.13Å
630	R	94.9	Very high	91.4	Very high	50 Å²	50	47.2 Å²	47.2	19%	0.189	24%	0.237	C	C	.	.			trans	-61.2	155.7	-179.2	-67.1	179.2	-73	174.5	-1.1	112.7	S606 H607 D628 N632 S660 E1182	S606-R630 CarbonylContact C-O 3.15Å; S606-R630 WeakPolarHBondContact CA-O 3.17Å; S606-R630 WeakPolarHBondContact CB-O 3.49Å; H607-R630 PolarHBondContact N-O 3.19Å; D628-R630 VanDerWaalsContact OD1-CB 3.28Å; D628-R630 WeakPolarHBondContact OD1-CB 3.34Å; D628-R630 VanDerWaalsContact OD1-CG 3.23Å; D628-R630 WeakPolarHBondContact OD1-CG 3.43Å; D628-R630 PolarHBondContact OD1-N 3.21Å; D628-R630 IonicContact OD1-NE 3.99Å; D628-R630 PolarHBondContact OD1-NE 2.69Å; D628-R630 VanDerWaalsContact OD1-NE 3.14Å; D628-R630 IonicContact OD2-CZ 3.21Å; D628-R630 VanDerWaalsContact OD2-CZ 3.28Å; D628-R630 IonicContact OD2-NE 2.79Å; D628-R630 PolarHBondContact OD2-NE 2.89Å; D628-R630 IonicContact OD2-NH2 3.99Å; D628-R630 PolarHBondContact OD2-NH2 3.31Å; R630-N632 VanDerWaalsContact C-N 3.31Å; R630-N632 PolarHBondContact O-N 3.44Å; R630-N632 PolarHBondContact O-ND2 3.15Å; R630-S660 WeakPolarHBondContact CA-O 3.38Å; R630-S660 WeakPolarHBondContact CD-OG 3.29Å; R630-S660 VanDerWaalsContact CG-OG 3.31Å; R630-S660 WeakPolarHBondContact CG-OG 3.35Å; R630-E1182 IonicContact CZ-OE1 2.8Å; R630-E1182 IonicContact NH1-OE1 3.36Å; R630-E1182 PolarHBondContact NH1-OE1 3.23Å; R630-E1182 VanDerWaalsContact NH1-OE1 3.13Å; R630-E1182 IonicContact NH2-OE1 2.71Å
631	Y	96.2	Very high	91.4	Very high	103 Å²	103	43.7 Å²	43.7	40%	0.404	22%	0.218	S	C	.	.	S	Bend	trans	54.6	43.7	175.9	-59.4	-84.2	0	0	0	114	H607 S660 N661	H607-Y631 WeakPolarHBondContact CA-O 3.21Å; H607-Y631 AromaticContact CD2-CD2 3.92Å; H607-Y631 AromaticContact CE1-CD1 3.74Å; H607-Y631 AromaticContact CE1-CD2 3.41Å; H607-Y631 VanDerWaalsContact CE1-CD2 3.41Å; H607-Y631 WeakPolarHBondContact CE1-CD2 3.48Å; H607-Y631 AromaticContact CE1-CE2 3.89Å; H607-Y631 AromaticContact CE1-CG 3.33Å; H607-Y631 PolarHBondContact N-O 2.95Å; H607-Y631 AromaticContact ND1-CG 3.69Å; H607-Y631 AromaticContact NE2-CD2 3.3Å; H607-Y631 VanDerWaalsContact NE2-CD2 3.3Å; H607-Y631 WeakPolarHBondContact NE2-CD2 3.39Å; H607-Y631 AromaticContact NE2-CE2 3.71Å; H607-Y631 AromaticContact NE2-CG 3.73Å; Y631-S660 PolarHBondContact N-O 3.11Å; Y631-N661 WeakPolarHBondContact CA-O 3.01Å; Y631-N661 HydrophobicContact CD1-CB 3.45Å; Y631-N661 VanDerWaalsContact CD1-CB 3.45Å; Y631-N661 HydrophobicContact CD2-CB 4.28Å; Y631-N661 HydrophobicContact CE1-CB 3.55Å; Y631-N661 HydrophobicContact CE2-CB 4.37Å; Y631-N661 HydrophobicContact CG-CB 3.84Å
632	N	97.7	Very high	91.4	Very high	3 Å²	3	45 Å²	45	2%	0.016	23%	0.225	C	C	.	.	S	Bend	trans	-109.4	-161.9	173.8	-86.4	-72.4	0	0	0	110.7	F605 N608 I610 L629 R630 L634 N662	F605-N632 PolarHBondContact O-ND2 2.7Å; N608-N632 VanDerWaalsContact CA-OD1 3.29Å; N608-N632 WeakPolarHBondContact CA-OD1 3.26Å; N608-N632 WeakPolarHBondContact CB-OD1 3.4Å; N608-N632 PolarHBondContact N-OD1 2.96Å; N608-N632 PolarHBondContact O-OD1 2.96Å; I610-N632 HydrophobicContact CB-CB 4.14Å; I610-N632 VanDerWaalsContact CB-OD1 3.27Å; I610-N632 WeakPolarHBondContact CB-OD1 3.38Å; I610-N632 VanDerWaalsContact CG1-OD1 3.29Å; I610-N632 WeakPolarHBondContact CG1-OD1 3.38Å; I610-N632 PolarHBondContact N-OD1 3.47Å; L629-N632 PolarHBondContact O-ND2 3.48Å; R630-N632 VanDerWaalsContact C-N 3.31Å; R630-N632 PolarHBondContact O-N 3.44Å; R630-N632 PolarHBondContact O-ND2 3.15Å; N632-L634 HydrophobicContact CB-CG 4.39Å; N632-N662 VanDerWaalsContact CA-OD1 3.27Å; N632-N662 WeakPolarHBondContact CA-OD1 3.4Å; N632-N662 WeakPolarHBondContact CB-OD1 3.25Å; N632-N662 PolarHBondContact N-OD1 3.29Å; N632-N662 PolarHBondContact O-OD1 2.97Å
633	K	96.9	Very high	91.4	Very high	118 Å²	118	46.7 Å²	46.7	51%	0.513	23%	0.229	S	C	.	.			trans	-117.6	25.7	-179.3	-58.8	-61.2	177.3	-167.2	0	112	I610 E611 R635 N662	I610-K633 CarbonylContact O-C 3.32Å; I610-K633 VanDerWaalsContact O-CA 3.29Å; I610-K633 WeakPolarHBondContact O-CA 3.48Å; I610-K633 PolarHBondContact O-N 3.35Å; E611-K633 HydrophobicContact CG-CB 4.07Å; K633-R635 PolarHBondContact O-N 3Å; K633-N662 PolarHBondContact N-OD1 3.01Å
634	L	95.8	Very high	91.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.221	C	C	.	.			trans	-67	117.4	-179.4	-61.7	171.9	0	0	0	110.3	I610 V613 L629 N632 L659 N662 P663 F664	I610-L634 HydrophobicContact CG2-CD2 3.94Å; I610-L634 PolarHBondContact O-N 3.07Å; I610-L634 VanDerWaalsContact O-N 3.15Å; V613-L634 HydrophobicContact CG2-CD2 3.99Å; L629-L634 HydrophobicContact CB-CD1 4.33Å; N632-L634 HydrophobicContact CB-CG 4.39Å; L634-L659 HydrophobicContact CD1-CD2 4.32Å; L634-N662 HydrophobicContact CB-CB 4.08Å; L634-N662 WeakPolarHBondContact CB-OD1 3.05Å; L634-N662 WeakPolarHBondContact CG-OD1 3.3Å; L634-N662 PolarHBondContact N-OD1 3.29Å; L634-N662 VanDerWaalsContact N-OD1 3.12Å; L634-P663 CarbonylContact O-C 3.56Å; L634-P663 VanDerWaalsContact O-C 3.29Å; L634-P663 VanDerWaalsContact O-CD 3.29Å; L634-P663 WeakPolarHBondContact O-CD 3.22Å; L634-F664 HydrophobicContact CB-CE1 3.87Å; L634-F664 HydrophobicContact CB-CZ 4.4Å; L634-F664 PolarHBondContact O-N 3.44Å
635	R	94.2	Very high	91	Very high	171 Å²	171	51.6 Å²	51.6	65%	0.645	25%	0.247	S	C	*	.	S	Bend	trans	-88	-28.5	168.7	-63.6	-174.3	-175.1	-174.7	1.3	112.1	K633 P663 F664 Q665	K633-R635 PolarHBondContact O-N 3Å; R635-P663 WeakPolarHBondContact CA-O 3.31Å; R635-F664 CarbonylContact O-C 3.36Å; R635-F664 WeakPolarHBondContact O-CA 3.41Å; R635-Q665 PolarHBondContact O-N 3.41Å
636	T	92.7	Very high	89.9	Confident	51 Å²	51	54.3 Å²	54.3	31%	0.313	27%	0.266	S	S	.	.			trans	-148.4	156.1	-177.9	-167.9	0	0	0	0	110.3	D667	T636-D667 WeakPolarHBondContact CB-OD2 3.42Å; T636-D667 PolarHBondContact OG1-OD1 3.27Å; T636-D667 PolarHBondContact OG1-OD2 2.83Å
637	I	92.2	Very high	88.1	Confident	4 Å²	4	57.2 Å²	57.2	2%	0.021	28%	0.283	C	S	.	.			trans	-153	116.6	173.9	-172.2	166.1	0	0	0	110.9	L629 A641 L642 L659 F664 Y669 I670 W672 L673	L629-I637 HydrophobicContact CD1-CD1 4.36Å; I637-A641 HydrophobicContact CG1-CB 4.23Å; I637-L642 HydrophobicContact CD1-CD1 3.87Å; I637-L642 HydrophobicContact CD1-CG 4.17Å; I637-L659 HydrophobicContact CD1-CD2 3.95Å; I637-F664 HydrophobicContact CB-CE1 4.47Å; I637-F664 HydrophobicContact CG2-CE1 3.78Å; I637-F664 HydrophobicContact CG2-CZ 4.3Å; I637-Y669 VanDerWaalsContact O-O 3.13Å; I637-I670 HydrophobicContact CG2-CG2 4.15Å; I637-W672 HydrophobicContact CG2-CZ2 4.22Å; I637-W672 PolarHBondContact O-NE1 3.07Å; I637-L673 HydrophobicContact CG2-CD1 4.16Å
638	E	88.7	Confident	85.7	Confident	94 Å²	94	63.9 Å²	63.9	44%	0.439	32%	0.318	S	S	.	.			trans	-74.6	146.4	174.7	-64.6	-175.5	-179.6	0	0	111.4	S640 A641 Y669	E638-S640 WeakPolarHBondContact CB-OG 3.32Å; E638-S640 PolarHBondContact O-N 3.18Å; E638-S640 VanDerWaalsContact O-N 3.15Å; E638-S640 PolarHBondContact OE2-OG 3.12Å; E638-A641 VanDerWaalsContact O-CB 3.25Å; E638-A641 WeakPolarHBondContact O-CB 3.12Å; E638-A641 PolarHBondContact O-N 3.37Å; E638-Y669 HydrophobicContact CG-CD1 4.2Å
639	A	86.2	Confident	83.5	Confident	53 Å²	53	71.9 Å²	71.9	44%	0.438	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-57.7	-29.4	172.2	0	0	0	0	0	112.6	A641 L642 Q643 W672	A639-A641 PolarHBondContact O-N 3.17Å; A639-L642 PolarHBondContact O-N 2.82Å; A639-Q643 PolarHBondContact O-N 2.83Å; A639-W672 HydrophobicContact CB-CD2 4.04Å; A639-W672 HydrophobicContact CB-CG 4.07Å
640	S	88.5	Confident	80.9	Confident	32 Å²	32	78.3 Å²	78.3	22%	0.224	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-62.1	-26.1	176.5	74.9	0	0	0	0	113.1	A615 R616 E638 L642 Q643	A615-S640 WeakPolarHBondContact CB-OG 3.26Å; R616-S640 PolarHBondContact N-O 3.5Å; E638-S640 WeakPolarHBondContact CB-OG 3.32Å; E638-S640 PolarHBondContact O-N 3.18Å; E638-S640 VanDerWaalsContact O-N 3.15Å; E638-S640 PolarHBondContact OE2-OG 3.12Å; S640-L642 VanDerWaalsContact C-N 3.34Å; S640-Q643 WeakPolarHBondContact O-CB 3.22Å; S640-Q643 PolarHBondContact O-N 2.04Å
641	A	89.3	Confident	78.3	Confident	1 Å²	1	79.4 Å²	79.4	1%	0.008	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-68.6	-34.3	-179.1	0	0	0	0	0	112.3	V613 F618 I637 E638 A639	V613-A641 HydrophobicContact CB-CB 4.21Å; V613-A641 HydrophobicContact CG1-CB 3.94Å; F618-A641 WeakPolarHBondContact CD2-O 3.47Å; I637-A641 HydrophobicContact CG1-CB 4.23Å; E638-A641 VanDerWaalsContact O-CB 3.25Å; E638-A641 WeakPolarHBondContact O-CB 3.12Å; E638-A641 PolarHBondContact O-N 3.37Å; A639-A641 PolarHBondContact O-N 3.17Å
642	L	88.4	Confident	75.7	Confident	27 Å²	27	79.9 Å²	79.9	14%	0.141	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-100.7	4.6	-179	-62.2	166.1	0	0	0	112.7	F618 L629 I637 A639 S640 L644 V657 W672	F618-L642 HydrophobicContact CD2-CD2 4.01Å; F618-L642 HydrophobicContact CE2-CD2 3.94Å; L629-L642 HydrophobicContact CD1-CD2 4.35Å; I637-L642 HydrophobicContact CD1-CD1 3.87Å; I637-L642 HydrophobicContact CD1-CG 4.17Å; A639-L642 PolarHBondContact O-N 2.82Å; S640-L642 VanDerWaalsContact C-N 3.34Å; L642-L644 PolarHBondContact O-N 2.75Å; L642-V657 HydrophobicContact CD1-CG1 3.82Å; L642-V657 HydrophobicContact CD1-CG2 4.35Å; L642-V657 HydrophobicContact CD2-CG1 4.09Å; L642-W672 HydrophobicContact CD1-CH2 3.56Å; L642-W672 HydrophobicContact CD1-CZ2 4.01Å
643	Q	84.4	Confident	73.3	Confident	89 Å²	89	84.6 Å²	84.6	42%	0.416	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-65	126.8	-180	-174.6	178.6	18.5	0	0	110.9	F619 A639 S640	F619-Q643 VanDerWaalsContact CA-O 3.25Å; F619-Q643 WeakPolarHBondContact CA-O 3.05Å; F619-Q643 HydrophobicContact CD2-CG 4.47Å; F619-Q643 PolarHBondContact N-O 3.02Å; A639-Q643 PolarHBondContact O-N 2.83Å; S640-Q643 WeakPolarHBondContact O-CB 3.22Å; S640-Q643 PolarHBondContact O-N 2.04Å
644	L	84.3	Confident	71.4	Confident	49 Å²	49	82.5 Å²	82.5	26%	0.257	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-94.9	151.4	169.1	-57.1	-177.6	0	0	0	110.7	F618 C621 L624 L642 S646 S655	F618-L644 HydrophobicContact CB-CD2 3.99Å; F618-L644 WeakPolarHBondContact O-CD2 3.1Å; C621-L644 HydrophobicContact CB-CD2 4.49Å; L624-L644 HydrophobicContact CB-CD1 4.28Å; L624-L644 HydrophobicContact CB-CD2 4.18Å; L624-L644 HydrophobicContact CD2-CD2 3.97Å; L642-L644 PolarHBondContact O-N 2.75Å; L644-S646 PolarHBondContact O-N 3.07Å; L644-S655 WeakPolarHBondContact CD1-OG 3.34Å
645	R	79.7	Confident	70	Confident	151 Å²	151	83.8 Å²	83.8	57%	0.57	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-62.4	121.5	169.8	-175.4	175.3	-177.3	175.7	0.4	109.1	F619 T622 T647	F619-R645 HydrophobicContact CD1-CB 4.37Å; F619-R645 HydrophobicContact CD2-CB 4.49Å; F619-R645 HydrophobicContact CE1-CB 4.11Å; F619-R645 HydrophobicContact CE1-CG 4.23Å; F619-R645 HydrophobicContact CE2-CB 4.23Å; F619-R645 HydrophobicContact CZ-CB 4.03Å; F619-R645 HydrophobicContact CZ-CG 4.1Å; F619-R645 WeakPolarHBondContact O-CB 3.42Å; F619-R645 PolarHBondContact O-N 2.92Å; T622-R645 HydrophobicContact CG2-CB 4.3Å; R645-T647 PolarHBondContact O-N 2.98Å
646	S	65.2	Low	69.2	Low	108 Å²	108	78.7 Å²	78.7	76%	0.755	47%	0.466	S	S	*	.			trans	-55	108	175.2	-177.8	0	0	0	0	109.5	L644	L644-S646 PolarHBondContact O-N 3.07Å
647	T	52.5	Low	68.9	Low	83 Å²	83	77.1 Å²	77.1	51%	0.509	46%	0.456	S	S	.	.			trans	-106.1	124.6	166.6	56.3	0	0	0	0	105.9	T622 R645	T622-T647 HydrophobicContact CG2-CG2 3.69Å; R645-T647 PolarHBondContact O-N 2.98Å
648	N	42.8	Very low	68.9	Low	143 Å²	143	80.3 Å²	80.3	77%	0.765	47%	0.468	S	S	*	.			trans	9.4	120.6	-178.3	-67.9	-17.2	0	0	0	117.7	T650	N648-T650 PolarHBondContact O-N 3.34Å
649	L	46.3	Very low	69	Low	179 Å²	179	75.9 Å²	75.9	94%	0.937	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-38.3	-3.2	-179.3	-82.6	138.1	0	0	0	119.9
650	T	41.9	Very low	69.3	Low	136 Å²	136	73.5 Å²	73.5	83%	0.834	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-7.4	-169.6	50.6	0	0	0	0	115.9	N648	N648-T650 PolarHBondContact O-N 3.34Å
651	A	39.8	Very low	69.4	Low	73 Å²	73	76 Å²	76	60%	0.603	44%	0.439	S	S	*	.			trans	-162.8	82.2	168.8	0	0	0	0	0	111.1	T653	A651-T653 PolarHBondContact O-N 2.89Å
652	S	43	Very low	69.6	Low	113 Å²	113	76.6 Å²	76.6	79%	0.79	44%	0.442	S	S	*	.			trans	-66.3	80.2	153	163.4	0	0	0	0	107	A654	S652-A654 PolarHBondContact O-N 2.89Å
653	T	46.2	Very low	69.9	Low	101 Å²	101	78.5 Å²	78.5	62%	0.62	46%	0.456	S	S	*	.			trans	-62.1	99.3	158.1	48.6	0	0	0	0	104.7	A651 S655	A651-T653 PolarHBondContact O-N 2.89Å; T653-S655 PolarHBondContact O-N 2.87Å
654	A	57.3	Low	70.3	Confident	75 Å²	75	74.4 Å²	74.4	62%	0.62	44%	0.436	S	S	*	.			trans	-52.7	113.4	176.5	0	0	0	0	0	106.7	S652 L656	S652-A654 PolarHBondContact O-N 2.89Å; A654-L656 PolarHBondContact O-N 3.23Å
655	S	66.2	Low	70.6	Confident	27 Å²	27	75.3 Å²	75.3	19%	0.189	44%	0.439	C	S	.	.			trans	-61	130	177	-47.8	0	0	0	0	107.5	L624 S625 L644 T653 V657	L624-S655 PolarHBondContact O-OG 2.86Å; S625-S655 CarbonylContact O-C 3.43Å; S625-S655 VanDerWaalsContact O-CA 3.3Å; S625-S655 WeakPolarHBondContact O-CA 3.42Å; L644-S655 WeakPolarHBondContact CD1-OG 3.34Å; T653-S655 PolarHBondContact O-N 2.87Å; S655-V657 WeakPolarHBondContact O-CG2 3.17Å; S655-V657 PolarHBondContact O-N 3.12Å
656	L	78.5	Confident	71.1	Confident	63 Å²	63	68.1 Å²	68.1	33%	0.33	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	117.2	175.9	-62.6	177.8	0	0	0	108.3	S625 S626 V627 A654 Y658 D678	S625-L656 PolarHBondContact O-N 3.29Å; S626-L656 CarbonylContact C-O 3.54Å; S626-L656 VanDerWaalsContact CA-O 3.25Å; S626-L656 WeakPolarHBondContact CA-O 3.29Å; V627-L656 PolarHBondContact N-O 3.22Å; A654-L656 PolarHBondContact O-N 3.23Å; L656-Y658 HydrophobicContact CB-CE2 4.09Å; L656-D678 HydrophobicContact CD2-CB 4.38Å; L656-D678 WeakPolarHBondContact CD2-OD2 3.44Å
657	V	86.7	Confident	72.3	Confident	18 Å²	18	63.7 Å²	63.7	11%	0.109	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	118.7	178.5	-170.2	0	0	0	0	109.3	V627 L642 S655 L659 L677	V627-V657 WeakPolarHBondContact O-CA 3.12Å; L642-V657 HydrophobicContact CD1-CG1 3.82Å; L642-V657 HydrophobicContact CD1-CG2 4.35Å; L642-V657 HydrophobicContact CD2-CG1 4.09Å; S655-V657 WeakPolarHBondContact O-CG2 3.17Å; S655-V657 PolarHBondContact O-N 3.12Å; V657-L659 HydrophobicContact CG1-CD1 4.11Å; V657-L659 HydrophobicContact CG1-CD2 4.24Å; V657-L659 HydrophobicContact CG1-CG 3.91Å; V657-L677 HydrophobicContact CB-CD2 3.96Å
658	Y	90.5	Very high	74.1	Confident	71 Å²	71	60.3 Å²	60.3	28%	0.278	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	123.8	177.5	-55.5	-83.6	0	0	0	110.2	V627 D628 L629 L656	V627-Y658 PolarHBondContact O-N 3.29Å; D628-Y658 HydrophobicContact CB-CD2 4.27Å; L629-Y658 WeakPolarHBondContact CA-O 3.28Å; L629-Y658 PolarHBondContact N-O 3.13Å; L656-Y658 HydrophobicContact CB-CE2 4.09Å
659	L	92.1	Very high	76.3	Confident	1 Å²	1	59 Å²	59	1%	0.005	35%	0.345	C	S	.	.			trans	-129.9	-2.3	-170.9	-71.4	167.6	0	0	0	113.7	L629 L634 I637 V657 N662 F664 L673 L677 L683	L629-L659 HydrophobicContact CB-CD2 3.97Å; L629-L659 HydrophobicContact CD1-CD2 4.01Å; L634-L659 HydrophobicContact CD1-CD2 4.32Å; I637-L659 HydrophobicContact CD1-CD2 3.95Å; V657-L659 HydrophobicContact CG1-CD1 4.11Å; V657-L659 HydrophobicContact CG1-CD2 4.24Å; V657-L659 HydrophobicContact CG1-CG 3.91Å; L659-N662 PolarHBondContact O-ND2 3.07Å; L659-F664 HydrophobicContact CB-CE2 4.11Å; L659-F664 HydrophobicContact CB-CZ 4.03Å; L659-F664 HydrophobicContact CD2-CZ 4.25Å; L659-F664 VanDerWaalsContact O-CE2 3.32Å; L659-F664 WeakPolarHBondContact O-CE2 3.3Å; L659-L673 HydrophobicContact CD1-CD1 4.46Å; L659-L673 HydrophobicContact CD1-CD2 3.55Å; L659-L677 HydrophobicContact CD1-CD1 4.21Å; L659-L683 VanDerWaalsContact C-CD2 3.48Å; L659-L683 HydrophobicContact CB-CD2 3.77Å
660	S	91.2	Very high	78.4	Confident	3 Å²	3	50.5 Å²	50.5	2%	0.021	30%	0.3	C	S	.	.			trans	-58.5	160.7	-177.9	56.3	0	0	0	0	113.7	R630 Y631 N662 D679	R630-S660 WeakPolarHBondContact CA-O 3.38Å; R630-S660 WeakPolarHBondContact CD-OG 3.29Å; R630-S660 VanDerWaalsContact CG-OG 3.31Å; R630-S660 WeakPolarHBondContact CG-OG 3.35Å; Y631-S660 PolarHBondContact N-O 3.11Å; S660-N662 VanDerWaalsContact C-N 3.27Å; S660-N662 PolarHBondContact O-N 2.8Å; S660-N662 PolarHBondContact O-ND2 2.69Å; S660-D679 WeakPolarHBondContact CB-OD2 3.44Å; S660-D679 PolarHBondContact OG-OD2 2.91Å
661	N	91.9	Very high	80.4	Confident	85 Å²	85	44.9 Å²	44.9	46%	0.455	27%	0.269	S	S	.	.	S	Bend	trans	58	32.6	-177.2	-57.4	90.2	0	0	0	115.1	Y631	Y631-N661 WeakPolarHBondContact CA-O 3.01Å; Y631-N661 HydrophobicContact CD1-CB 3.45Å; Y631-N661 VanDerWaalsContact CD1-CB 3.45Å; Y631-N661 HydrophobicContact CD2-CB 4.28Å; Y631-N661 HydrophobicContact CE1-CB 3.55Å; Y631-N661 HydrophobicContact CE2-CB 4.37Å; Y631-N661 HydrophobicContact CG-CB 3.84Å
662	N	93.7	Very high	82.6	Confident	14 Å²	14	45.2 Å²	45.2	8%	0.075	26%	0.255	C	S	.	.			trans	-105	145.1	167	-81.6	-78.6	0	0	0	111	L629 N632 K633 L634 L659 S660 F664	L629-N662 PolarHBondContact O-ND2 3.13Å; N632-N662 VanDerWaalsContact CA-OD1 3.27Å; N632-N662 WeakPolarHBondContact CA-OD1 3.4Å; N632-N662 WeakPolarHBondContact CB-OD1 3.25Å; N632-N662 PolarHBondContact N-OD1 3.29Å; N632-N662 PolarHBondContact O-OD1 2.97Å; K633-N662 PolarHBondContact N-OD1 3.01Å; L634-N662 HydrophobicContact CB-CB 4.08Å; L634-N662 WeakPolarHBondContact CB-OD1 3.05Å; L634-N662 WeakPolarHBondContact CG-OD1 3.3Å; L634-N662 PolarHBondContact N-OD1 3.29Å; L634-N662 VanDerWaalsContact N-OD1 3.12Å; L659-N662 PolarHBondContact O-ND2 3.07Å; S660-N662 VanDerWaalsContact C-N 3.27Å; S660-N662 PolarHBondContact O-N 2.8Å; S660-N662 PolarHBondContact O-ND2 2.69Å; N662-F664 HydrophobicContact CB-CD2 3.89Å; N662-F664 HydrophobicContact CB-CE1 4.2Å; N662-F664 HydrophobicContact CB-CE2 3.53Å; N662-F664 HydrophobicContact CB-CG 4.38Å; N662-F664 HydrophobicContact CB-CZ 3.68Å; N662-F664 PolarHBondContact O-N 3.17Å
663	P	93.6	Very high	84.6	Confident	66 Å²	66	39.8 Å²	39.8	43%	0.429	22%	0.217	S	C	.	.			trans	-78.7	57	-179.8	35.8	-38.2	0	0	0	111.8	L634 R635 Q665	L634-P663 CarbonylContact O-C 3.56Å; L634-P663 VanDerWaalsContact O-C 3.29Å; L634-P663 VanDerWaalsContact O-CD 3.29Å; L634-P663 WeakPolarHBondContact O-CD 3.22Å; R635-P663 WeakPolarHBondContact CA-O 3.31Å; P663-Q665 PolarHBondContact O-N 3.06Å
664	F	92.8	Very high	86.2	Confident	3 Å²	3	38 Å²	38	1%	0.013	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	139.3	-177.8	-68.8	-63.2	0	0	0	111.7	L634 R635 I637 L659 N662 I670 L673 C685 T686	L634-F664 HydrophobicContact CB-CE1 3.87Å; L634-F664 HydrophobicContact CB-CZ 4.4Å; L634-F664 PolarHBondContact O-N 3.44Å; R635-F664 CarbonylContact O-C 3.36Å; R635-F664 WeakPolarHBondContact O-CA 3.41Å; I637-F664 HydrophobicContact CB-CE1 4.47Å; I637-F664 HydrophobicContact CG2-CE1 3.78Å; I637-F664 HydrophobicContact CG2-CZ 4.3Å; L659-F664 HydrophobicContact CB-CE2 4.11Å; L659-F664 HydrophobicContact CB-CZ 4.03Å; L659-F664 HydrophobicContact CD2-CZ 4.25Å; L659-F664 VanDerWaalsContact O-CE2 3.32Å; L659-F664 WeakPolarHBondContact O-CE2 3.3Å; N662-F664 HydrophobicContact CB-CD2 3.89Å; N662-F664 HydrophobicContact CB-CE1 4.2Å; N662-F664 HydrophobicContact CB-CE2 3.53Å; N662-F664 HydrophobicContact CB-CG 4.38Å; N662-F664 HydrophobicContact CB-CZ 3.68Å; N662-F664 PolarHBondContact O-N 3.17Å; F664-I670 HydrophobicContact CB-CD1 3.96Å; F664-I670 HydrophobicContact CD1-CG2 4.38Å; F664-I670 HydrophobicContact CG-CD1 4.45Å; F664-L673 HydrophobicContact CZ-CD1 4.5Å; F664-C685 HydrophobicContact CB-CB 3.91Å; F664-C685 CarbonylContact O-C 3.55Å; F664-C685 WeakPolarHBondContact O-CA 3.39Å; F664-T686 PolarHBondContact O-N 3.1Å; F664-T686 PolarHBondContact O-OG1 2.93Å
665	Q	91.2	Very high	86.6	Confident	69 Å²	69	36.3 Å²	36.3	32%	0.322	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	134	167.9	178	172.3	-7.6	0	0	107.9	R635 P663 D667 I670 T686 T688	R635-Q665 PolarHBondContact O-N 3.41Å; P663-Q665 PolarHBondContact O-N 3.06Å; Q665-D667 PolarHBondContact O-N 3Å; Q665-I670 WeakPolarHBondContact O-CD1 3.11Å; Q665-T686 CarbonylContact C-O 3.56Å; Q665-T686 WeakPolarHBondContact CA-O 3.42Å; Q665-T688 WeakPolarHBondContact CG-OG1 3.44Å; Q665-T688 PolarHBondContact NE2-OG1 3.38Å
666	C	89.9	Confident	86.1	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	79.2	177.2	-43.7	0	0	0	0	109.2	C685 T686 T688 A706 F707	C666-C685 HydrophobicContact CB-CB 4.02Å; C666-C685 WeakPolarHBondContact CB-SG 3.09Å; C666-C685 WeakPolarHBondContact SG-CB 3.36Å; C666-C685 PolarHBondContact SG-O 3.31Å; C666-C685 CovalentContact SG-SG 2.04Å; C666-C685 PolarHBondContact SG-SG 3.35Å; C666-T686 PolarHBondContact N-O 2.68Å; C666-T688 PolarHBondContact O-OG1 3Å; C666-A706 WeakPolarHBondContact CB-O 3.35Å; C666-F707 HydrophobicContact CB-CD1 4.28Å; C666-F707 HydrophobicContact CB-CE1 4.46Å
667	D	90.4	Very high	85.1	Confident	15 Å²	15	38.4 Å²	38.4	8%	0.08	22%	0.217	C	C	.	.			trans	-102.3	173.6	174	68.1	29.9	0	0	0	110.7	T636 Q665 Y669 I670 F707 V708	T636-D667 WeakPolarHBondContact CB-OD2 3.42Å; T636-D667 PolarHBondContact OG1-OD1 3.27Å; T636-D667 PolarHBondContact OG1-OD2 2.83Å; Q665-D667 PolarHBondContact O-N 3Å; D667-Y669 HydrophobicContact CB-CD2 4.48Å; D667-Y669 PolarHBondContact O-N 2.8Å; D667-Y669 WeakPolarHBondContact OD1-CA 3.42Å; D667-Y669 WeakPolarHBondContact OD1-CB 3.14Å; D667-Y669 PolarHBondContact OD1-N 3.04Å; D667-I670 PolarHBondContact OD1-N 2.89Å; D667-F707 WeakPolarHBondContact O-CB 3.1Å; D667-V708 WeakPolarHBondContact CA-O 3.45Å
668	C	89.5	Confident	83.6	Confident	11 Å²	11	44.4 Å²	44.4	7%	0.074	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-13.9	179.6	71	0	0	0	0	113.6	C709 A743	C668-C709 HydrophobicContact CB-CB 3.88Å; C668-C709 WeakPolarHBondContact CB-SG 3.38Å; C668-C709 PolarHBondContact N-SG 3.38Å; C668-C709 WeakPolarHBondContact SG-CB 3.25Å; C668-C709 CovalentContact SG-SG 2.03Å; C668-C709 PolarHBondContact SG-SG 3.26Å; C668-A743 HydrophobicContact CB-CB 4.33Å
669	Y	89.5	Confident	81.9	Confident	117 Å²	117	42 Å²	42	46%	0.459	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-22.6	-178.5	-57.4	-69.4	0	0	0	112.9	I637 E638 D667 W672 C709	I637-Y669 VanDerWaalsContact O-O 3.13Å; E638-Y669 HydrophobicContact CG-CD1 4.2Å; D667-Y669 HydrophobicContact CB-CD2 4.48Å; D667-Y669 PolarHBondContact O-N 2.8Å; D667-Y669 WeakPolarHBondContact OD1-CA 3.42Å; D667-Y669 WeakPolarHBondContact OD1-CB 3.14Å; D667-Y669 PolarHBondContact OD1-N 3.04Å; Y669-W672 PolarHBondContact O-NE1 3.34Å; Y669-W672 VanDerWaalsContact O-NE1 3.09Å; Y669-C709 VanDerWaalsContact CE2-SG 3.54Å
670	I	90.3	Very high	80.2	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.252	C	S	.	.	S	Bend	trans	-99.5	-0.2	177.8	70.9	162.2	0	0	0	114.1	I637 F664 Q665 D667 W672 L673 C685 I699 F707	I637-I670 HydrophobicContact CG2-CG2 4.15Å; F664-I670 HydrophobicContact CB-CD1 3.96Å; F664-I670 HydrophobicContact CD1-CG2 4.38Å; F664-I670 HydrophobicContact CG-CD1 4.45Å; Q665-I670 WeakPolarHBondContact O-CD1 3.11Å; D667-I670 PolarHBondContact OD1-N 2.89Å; I670-W672 PolarHBondContact O-N 2.94Å; I670-W672 VanDerWaalsContact O-N 3.08Å; I670-L673 HydrophobicContact CB-CD1 3.87Å; I670-L673 HydrophobicContact CB-CG 4.32Å; I670-L673 HydrophobicContact CG2-CD1 4.35Å; I670-L673 VanDerWaalsContact O-CB 3.24Å; I670-L673 WeakPolarHBondContact O-CB 3.34Å; I670-L673 WeakPolarHBondContact O-CG 3.3Å; I670-L673 PolarHBondContact O-N 3.24Å; I670-C685 HydrophobicContact CD1-CB 3.89Å; I670-I699 HydrophobicContact CD1-CD1 4.05Å; I670-F707 HydrophobicContact CD1-CD1 4.45Å; I670-F707 HydrophobicContact CD1-CE1 4.22Å; I670-F707 HydrophobicContact CG1-CD1 3.95Å; I670-F707 HydrophobicContact CG1-CE1 4.11Å
671	G	85.1	Confident	78.5	Confident	18 Å²	18	48.1 Å²	48.1	19%	0.186	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-57.6	-26.4	-178.9	0	0	0	0	0	113.7	L673 S674	G671-L673 PolarHBondContact O-N 3.38Å; G671-S674 WeakPolarHBondContact O-CB 3.37Å; G671-S674 PolarHBondContact O-N 3.04Å; G671-S674 PolarHBondContact O-OG 3.32Å
672	W	85.3	Confident	77.5	Confident	79 Å²	79	48.5 Å²	48.5	30%	0.299	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-65.1	-23.1	175	69.5	-88.9	0	0	0	113.5	I637 A639 L642 Y669 I670 S674 G675 L677	I637-W672 HydrophobicContact CG2-CZ2 4.22Å; I637-W672 PolarHBondContact O-NE1 3.07Å; A639-W672 HydrophobicContact CB-CD2 4.04Å; A639-W672 HydrophobicContact CB-CG 4.07Å; L642-W672 HydrophobicContact CD1-CH2 3.56Å; L642-W672 HydrophobicContact CD1-CZ2 4.01Å; Y669-W672 PolarHBondContact O-NE1 3.34Å; Y669-W672 VanDerWaalsContact O-NE1 3.09Å; I670-W672 PolarHBondContact O-N 2.94Å; I670-W672 VanDerWaalsContact O-N 3.08Å; W672-S674 PolarHBondContact O-N 3.17Å; W672-G675 PolarHBondContact O-N 3.49Å; W672-L677 HydrophobicContact CH2-CD1 4.34Å; W672-L677 HydrophobicContact CZ3-CD1 3.96Å; W672-L677 HydrophobicContact CZ3-CG 4.46Å
673	L	85.6	Confident	77.3	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-65.7	-15.6	176.6	-62.1	-179.7	0	0	0	113	I637 L659 F664 I670 G671 G675 L677 H680 L683 I699	I637-L673 HydrophobicContact CG2-CD1 4.16Å; L659-L673 HydrophobicContact CD1-CD1 4.46Å; L659-L673 HydrophobicContact CD1-CD2 3.55Å; F664-L673 HydrophobicContact CZ-CD1 4.5Å; I670-L673 HydrophobicContact CB-CD1 3.87Å; I670-L673 HydrophobicContact CB-CG 4.32Å; I670-L673 HydrophobicContact CG2-CD1 4.35Å; I670-L673 VanDerWaalsContact O-CB 3.24Å; I670-L673 WeakPolarHBondContact O-CB 3.34Å; I670-L673 WeakPolarHBondContact O-CG 3.3Å; I670-L673 PolarHBondContact O-N 3.24Å; G671-L673 PolarHBondContact O-N 3.38Å; L673-G675 PolarHBondContact O-N 2.88Å; L673-L677 HydrophobicContact CB-CD1 4.42Å; L673-L677 HydrophobicContact CD2-CD1 3.33Å; L673-L677 HydrophobicContact CG-CD1 4.48Å; L673-H680 PolarHBondContact O-ND1 3.03Å; L673-L683 HydrophobicContact CB-CD1 4.44Å; L673-I699 HydrophobicContact CB-CD1 4.39Å; L673-I699 HydrophobicContact CB-CG2 3.93Å; L673-I699 HydrophobicContact CD1-CD1 3.97Å
674	S	78.7	Confident	77.1	Confident	63 Å²	63	49.1 Å²	49.1	44%	0.441	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-66	-20.6	171.4	65.5	0	0	0	0	112.8	G671 W672	G671-S674 WeakPolarHBondContact O-CB 3.37Å; G671-S674 PolarHBondContact O-N 3.04Å; G671-S674 PolarHBondContact O-OG 3.32Å; W672-S674 PolarHBondContact O-N 3.17Å
675	G	65.7	Low	77	Confident	40 Å²	40	49 Å²	49	41%	0.412	28%	0.276	S	S	.	.	S	Bend	trans	-113.7	133	179.8	0	0	0	0	0	113.9	W672 L673 H680	W672-G675 PolarHBondContact O-N 3.49Å; L673-G675 PolarHBondContact O-N 2.88Å; G675-H680 VanDerWaalsContact C-CE1 3.4Å
676	S	55.1	Low	76.9	Confident	115 Å²	115	48.6 Å²	48.6	80%	0.804	28%	0.278	S	S	*	.	S	Bend	trans	45.7	65.9	167	-161	0	0	0	0	118.4	H680	S676-H680 VanDerWaalsContact CA-NE2 3.3Å; S676-H680 WeakPolarHBondContact CA-NE2 3.37Å; S676-H680 PolarHBondContact N-CE1 3.34Å; S676-H680 PolarHBondContact N-NE2 3.41Å
677	L	57.8	Low	76.7	Confident	18 Å²	18	49.1 Å²	49.1	9%	0.094	28%	0.282	C	S	.	.			trans	-132.6	131.2	162.6	-76.7	167.3	0	0	0	109	V657 L659 W672 L673 D679 H680 L683	V657-L677 HydrophobicContact CB-CD2 3.96Å; L659-L677 HydrophobicContact CD1-CD1 4.21Å; W672-L677 HydrophobicContact CH2-CD1 4.34Å; W672-L677 HydrophobicContact CZ3-CD1 3.96Å; W672-L677 HydrophobicContact CZ3-CG 4.46Å; L673-L677 HydrophobicContact CB-CD1 4.42Å; L673-L677 HydrophobicContact CD2-CD1 3.33Å; L673-L677 HydrophobicContact CG-CD1 4.48Å; L677-D679 PolarHBondContact O-N 3.36Å; L677-H680 PolarHBondContact N-CE1 3.3Å; L677-H680 PolarHBondContact N-NE2 2.84Å; L677-H680 PolarHBondContact O-CD2 3.21Å; L677-H680 PolarHBondContact O-N 3.06Å; L677-H680 VanDerWaalsContact O-N 3.13Å; L677-H680 PolarHBondContact O-ND1 3.07Å; L677-H680 PolarHBondContact O-NE2 2.66Å; L677-L683 HydrophobicContact CD1-CD1 4.42Å
678	D	54.7	Low	75.9	Confident	145 Å²	145	50.3 Å²	50.3	78%	0.775	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-20.7	-177.3	-79.7	-31.5	0	0	0	114	L656 H680	L656-D678 HydrophobicContact CD2-CB 4.38Å; L656-D678 WeakPolarHBondContact CD2-OD2 3.44Å; D678-H680 VanDerWaalsContact C-N 3.31Å; D678-H680 PolarHBondContact O-N 3.11Å
679	D	55.1	Low	74.7	Confident	20 Å²	20	51.2 Å²	51.2	11%	0.107	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	18.2	179.2	-152.1	9.2	0	0	0	114.1	S660 L677 A681 Q682	S660-D679 WeakPolarHBondContact CB-OD2 3.44Å; S660-D679 PolarHBondContact OG-OD2 2.91Å; L677-D679 PolarHBondContact O-N 3.36Å; D679-A681 PolarHBondContact O-N 3.48Å; D679-Q682 PolarHBondContact O-N 3.01Å; D679-Q682 VanDerWaalsContact O-N 3.15Å
680	H	56.3	Low	73.3	Confident	55 Å²	55	50.5 Å²	50.5	26%	0.255	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-27.3	-174.3	-81.1	-44.7	0	0	0	115.9	L673 G675 S676 L677 D678 Q682 S700	L673-H680 PolarHBondContact O-ND1 3.03Å; G675-H680 VanDerWaalsContact C-CE1 3.4Å; S676-H680 VanDerWaalsContact CA-NE2 3.3Å; S676-H680 WeakPolarHBondContact CA-NE2 3.37Å; S676-H680 PolarHBondContact N-CE1 3.34Å; S676-H680 PolarHBondContact N-NE2 3.41Å; L677-H680 PolarHBondContact N-CE1 3.3Å; L677-H680 PolarHBondContact N-NE2 2.84Å; L677-H680 PolarHBondContact O-CD2 3.21Å; L677-H680 PolarHBondContact O-N 3.06Å; L677-H680 VanDerWaalsContact O-N 3.13Å; L677-H680 PolarHBondContact O-ND1 3.07Å; L677-H680 PolarHBondContact O-NE2 2.66Å; D678-H680 VanDerWaalsContact C-N 3.31Å; D678-H680 PolarHBondContact O-N 3.11Å; H680-Q682 VanDerWaalsContact C-N 3.3Å; H680-Q682 PolarHBondContact O-N 3.46Å; H680-S700 PolarHBondContact O-OG 2.9Å
681	A	57.1	Low	71.6	Confident	78 Å²	78	59.3 Å²	59.3	65%	0.645	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-12.8	-174.2	0	0	0	0	0	113.7	D679	D679-A681 PolarHBondContact O-N 3.48Å
682	Q	71.1	Confident	70	Confident	93 Å²	93	65.3 Å²	65.3	44%	0.435	37%	0.368	S	S	.	.	S	Bend	trans	-127.1	8	-166.9	-55.2	-171.7	17	0	0	114.7	D679 H680 F684	D679-Q682 PolarHBondContact O-N 3.01Å; D679-Q682 VanDerWaalsContact O-N 3.15Å; H680-Q682 VanDerWaalsContact C-N 3.3Å; H680-Q682 PolarHBondContact O-N 3.46Å; Q682-F684 WeakPolarHBondContact O-CD2 3.13Å
683	L	87.9	Confident	68.6	Low	4 Å²	4	64 Å²	64	2%	0.021	37%	0.374	C	S	.	.			trans	-91.4	123.1	177.2	-55.5	-177.8	0	0	0	111.1	L659 L673 L677 I698 I699	L659-L683 VanDerWaalsContact C-CD2 3.48Å; L659-L683 HydrophobicContact CB-CD2 3.77Å; L673-L683 HydrophobicContact CB-CD1 4.44Å; L677-L683 HydrophobicContact CD1-CD1 4.42Å; L683-I698 CarbonylContact O-C 3.57Å; L683-I698 WeakPolarHBondContact O-CA 3.19Å; L683-I699 HydrophobicContact CB-CB 4.22Å; L683-I699 HydrophobicContact CB-CD1 3.78Å; L683-I699 HydrophobicContact CB-CG1 4.1Å; L683-I699 PolarHBondContact O-N 2.51Å
684	F	90.1	Very high	67.4	Low	89 Å²	89	73.1 Å²	73.1	39%	0.39	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	144.1	178.4	-64.8	-94.4	0	0	0	110.6	Q682 I697 I698	Q682-F684 WeakPolarHBondContact O-CD2 3.13Å; F684-I697 CarbonylContact C-O 3.54Å; F684-I697 VanDerWaalsContact CA-O 3.26Å; F684-I697 WeakPolarHBondContact CA-O 3.43Å; F684-I698 HydrophobicContact CD1-CG1 3.9Å; F684-I698 HydrophobicContact CE1-CD1 4.25Å; F684-I698 HydrophobicContact CE1-CG1 3.43Å; F684-I698 VanDerWaalsContact CE1-CG1 3.43Å; F684-I698 HydrophobicContact CZ-CG1 4Å
685	C	90.9	Very high	67.1	Low	1 Å²	1	78.4 Å²	78.4	1%	0.007	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	153.5	170	69.3	0	0	0	0	111.9	F664 C666 I670 S696 I697 I699	F664-C685 HydrophobicContact CB-CB 3.91Å; F664-C685 CarbonylContact O-C 3.55Å; F664-C685 WeakPolarHBondContact O-CA 3.39Å; C666-C685 HydrophobicContact CB-CB 4.02Å; C666-C685 WeakPolarHBondContact CB-SG 3.09Å; C666-C685 WeakPolarHBondContact SG-CB 3.36Å; C666-C685 PolarHBondContact SG-O 3.31Å; C666-C685 CovalentContact SG-SG 2.04Å; C666-C685 PolarHBondContact SG-SG 3.35Å; I670-C685 HydrophobicContact CD1-CB 3.89Å; C685-S696 CarbonylContact O-C 3.6Å; C685-S696 WeakPolarHBondContact O-CA 3.24Å; C685-I697 PolarHBondContact N-O 2.91Å; C685-I697 PolarHBondContact O-N 3.4Å; C685-I699 HydrophobicContact CB-CD1 4.22Å; C685-I699 HydrophobicContact CB-CG1 4.02Å
686	T	89.1	Confident	68	Low	59 Å²	59	79.7 Å²	79.7	36%	0.362	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	123.8	172.2	51.4	0	0	0	0	110.6	F664 Q665 C666 T688	F664-T686 PolarHBondContact O-N 3.1Å; F664-T686 PolarHBondContact O-OG1 2.93Å; Q665-T686 CarbonylContact C-O 3.56Å; Q665-T686 WeakPolarHBondContact CA-O 3.42Å; C666-T686 PolarHBondContact N-O 2.68Å; T686-T688 PolarHBondContact O-N 2.04Å
687	P	84.7	Confident	69.4	Low	11 Å²	11	76.6 Å²	76.6	7%	0.071	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	130.8	-178.4	-26.3	35.8	0	0	0	113.5	L690 K695 I697	P687-L690 HydrophobicContact CB-CB 4.35Å; P687-L690 HydrophobicContact CB-CD1 3.78Å; P687-L690 HydrophobicContact CB-CG 4.26Å; P687-L690 HydrophobicContact CG-CD1 3.98Å; P687-K695 WeakPolarHBondContact CD-O 3.36Å; P687-I697 HydrophobicContact CG-CD1 4.06Å; P687-I697 HydrophobicContact CG-CG1 4.28Å; P687-I697 HydrophobicContact CG-CG2 4.45Å
688	T	73.7	Confident	70.8	Confident	40 Å²	40	78 Å²	78	25%	0.245	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-31.1	178.5	-52.7	0	0	0	0	113.4	Q665 C666 T686 Y740	Q665-T688 WeakPolarHBondContact CG-OG1 3.44Å; Q665-T688 PolarHBondContact NE2-OG1 3.38Å; C666-T688 PolarHBondContact O-OG1 3Å; T686-T688 PolarHBondContact O-N 2.04Å; T688-Y740 HydrophobicContact CG2-CE1 4.33Å
689	A	65.1	Low	72.4	Confident	30 Å²	30	71.2 Å²	71.2	25%	0.248	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	7.8	-164.1	0	0	0	0	0	115.3	V708 Y740	A689-V708 HydrophobicContact CB-CG2 4.08Å; A689-Y740 HydrophobicContact CB-CD1 4.18Å; A689-Y740 HydrophobicContact CB-CD2 4.31Å; A689-Y740 HydrophobicContact CB-CE1 3.93Å; A689-Y740 HydrophobicContact CB-CE2 4.05Å; A689-Y740 HydrophobicContact CB-CG 4.36Å
690	L	59.7	Low	73.6	Confident	103 Å²	103	72.8 Å²	72.8	54%	0.539	39%	0.392	S	S	.	.			trans	-104.7	124.6	179.6	-73.5	166.7	0	0	0	110.1	P687 N692 A693	P687-L690 HydrophobicContact CB-CB 4.35Å; P687-L690 HydrophobicContact CB-CD1 3.78Å; P687-L690 HydrophobicContact CB-CG 4.26Å; P687-L690 HydrophobicContact CG-CD1 3.98Å; L690-N692 PolarHBondContact O-N 2.97Å; L690-A693 WeakPolarHBondContact O-CB 3.15Å; L690-A693 PolarHBondContact O-N 3.42Å; L690-A693 VanDerWaalsContact O-N 3.13Å
691	K	56	Low	74.9	Confident	185 Å²	185	78.3 Å²	78.3	80%	0.804	42%	0.415	S	S	*	.	S	Bend	trans	-53.6	-22.3	172.3	-72.4	-177.8	177.2	174.5	0	112.8
692	N	51	Low	76.1	Confident	144 Å²	144	75.3 Å²	75.3	77%	0.77	39%	0.39	S	S	*	.			trans	-101.7	56.6	173.5	-68.3	-5	0	0	0	111.7	L690 E694	L690-N692 PolarHBondContact O-N 2.97Å; N692-E694 PolarHBondContact O-N 3.2Å
693	A	56.4	Low	76.7	Confident	51 Å²	51	74.4 Å²	74.4	42%	0.421	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	7.2	-174	0	0	0	0	0	115.8	L690	L690-A693 WeakPolarHBondContact O-CB 3.15Å; L690-A693 PolarHBondContact O-N 3.42Å; L690-A693 VanDerWaalsContact O-N 3.13Å
694	E	59.1	Low	76.2	Confident	192 Å²	192	78.9 Å²	78.9	90%	0.897	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-19.2	-174.5	-66.8	-172.2	170.2	0	0	114.3	N692	N692-E694 PolarHBondContact O-N 3.2Å
695	K	73.6	Confident	75.7	Confident	173 Å²	173	80.2 Å²	80.2	75%	0.752	43%	0.427	S	S	*	.			trans	-94.1	113.3	-179.9	-70.4	-173.6	-179.8	-178.9	0	110.8	P687	P687-K695 WeakPolarHBondContact CD-O 3.36Å
696	S	83.3	Confident	75.4	Confident	68 Å²	68	81 Å²	81	48%	0.476	43%	0.433	S	S	.	.			trans	-66.4	145.1	166.7	55.9	0	0	0	0	110.6	C685	C685-S696 CarbonylContact O-C 3.6Å; C685-S696 WeakPolarHBondContact O-CA 3.24Å
697	I	86	Confident	75.4	Confident	50 Å²	50	78.7 Å²	78.7	26%	0.256	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	147.5	176.1	61.5	175.6	0	0	0	109.8	F684 C685 P687 I699 A702 A706	F684-I697 CarbonylContact C-O 3.54Å; F684-I697 VanDerWaalsContact CA-O 3.26Å; F684-I697 WeakPolarHBondContact CA-O 3.43Å; C685-I697 PolarHBondContact N-O 2.91Å; C685-I697 PolarHBondContact O-N 3.4Å; P687-I697 HydrophobicContact CG-CD1 4.06Å; P687-I697 HydrophobicContact CG-CG1 4.28Å; P687-I697 HydrophobicContact CG-CG2 4.45Å; I697-I699 PolarHBondContact O-N 3.42Å; I697-A702 HydrophobicContact CD1-CB 3.51Å; I697-A702 HydrophobicContact CG1-CB 4.15Å; I697-A706 HydrophobicContact CD1-CB 3.87Å
698	I	86.8	Confident	75.7	Confident	48 Å²	48	78.3 Å²	78.3	25%	0.246	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	123.1	174.3	-59.7	168.8	0	0	0	108.1	L683 F684 S700 K701 A702	L683-I698 CarbonylContact O-C 3.57Å; L683-I698 WeakPolarHBondContact O-CA 3.19Å; F684-I698 HydrophobicContact CD1-CG1 3.9Å; F684-I698 HydrophobicContact CE1-CD1 4.25Å; F684-I698 HydrophobicContact CE1-CG1 3.43Å; F684-I698 VanDerWaalsContact CE1-CG1 3.43Å; F684-I698 HydrophobicContact CZ-CG1 4Å; I698-S700 VanDerWaalsContact C-N 3.3Å; I698-S700 VanDerWaalsContact CG2-OG 3.31Å; I698-S700 WeakPolarHBondContact CG2-OG 3.47Å; I698-S700 PolarHBondContact O-N 3.09Å; I698-K701 HydrophobicContact CB-CB 4.4Å; I698-K701 HydrophobicContact CD1-CD 4.35Å; I698-K701 CarbonylContact O-C 3.28Å; I698-K701 PolarHBondContact O-N 2.76Å; I698-A702 PolarHBondContact O-N 2.78Å
699	I	87.3	Confident	76.5	Confident	1 Å²	1	77 Å²	77	1%	0.005	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-55.8	-42.8	-174.9	-65.2	-174.3	0	0	0	111.6	I670 L673 L683 C685 I697 K701 A702 F707	I670-I699 HydrophobicContact CD1-CD1 4.05Å; L673-I699 HydrophobicContact CB-CD1 4.39Å; L673-I699 HydrophobicContact CB-CG2 3.93Å; L673-I699 HydrophobicContact CD1-CD1 3.97Å; L683-I699 HydrophobicContact CB-CB 4.22Å; L683-I699 HydrophobicContact CB-CD1 3.78Å; L683-I699 HydrophobicContact CB-CG1 4.1Å; L683-I699 PolarHBondContact O-N 2.51Å; C685-I699 HydrophobicContact CB-CD1 4.22Å; C685-I699 HydrophobicContact CB-CG1 4.02Å; I697-I699 PolarHBondContact O-N 3.42Å; I699-K701 PolarHBondContact O-N 3.26Å; I699-A702 WeakPolarHBondContact O-CB 3.3Å; I699-A702 PolarHBondContact O-N 3.24Å; I699-A702 VanDerWaalsContact O-N 3.14Å; I699-F707 HydrophobicContact CB-CZ 4.24Å; I699-F707 HydrophobicContact CG1-CE1 4.49Å; I699-F707 HydrophobicContact CG2-CE1 3.98Å; I699-F707 HydrophobicContact CG2-CZ 3.59Å
700	S	81.3	Confident	77.6	Confident	54 Å²	54	78.8 Å²	78.8	38%	0.378	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-67.7	-20.4	179.7	54.4	0	0	0	0	114.4	H680 I698	H680-S700 PolarHBondContact O-OG 2.9Å; I698-S700 VanDerWaalsContact C-N 3.3Å; I698-S700 VanDerWaalsContact CG2-OG 3.31Å; I698-S700 WeakPolarHBondContact CG2-OG 3.47Å; I698-S700 PolarHBondContact O-N 3.09Å
701	K	83	Confident	79.1	Confident	171 Å²	171	74.7 Å²	74.7	74%	0.743	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-103.7	-3	174.1	-63.7	-176.6	-178.9	175.3	0	112.6	I698 I699	I698-K701 HydrophobicContact CB-CB 4.4Å; I698-K701 HydrophobicContact CD1-CD 4.35Å; I698-K701 CarbonylContact O-C 3.28Å; I698-K701 PolarHBondContact O-N 2.76Å; I699-K701 PolarHBondContact O-N 3.26Å
702	A	83	Confident	80.8	Confident	15 Å²	15	72.4 Å²	72.4	12%	0.124	40%	0.397	C	S	.	.	S	Bend	trans	-72.7	135	-179.2	0	0	0	0	0	109.5	I697 I698 I699 A706 F707	I697-A702 HydrophobicContact CD1-CB 3.51Å; I697-A702 HydrophobicContact CG1-CB 4.15Å; I698-A702 PolarHBondContact O-N 2.78Å; I699-A702 WeakPolarHBondContact O-CB 3.3Å; I699-A702 PolarHBondContact O-N 3.24Å; I699-A702 VanDerWaalsContact O-N 3.14Å; A702-A706 HydrophobicContact CB-CB 4.34Å; A702-F707 HydrophobicContact CB-CE2 3.69Å; A702-F707 HydrophobicContact CB-CZ 3.64Å
703	P	82	Confident	82.6	Confident	73 Å²	73	72.1 Å²	72.1	47%	0.474	39%	0.391	S	S	.	.			trans	-64.6	151.2	173.5	29.1	-33.9	0	0	0	109.9	E705 A706	P703-E705 WeakPolarHBondContact CB-OE2 3.22Å; P703-E705 PolarHBondContact O-N 2.72Å; P703-E705 VanDerWaalsContact O-N 3.1Å; P703-A706 HydrophobicContact CG-CB 4.09Å; P703-A706 VanDerWaalsContact O-CB 3.27Å; P703-A706 WeakPolarHBondContact O-CB 3.41Å; P703-A706 PolarHBondContact O-N 3.06Å
704	V	79.2	Confident	84.1	Confident	99 Å²	99	70.8 Å²	70.8	60%	0.6	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-56.1	-32.2	179.3	-179.5	0	0	0	0	110.7	A706 F707	V704-A706 PolarHBondContact O-N 3.2Å; V704-F707 PolarHBondContact O-N 3.17Å
705	E	79.3	Confident	85.5	Confident	117 Å²	117	63.4 Å²	63.4	55%	0.547	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-68.2	-9.5	177.2	-57.1	82.4	176.3	0	0	114.8	P703 V708 L747	P703-E705 WeakPolarHBondContact CB-OE2 3.22Å; P703-E705 PolarHBondContact O-N 2.72Å; P703-E705 VanDerWaalsContact O-N 3.1Å; E705-V708 WeakPolarHBondContact O-CG1 3.36Å; E705-L747 HydrophobicContact CB-CD2 3.82Å; E705-L747 HydrophobicContact CG-CD1 4.21Å; E705-L747 HydrophobicContact CG-CD2 3.93Å
706	A	84.8	Confident	85.8	Confident	17 Å²	17	57.7 Å²	57.7	14%	0.14	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-80.8	-23.5	173.1	0	0	0	0	0	113	C666 I697 A702 P703 V704 V708	C666-A706 WeakPolarHBondContact CB-O 3.35Å; I697-A706 HydrophobicContact CD1-CB 3.87Å; A702-A706 HydrophobicContact CB-CB 4.34Å; P703-A706 HydrophobicContact CG-CB 4.09Å; P703-A706 VanDerWaalsContact O-CB 3.27Å; P703-A706 WeakPolarHBondContact O-CB 3.41Å; P703-A706 PolarHBondContact O-N 3.06Å; V704-A706 PolarHBondContact O-N 3.2Å; A706-V708 PolarHBondContact O-N 3.46Å
707	F	89.4	Confident	85.5	Confident	10 Å²	10	61.3 Å²	61.3	4%	0.044	34%	0.341	C	S	.	.	S	Bend	trans	-93.1	77.4	-176.8	-61.1	-73	0	0	0	111	C666 D667 I670 I699 A702 V704	C666-F707 HydrophobicContact CB-CD1 4.28Å; C666-F707 HydrophobicContact CB-CE1 4.46Å; D667-F707 WeakPolarHBondContact O-CB 3.1Å; I670-F707 HydrophobicContact CD1-CD1 4.45Å; I670-F707 HydrophobicContact CD1-CE1 4.22Å; I670-F707 HydrophobicContact CG1-CD1 3.95Å; I670-F707 HydrophobicContact CG1-CE1 4.11Å; I699-F707 HydrophobicContact CB-CZ 4.24Å; I699-F707 HydrophobicContact CG1-CE1 4.49Å; I699-F707 HydrophobicContact CG2-CE1 3.98Å; I699-F707 HydrophobicContact CG2-CZ 3.59Å; A702-F707 HydrophobicContact CB-CE2 3.69Å; A702-F707 HydrophobicContact CB-CZ 3.64Å; V704-F707 PolarHBondContact O-N 3.17Å
708	V	89.6	Confident	85.3	Confident	4 Å²	4	66.1 Å²	66.1	2%	0.024	37%	0.367	C	S	.	.			trans	-125.9	143.4	-174.2	-60.8	0	0	0	0	112.5	D667 A689 E705 A706 Y740 H741 L747	D667-V708 WeakPolarHBondContact CA-O 3.45Å; A689-V708 HydrophobicContact CB-CG2 4.08Å; E705-V708 WeakPolarHBondContact O-CG1 3.36Å; A706-V708 PolarHBondContact O-N 3.46Å; V708-Y740 HydrophobicContact CG2-CD1 3.96Å; V708-Y740 HydrophobicContact CG2-CG 4.08Å; V708-H741 CarbonylContact C-O 3.55Å; V708-H741 VanDerWaalsContact CA-O 3.31Å; V708-H741 WeakPolarHBondContact CA-O 3.31Å; V708-L747 HydrophobicContact CG1-CD2 3.63Å
709	C	90.6	Very high	85.3	Confident	11 Å²	11	64.4 Å²	64.4	7%	0.074	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	136.1	174.2	-74	0	0	0	0	110.4	C668 Y669 Y740 H741	C668-C709 HydrophobicContact CB-CB 3.88Å; C668-C709 WeakPolarHBondContact CB-SG 3.38Å; C668-C709 PolarHBondContact N-SG 3.38Å; C668-C709 WeakPolarHBondContact SG-CB 3.25Å; C668-C709 CovalentContact SG-SG 2.03Å; C668-C709 PolarHBondContact SG-SG 3.26Å; Y669-C709 VanDerWaalsContact CE2-SG 3.54Å; C709-Y740 CarbonylContact O-C 3.14Å; C709-Y740 WeakPolarHBondContact O-CA 3.26Å; C709-H741 PolarHBondContact N-O 2.96Å; C709-H741 PolarHBondContact O-N 2.88Å
710	A	89.5	Confident	85.2	Confident	69 Å²	69	70.4 Å²	70.4	57%	0.57	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.5	143.4	169.8	0	0	0	0	0	110	C739 Y740	A710-C739 WeakPolarHBondContact CA-O 3.12Å; A710-Y740 HydrophobicContact CB-CD1 4.01Å; A710-Y740 HydrophobicContact CB-CE1 3.89Å
711	Y	90.9	Very high	85.5	Confident	16 Å²	16	69.7 Å²	69.7	6%	0.063	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	147.5	178.3	73.3	-92.8	0	0	0	111.7	F714 C733 C739 H741 N748	Y711-F714 AromaticContact CD1-CD1 3.95Å; Y711-F714 HydrophobicContact CD1-CD1 3.95Å; Y711-F714 HydrophobicContact CD1-CE1 4.16Å; Y711-F714 AromaticContact CD2-CD1 3.56Å; Y711-F714 HydrophobicContact CD2-CD1 3.56Å; Y711-F714 HydrophobicContact CD2-CE1 4.23Å; Y711-F714 AromaticContact CE1-CD1 3.88Å; Y711-F714 HydrophobicContact CE1-CD1 3.88Å; Y711-F714 AromaticContact CE1-CE1 3.65Å; Y711-F714 HydrophobicContact CE1-CE1 3.65Å; Y711-F714 AromaticContact CE2-CD1 3.53Å; Y711-F714 HydrophobicContact CE2-CD1 3.53Å; Y711-F714 AromaticContact CE2-CE1 3.78Å; Y711-F714 HydrophobicContact CE2-CE1 3.78Å; Y711-F714 AromaticContact CG-CD1 3.77Å; Y711-F714 HydrophobicContact CG-CD1 3.77Å; Y711-F714 HydrophobicContact CG-CE1 4.4Å; Y711-F714 AromaticContact CZ-CD1 3.67Å; Y711-F714 AromaticContact CZ-CE1 3.45Å; Y711-F714 VanDerWaalsContact CZ-CE1 3.45Å; Y711-C733 HydrophobicContact CD2-CB 4.45Å; Y711-C733 HydrophobicContact CE2-CB 4.18Å; Y711-C733 WeakPolarHBondContact O-CB 3.47Å; Y711-C739 HydrophobicContact CD1-CB 3.96Å; Y711-C739 WeakPolarHBondContact CD1-O 3.48Å; Y711-C739 HydrophobicContact CD2-CB 4.26Å; Y711-C739 HydrophobicContact CE1-CB 3.41Å; Y711-C739 VanDerWaalsContact CE1-CB 3.41Å; Y711-C739 HydrophobicContact CE2-CB 3.71Å; Y711-C739 HydrophobicContact CG-CB 4.38Å; Y711-C739 PolarHBondContact N-O 3.41Å; Y711-C739 WeakPolarHBondContact OH-CB 3.5Å; Y711-H741 HydrophobicContact CD1-CB 4.17Å; Y711-H741 AromaticContact CD1-CD2 3.44Å; Y711-H741 VanDerWaalsContact CD1-CD2 3.44Å; Y711-H741 WeakPolarHBondContact CD1-CD2 3.21Å; Y711-H741 HydrophobicContact CE1-CB 4.13Å; Y711-H741 AromaticContact CG-CD2 3.87Å; Y711-N748 PolarHBondContact OH-ND2 2.88Å; Y711-N748 PolarHBondContact OH-OD1 3.3Å
712	D	90.7	Very high	85.5	Confident	137 Å²	137	63.8 Å²	63.8	73%	0.733	37%	0.372	S	S	*	.	S	Bend	trans	-93.7	-39.5	169.1	-61.9	-36.1	0	0	0	111.1	C733	D712-C733 WeakPolarHBondContact O-CB 3.24Å; D712-C733 PolarHBondContact O-N 3.45Å
713	H	88.9	Confident	85.4	Confident	139 Å²	139	71.8 Å²	71.8	64%	0.644	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.8	146.6	170.1	80.3	-72.3	0	0	0	110.6	S731	H713-S731 CarbonylContact C-O 3.5Å; H713-S731 WeakPolarHBondContact CA-O 3.41Å
714	F	88.9	Confident	85.4	Confident	22 Å²	22	74.9 Å²	74.9	10%	0.096	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	155.8	164.8	80.4	-94.4	0	0	0	110.7	Y711 N730 S731 H741 L745	Y711-F714 AromaticContact CD1-CD1 3.95Å; Y711-F714 HydrophobicContact CD1-CD1 3.95Å; Y711-F714 HydrophobicContact CD1-CE1 4.16Å; Y711-F714 AromaticContact CD2-CD1 3.56Å; Y711-F714 HydrophobicContact CD2-CD1 3.56Å; Y711-F714 HydrophobicContact CD2-CE1 4.23Å; Y711-F714 AromaticContact CE1-CD1 3.88Å; Y711-F714 HydrophobicContact CE1-CD1 3.88Å; Y711-F714 AromaticContact CE1-CE1 3.65Å; Y711-F714 HydrophobicContact CE1-CE1 3.65Å; Y711-F714 AromaticContact CE2-CD1 3.53Å; Y711-F714 HydrophobicContact CE2-CD1 3.53Å; Y711-F714 AromaticContact CE2-CE1 3.78Å; Y711-F714 HydrophobicContact CE2-CE1 3.78Å; Y711-F714 AromaticContact CG-CD1 3.77Å; Y711-F714 HydrophobicContact CG-CD1 3.77Å; Y711-F714 HydrophobicContact CG-CE1 4.4Å; Y711-F714 AromaticContact CZ-CD1 3.67Å; Y711-F714 AromaticContact CZ-CE1 3.45Å; Y711-F714 VanDerWaalsContact CZ-CE1 3.45Å; F714-N730 PolarHBondContact O-OD1 3.24Å; F714-S731 VanDerWaalsContact CE1-CB 3.45Å; F714-S731 PolarHBondContact N-O 2.98Å; F714-S731 PolarHBondContact O-N 2.7Å; F714-H741 AromaticContact CD1-CD2 3.86Å; F714-H741 HydrophobicContact CE1-CB 4.11Å; F714-H741 HydrophobicContact CZ-CB 4.49Å; F714-L745 HydrophobicContact CD2-CD1 4.18Å; F714-L745 HydrophobicContact CD2-CD2 3.96Å; F714-L745 HydrophobicContact CE2-CD1 3.94Å; F714-L745 HydrophobicContact CE2-CD2 3.66Å; F714-L745 HydrophobicContact CE2-CG 4.28Å; F714-L745 HydrophobicContact CZ-CD2 4.03Å
715	C	86.7	Confident	84.9	Confident	37 Å²	37	77.4 Å²	77.4	25%	0.25	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	144.3	173.9	-164.5	0	0	0	0	110	C719 C722	C715-C719 VanDerWaalsContact SG-CB 3.52Å; C715-C719 PolarHBondContact SG-SG 2.87Å; C715-C722 HydrophobicContact CB-CB 3.74Å; C715-C722 WeakPolarHBondContact CB-SG 3.43Å; C715-C722 WeakPolarHBondContact SG-CA 3.49Å; C715-C722 WeakPolarHBondContact SG-CB 3.3Å; C715-C722 CovalentContact SG-SG 2.03Å; C715-C722 PolarHBondContact SG-SG 2.94Å
716	M	81	Confident	84.6	Confident	53 Å²	53	77.2 Å²	77.2	26%	0.261	44%	0.435	S	S	.	.			trans	-66.7	144.3	177.2	-60.4	-168.7	-47.8	0	0	110.5	D718 C719 C729 L745 L765	M716-D718 PolarHBondContact O-N 3.07Å; M716-D718 VanDerWaalsContact O-N 3.13Å; M716-C719 HydrophobicContact CB-CB 4.3Å; M716-C719 VanDerWaalsContact O-CB 3.26Å; M716-C719 WeakPolarHBondContact O-CB 3.25Å; M716-C719 PolarHBondContact O-N 2.96Å; M716-C729 HydrophobicContact CE-CB 4.19Å; M716-L745 HydrophobicContact CG-CD1 4.11Å; M716-L765 HydrophobicContact CG-CD1 4.05Å; M716-L765 HydrophobicContact SD-CD1 4.05Å
717	V	77.9	Confident	84.6	Confident	145 Å²	145	76.8 Å²	76.8	88%	0.879	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-35	-177.8	-177.6	0	0	0	0	112.6
718	D	81.9	Confident	84.2	Confident	151 Å²	151	81 Å²	81	81%	0.807	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	10.9	-178.6	-59.3	-34.1	0	0	0	114	M716 P720	M716-D718 PolarHBondContact O-N 3.07Å; M716-D718 VanDerWaalsContact O-N 3.13Å; D718-P720 WeakPolarHBondContact O-CD 2.99Å
719	C	84.8	Confident	83.8	Confident	12 Å²	12	81.9 Å²	81.9	8%	0.081	46%	0.46	C	S	.	.			trans	-81.3	115.9	-178	173.9	0	0	0	0	110.9	C715 M716 C721 C722 C727 C729	C715-C719 VanDerWaalsContact SG-CB 3.52Å; C715-C719 PolarHBondContact SG-SG 2.87Å; M716-C719 HydrophobicContact CB-CB 4.3Å; M716-C719 VanDerWaalsContact O-CB 3.26Å; M716-C719 WeakPolarHBondContact O-CB 3.25Å; M716-C719 PolarHBondContact O-N 2.96Å; C719-C721 PolarHBondContact O-N 3.36Å; C719-C721 VanDerWaalsContact O-N 3.16Å; C719-C722 WeakPolarHBondContact CB-SG 3.47Å; C719-C722 PolarHBondContact O-SG 3.14Å; C719-C722 VanDerWaalsContact O-SG 3.37Å; C719-C727 PolarHBondContact SG-SG 2.8Å; C719-C729 HydrophobicContact CB-CB 3.66Å; C719-C729 WeakPolarHBondContact CB-SG 3.16Å; C719-C729 WeakPolarHBondContact SG-CB 3.44Å; C719-C729 CovalentContact SG-SG 2.04Å; C719-C729 PolarHBondContact SG-SG 3.39Å
720	P	85.5	Confident	83.5	Confident	127 Å²	127	82.5 Å²	82.5	83%	0.825	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-6.3	-172.6	30.8	-36.3	0	0	0	114	D718	D718-P720 WeakPolarHBondContact O-CD 2.99Å
721	C	88.5	Confident	83.5	Confident	38 Å²	38	79.2 Å²	79.2	26%	0.257	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.9	18.8	-173.9	58.1	0	0	0	0	114.6	C719 E723 F724 C727	C719-C721 PolarHBondContact O-N 3.36Å; C719-C721 VanDerWaalsContact O-N 3.16Å; C721-E723 PolarHBondContact O-N 3.03Å; C721-F724 HydrophobicContact CB-CD2 3.89Å; C721-F724 PolarHBondContact O-N 2.68Å; C721-C727 HydrophobicContact CB-CB 3.76Å; C721-C727 WeakPolarHBondContact CB-SG 3.49Å; C721-C727 WeakPolarHBondContact O-CB 3.47Å; C721-C727 PolarHBondContact O-SG 2.62Å; C721-C727 WeakPolarHBondContact SG-CB 3.23Å; C721-C727 CovalentContact SG-SG 2.04Å; C721-C727 PolarHBondContact SG-SG 2.78Å
722	C	82.4	Confident	83.4	Confident	47 Å²	47	82 Å²	82	32%	0.318	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-24	-174.3	-69.4	0	0	0	0	115.3	C715 C719 F724	C715-C722 HydrophobicContact CB-CB 3.74Å; C715-C722 WeakPolarHBondContact CB-SG 3.43Å; C715-C722 WeakPolarHBondContact SG-CA 3.49Å; C715-C722 WeakPolarHBondContact SG-CB 3.3Å; C715-C722 CovalentContact SG-SG 2.03Å; C715-C722 PolarHBondContact SG-SG 2.94Å; C719-C722 WeakPolarHBondContact CB-SG 3.47Å; C719-C722 PolarHBondContact O-SG 3.14Å; C719-C722 VanDerWaalsContact O-SG 3.37Å; C722-F724 VanDerWaalsContact C-N 3.3Å
723	E	81.3	Confident	83.5	Confident	184 Å²	184	76.3 Å²	76.3	86%	0.86	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-11.2	178.4	-60.5	-174.8	170.1	0	0	113.8	C721	C721-E723 PolarHBondContact O-N 3.03Å
724	F	81.2	Confident	83.6	Confident	138 Å²	138	70.6 Å²	70.6	61%	0.605	40%	0.4	S	S	*	.			trans	-102.8	130.9	-177.9	-58.7	-78.7	0	0	0	111.7	C721 C722 S726 C727	C721-F724 HydrophobicContact CB-CD2 3.89Å; C721-F724 PolarHBondContact O-N 2.68Å; C722-F724 VanDerWaalsContact C-N 3.3Å; F724-S726 VanDerWaalsContact C-N 3.25Å; F724-S726 PolarHBondContact O-N 2.97Å; F724-C727 HydrophobicContact CB-CB 4.36Å; F724-C727 WeakPolarHBondContact O-CB 3.25Å; F724-C727 PolarHBondContact O-N 3.44Å; F724-C727 VanDerWaalsContact O-N 3.08Å
725	D	70.2	Confident	83.4	Confident	152 Å²	152	73.5 Å²	73.5	81%	0.813	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-32.1	178.3	-67.6	-27.3	0	0	0	113.2	C727	D725-C727 PolarHBondContact O-N 3.43Å
726	S	72.7	Confident	83.4	Confident	113 Å²	113	78.2 Å²	78.2	79%	0.79	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	9.3	178.4	-52.4	0	0	0	0	113.6	F724 D728	F724-S726 VanDerWaalsContact C-N 3.25Å; F724-S726 PolarHBondContact O-N 2.97Å; S726-D728 PolarHBondContact O-N 2.92Å
727	C	84	Confident	83.8	Confident	8 Å²	8	76.5 Å²	76.5	5%	0.054	44%	0.443	C	S	.	.			trans	-79	117.8	-176.9	179.6	0	0	0	0	111.4	C719 C721 F724 D725 C729 N730	C719-C727 PolarHBondContact SG-SG 2.8Å; C721-C727 HydrophobicContact CB-CB 3.76Å; C721-C727 WeakPolarHBondContact CB-SG 3.49Å; C721-C727 WeakPolarHBondContact O-CB 3.47Å; C721-C727 PolarHBondContact O-SG 2.62Å; C721-C727 WeakPolarHBondContact SG-CB 3.23Å; C721-C727 CovalentContact SG-SG 2.04Å; C721-C727 PolarHBondContact SG-SG 2.78Å; F724-C727 HydrophobicContact CB-CB 4.36Å; F724-C727 WeakPolarHBondContact O-CB 3.25Å; F724-C727 PolarHBondContact O-N 3.44Å; F724-C727 VanDerWaalsContact O-N 3.08Å; D725-C727 PolarHBondContact O-N 3.43Å; C727-C729 PolarHBondContact O-N 2.64Å; C727-C729 VanDerWaalsContact O-N 3.08Å; C727-C729 PolarHBondContact SG-SG 3.23Å; C727-N730 HydrophobicContact CB-CB 3.97Å; C727-N730 WeakPolarHBondContact O-CB 3.3Å; C727-N730 PolarHBondContact O-N 3.49Å
728	D	80.6	Confident	84.4	Confident	99 Å²	99	72.5 Å²	72.5	53%	0.529	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-24.7	-179.2	-66	-3.6	0	0	0	114.2	S726 M764	S726-D728 PolarHBondContact O-N 2.92Å; D728-M764 HydrophobicContact CB-CE 3.72Å; D728-M764 HydrophobicContact CB-SD 3.6Å; D728-M764 VanDerWaalsContact OD2-CE 3.3Å; D728-M764 WeakPolarHBondContact OD2-CE 3.27Å
729	C	81.3	Confident	84.9	Confident	22 Å²	22	65.4 Å²	65.4	15%	0.149	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-1.9	175.8	42.8	0	0	0	0	114.7	M716 C719 C727	M716-C729 HydrophobicContact CE-CB 4.19Å; C719-C729 HydrophobicContact CB-CB 3.66Å; C719-C729 WeakPolarHBondContact CB-SG 3.16Å; C719-C729 WeakPolarHBondContact SG-CB 3.44Å; C719-C729 CovalentContact SG-SG 2.04Å; C719-C729 PolarHBondContact SG-SG 3.39Å; C727-C729 PolarHBondContact O-N 2.64Å; C727-C729 VanDerWaalsContact O-N 3.08Å; C727-C729 PolarHBondContact SG-SG 3.23Å
730	N	85.7	Confident	85.3	Confident	24 Å²	24	66.3 Å²	66.3	13%	0.128	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	116.9	168	-171.5	14.9	0	0	0	109.7	F714 C727	F714-N730 PolarHBondContact O-OD1 3.24Å; C727-N730 HydrophobicContact CB-CB 3.97Å; C727-N730 WeakPolarHBondContact O-CB 3.3Å; C727-N730 PolarHBondContact O-N 3.49Å
731	S	88.5	Confident	85.5	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	98.4	-179.3	-67.1	0	0	0	0	110	H713 F714	H713-S731 CarbonylContact C-O 3.5Å; H713-S731 WeakPolarHBondContact CA-O 3.41Å; F714-S731 VanDerWaalsContact CE1-CB 3.45Å; F714-S731 PolarHBondContact N-O 2.98Å; F714-S731 PolarHBondContact O-N 2.7Å
732	V	90	Very high	85.6	Confident	74 Å²	74	60.2 Å²	60.2	45%	0.448	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	124	173.9	-177.2	0	0	0	0	109.3	P763	V732-P763 WeakPolarHBondContact O-CG 3.1Å
733	C	91.9	Very high	85.6	Confident	17 Å²	17	61.5 Å²	61.5	12%	0.115	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-70.4	126.8	174.3	-165.9	0	0	0	0	109.6	Y711 D712 C739	Y711-C733 HydrophobicContact CD2-CB 4.45Å; Y711-C733 HydrophobicContact CE2-CB 4.18Å; Y711-C733 WeakPolarHBondContact O-CB 3.47Å; D712-C733 WeakPolarHBondContact O-CB 3.24Å; D712-C733 PolarHBondContact O-N 3.45Å; C733-C739 WeakPolarHBondContact CA-SG 3.37Å; C733-C739 HydrophobicContact CB-CB 3.66Å; C733-C739 WeakPolarHBondContact CB-SG 3.36Å; C733-C739 WeakPolarHBondContact SG-CB 3.39Å; C733-C739 PolarHBondContact SG-N 3.03Å; C733-C739 VanDerWaalsContact SG-N 3.35Å; C733-C739 CovalentContact SG-SG 2.04Å; C733-C739 PolarHBondContact SG-SG 3.14Å
734	P	90.2	Very high	85.8	Confident	20 Å²	20	57.3 Å²	57.3	13%	0.13	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-62.3	149.3	176.1	-18.5	30.2	0	0	0	111.3	C737 V757 V762	P734-C737 HydrophobicContact CB-CB 4.36Å; P734-C737 HydrophobicContact CG-CB 4.49Å; P734-C737 WeakPolarHBondContact O-CB 3.28Å; P734-C737 PolarHBondContact O-N 3.28Å; P734-C737 VanDerWaalsContact O-N 3.16Å; P734-V757 HydrophobicContact CB-CG1 3.88Å; P734-V757 HydrophobicContact CB-CG2 4.15Å; P734-V757 HydrophobicContact CG-CG1 4.03Å; P734-V762 HydrophobicContact CG-CG2 4.46Å
735	A	85.6	Confident	85.9	Confident	82 Å²	82	53 Å²	53	68%	0.678	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	143.1	167	0	0	0	0	0	109.9	C737	A735-C737 PolarHBondContact O-N 3.2Å
736	D	85.7	Confident	86.6	Confident	137 Å²	137	49.8 Å²	49.8	73%	0.733	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.5	2.2	-176	-49.9	-41.2	0	0	0	116.3	A755	D736-A755 HydrophobicContact CB-CB 3.57Å
737	C	90.4	Very high	87.4	Confident	17 Å²	17	45.5 Å²	45.5	12%	0.115	28%	0.281	C	S	.	.			trans	-100.9	157.6	170.4	-57.6	0	0	0	0	111.9	P734 A735 V750 V751 C752	P734-C737 HydrophobicContact CB-CB 4.36Å; P734-C737 HydrophobicContact CG-CB 4.49Å; P734-C737 WeakPolarHBondContact O-CB 3.28Å; P734-C737 PolarHBondContact O-N 3.28Å; P734-C737 VanDerWaalsContact O-N 3.16Å; A735-C737 PolarHBondContact O-N 3.2Å; C737-V750 HydrophobicContact CB-CG1 4.35Å; C737-V751 CarbonylContact C-O 3.58Å; C737-V751 VanDerWaalsContact CA-O 3.28Å; C737-V751 WeakPolarHBondContact CA-O 3.27Å; C737-C752 HydrophobicContact CB-CB 4.12Å; C737-C752 WeakPolarHBondContact CB-SG 3.43Å; C737-C752 WeakPolarHBondContact SG-CB 3.29Å; C737-C752 CovalentContact SG-SG 2.03Å; C737-C752 PolarHBondContact SG-SG 2.83Å
738	S	90.7	Very high	87.8	Confident	60 Å²	60	45.2 Å²	45.2	42%	0.42	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	114.3	165.7	-57.5	0	0	0	0	108.9	V751	S738-V751 PolarHBondContact N-O 2.85Å; S738-V751 PolarHBondContact O-N 3.38Å
739	C	92.4	Very high	88.3	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.014	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	140.8	-178.9	-51.1	0	0	0	0	111.2	A710 Y711 C733 K749	A710-C739 WeakPolarHBondContact CA-O 3.12Å; Y711-C739 HydrophobicContact CD1-CB 3.96Å; Y711-C739 WeakPolarHBondContact CD1-O 3.48Å; Y711-C739 HydrophobicContact CD2-CB 4.26Å; Y711-C739 HydrophobicContact CE1-CB 3.41Å; Y711-C739 VanDerWaalsContact CE1-CB 3.41Å; Y711-C739 HydrophobicContact CE2-CB 3.71Å; Y711-C739 HydrophobicContact CG-CB 4.38Å; Y711-C739 PolarHBondContact N-O 3.41Å; Y711-C739 WeakPolarHBondContact OH-CB 3.5Å; C733-C739 WeakPolarHBondContact CA-SG 3.37Å; C733-C739 HydrophobicContact CB-CB 3.66Å; C733-C739 WeakPolarHBondContact CB-SG 3.36Å; C733-C739 WeakPolarHBondContact SG-CB 3.39Å; C733-C739 PolarHBondContact SG-N 3.03Å; C733-C739 VanDerWaalsContact SG-N 3.35Å; C733-C739 CovalentContact SG-SG 2.04Å; C733-C739 PolarHBondContact SG-SG 3.14Å; C739-K749 CarbonylContact C-O 3.6Å; C739-K749 WeakPolarHBondContact CA-O 3.29Å
740	Y	91.7	Very high	88.9	Confident	31 Å²	31	40.8 Å²	40.8	12%	0.122	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	139.4	-175.6	-54.5	-88	0	0	0	111.3	T688 A689 V708 C709 A710 N748 K749 V751	T688-Y740 HydrophobicContact CG2-CE1 4.33Å; A689-Y740 HydrophobicContact CB-CD1 4.18Å; A689-Y740 HydrophobicContact CB-CD2 4.31Å; A689-Y740 HydrophobicContact CB-CE1 3.93Å; A689-Y740 HydrophobicContact CB-CE2 4.05Å; A689-Y740 HydrophobicContact CB-CG 4.36Å; V708-Y740 HydrophobicContact CG2-CD1 3.96Å; V708-Y740 HydrophobicContact CG2-CG 4.08Å; C709-Y740 CarbonylContact O-C 3.14Å; C709-Y740 WeakPolarHBondContact O-CA 3.26Å; A710-Y740 HydrophobicContact CB-CD1 4.01Å; A710-Y740 HydrophobicContact CB-CE1 3.89Å; Y740-N748 CarbonylContact O-C 3.55Å; Y740-N748 WeakPolarHBondContact O-CA 3.47Å; Y740-K749 PolarHBondContact N-O 3.31Å; Y740-K749 PolarHBondContact O-N 2.84Å; Y740-V751 HydrophobicContact CE2-CG2 4.36Å
741	H	91.4	Very high	89.1	Confident	32 Å²	32	41 Å²	41	15%	0.148	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	152.9	172.7	72.8	75.9	0	0	0	111.2	V708 C709 Y711 F714 L745 L747	V708-H741 CarbonylContact C-O 3.55Å; V708-H741 VanDerWaalsContact CA-O 3.31Å; V708-H741 WeakPolarHBondContact CA-O 3.31Å; C709-H741 PolarHBondContact N-O 2.96Å; C709-H741 PolarHBondContact O-N 2.88Å; Y711-H741 HydrophobicContact CD1-CB 4.17Å; Y711-H741 AromaticContact CD1-CD2 3.44Å; Y711-H741 VanDerWaalsContact CD1-CD2 3.44Å; Y711-H741 WeakPolarHBondContact CD1-CD2 3.21Å; Y711-H741 HydrophobicContact CE1-CB 4.13Å; Y711-H741 AromaticContact CG-CD2 3.87Å; F714-H741 AromaticContact CD1-CD2 3.86Å; F714-H741 HydrophobicContact CE1-CB 4.11Å; F714-H741 HydrophobicContact CZ-CB 4.49Å; H741-L745 HydrophobicContact CB-CD2 3.98Å; H741-L745 WeakPolarHBondContact ND1-CD2 3.23Å; H741-L747 VanDerWaalsContact CA-O 3.31Å; H741-L747 WeakPolarHBondContact CA-O 3.37Å
742	D	88.9	Confident	89.1	Confident	6 Å²	6	41 Å²	41	3%	0.032	25%	0.254	C	S	.	.			trans	-83	172.7	167.8	77.2	-51.1	0	0	0	111.2	T744 L745 T746 L747	D742-T744 VanDerWaalsContact C-N 3.26Å; D742-T744 PolarHBondContact O-N 3.44Å; D742-T744 WeakPolarHBondContact OD2-CB 3.32Å; D742-T744 PolarHBondContact OD2-N 3.28Å; D742-T744 VanDerWaalsContact OD2-N 3.09Å; D742-T744 PolarHBondContact OD2-OG1 2.97Å; D742-L745 PolarHBondContact O-N 2.77Å; D742-L745 VanDerWaalsContact OD1-CA 3.24Å; D742-L745 WeakPolarHBondContact OD1-CA 3.5Å; D742-L745 PolarHBondContact OD1-N 3.35Å; D742-T746 PolarHBondContact OD1-N 2.7Å; D742-T746 PolarHBondContact OD2-OG1 3.41Å; D742-L747 HydrophobicContact CB-CB 4.07Å; D742-L747 PolarHBondContact N-O 2.9Å; D742-L747 VanDerWaalsContact N-O 3.15Å; D742-L747 PolarHBondContact OD1-N 3.1Å; D742-L747 VanDerWaalsContact OD1-O 3.14Å
743	A	84	Confident	88.6	Confident	73 Å²	73	39.2 Å²	39.2	60%	0.603	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-27.8	-179.3	0	0	0	0	0	113.7	C668	C668-A743 HydrophobicContact CB-CB 4.33Å
744	T	83.8	Confident	87.9	Confident	96 Å²	96	42.1 Å²	42.1	59%	0.589	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-1.2	-178.6	68.8	0	0	0	0	113.8	D742 T746	D742-T744 VanDerWaalsContact C-N 3.26Å; D742-T744 PolarHBondContact O-N 3.44Å; D742-T744 WeakPolarHBondContact OD2-CB 3.32Å; D742-T744 PolarHBondContact OD2-N 3.28Å; D742-T744 VanDerWaalsContact OD2-N 3.09Å; D742-T744 PolarHBondContact OD2-OG1 2.97Å; T744-T746 PolarHBondContact O-N 3.43Å; T744-T746 WeakPolarHBondContact OG1-CG2 3.5Å; T744-T746 PolarHBondContact OG1-OG1 2.88Å
745	L	84.3	Confident	87.2	Confident	48 Å²	48	41.5 Å²	41.5	25%	0.251	27%	0.267	S	S	.	.	S	Bend	trans	56.4	25	-174.6	-51.7	175.8	0	0	0	113.3	F714 M716 H741 D742	F714-L745 HydrophobicContact CD2-CD1 4.18Å; F714-L745 HydrophobicContact CD2-CD2 3.96Å; F714-L745 HydrophobicContact CE2-CD1 3.94Å; F714-L745 HydrophobicContact CE2-CD2 3.66Å; F714-L745 HydrophobicContact CE2-CG 4.28Å; F714-L745 HydrophobicContact CZ-CD2 4.03Å; M716-L745 HydrophobicContact CG-CD1 4.11Å; H741-L745 HydrophobicContact CB-CD2 3.98Å; H741-L745 WeakPolarHBondContact ND1-CD2 3.23Å; D742-L745 PolarHBondContact O-N 2.77Å; D742-L745 VanDerWaalsContact OD1-CA 3.24Å; D742-L745 WeakPolarHBondContact OD1-CA 3.5Å; D742-L745 PolarHBondContact OD1-N 3.35Å
746	T	85.2	Confident	86.8	Confident	84 Å²	84	46.3 Å²	46.3	52%	0.515	28%	0.275	S	S	.	.	S	Bend	trans	-86.1	-25.7	174.4	61	0	0	0	0	112.1	D742 T744 T767	D742-T746 PolarHBondContact OD1-N 2.7Å; D742-T746 PolarHBondContact OD2-OG1 3.41Å; T744-T746 PolarHBondContact O-N 3.43Å; T744-T746 WeakPolarHBondContact OG1-CG2 3.5Å; T744-T746 PolarHBondContact OG1-OG1 2.88Å; T746-T767 WeakPolarHBondContact O-CG2 3.28Å
747	L	89.8	Confident	86.6	Confident	23 Å²	23	40.3 Å²	40.3	12%	0.12	24%	0.244	C	C	.	.			trans	-110.7	124.2	170.7	178.7	76.1	0	0	0	108.5	E705 V708 H741 D742	E705-L747 HydrophobicContact CB-CD2 3.82Å; E705-L747 HydrophobicContact CG-CD1 4.21Å; E705-L747 HydrophobicContact CG-CD2 3.93Å; V708-L747 HydrophobicContact CG1-CD2 3.63Å; H741-L747 VanDerWaalsContact CA-O 3.31Å; H741-L747 WeakPolarHBondContact CA-O 3.37Å; D742-L747 HydrophobicContact CB-CB 4.07Å; D742-L747 PolarHBondContact N-O 2.9Å; D742-L747 VanDerWaalsContact N-O 3.15Å; D742-L747 PolarHBondContact OD1-N 3.1Å; D742-L747 VanDerWaalsContact OD1-O 3.14Å
748	N	91.8	Very high	86.2	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.011	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	109.7	169.7	-177.1	-17.1	0	0	0	107.8	Y711 Y740 T767 E768	Y711-N748 PolarHBondContact OH-ND2 2.88Å; Y711-N748 PolarHBondContact OH-OD1 3.3Å; Y740-N748 CarbonylContact O-C 3.55Å; Y740-N748 WeakPolarHBondContact O-CA 3.47Å; N748-T767 PolarHBondContact N-OG1 2.98Å; N748-T767 PolarHBondContact O-N 3.07Å; N748-T767 PolarHBondContact O-OG1 3.08Å; N748-E768 PolarHBondContact O-N 2.78Å; N748-E768 VanDerWaalsContact O-N 3.11Å
749	K	91.6	Very high	86	Confident	29 Å²	29	40.9 Å²	40.9	13%	0.126	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	126.2	-174.4	176.7	175	180	167.4	0	109.7	C739 Y740 V751 E768	C739-K749 CarbonylContact C-O 3.6Å; C739-K749 WeakPolarHBondContact CA-O 3.29Å; Y740-K749 PolarHBondContact N-O 3.31Å; Y740-K749 PolarHBondContact O-N 2.84Å; K749-V751 HydrophobicContact CD-CG2 4.3Å; K749-V751 HydrophobicContact CG-CG2 4.01Å; K749-E768 WeakPolarHBondContact CA-O 3.35Å; K749-E768 HydrophobicContact CB-CB 4.31Å; K749-E768 WeakPolarHBondContact CE-OE1 3.32Å; K749-E768 HydrophobicContact CG-CB 4.2Å; K749-E768 HydrophobicContact CG-CG 4.13Å; K749-E768 IonicContact NZ-OE1 2.8Å; K749-E768 PolarHBondContact NZ-OE1 3.26Å
750	V	92.5	Very high	85.6	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	115.3	-179.6	-178.1	0	0	0	0	109	C737 C752 V762 P763 A766 E768 I769 R770	C737-V750 HydrophobicContact CB-CG1 4.35Å; V750-C752 VanDerWaalsContact CG1-SG 3.57Å; V750-V762 HydrophobicContact CB-CG1 4.05Å; V750-V762 HydrophobicContact CG1-CG1 3.96Å; V750-V762 HydrophobicContact CG1-CG2 4.41Å; V750-V762 HydrophobicContact CG2-CG1 4.01Å; V750-P763 HydrophobicContact CG2-CG 4.2Å; V750-A766 HydrophobicContact CG2-CB 4.06Å; V750-E768 PolarHBondContact N-O 3.41Å; V750-I769 WeakPolarHBondContact O-CA 3.47Å; V750-R770 PolarHBondContact O-N 3.19Å
751	V	90.7	Very high	85.4	Confident	28 Å²	28	49.8 Å²	49.8	17%	0.17	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	111.6	-178.7	-174.9	0	0	0	0	109.4	C737 S738 Y740 K749 R770	C737-V751 CarbonylContact C-O 3.58Å; C737-V751 VanDerWaalsContact CA-O 3.28Å; C737-V751 WeakPolarHBondContact CA-O 3.27Å; S738-V751 PolarHBondContact N-O 2.85Å; S738-V751 PolarHBondContact O-N 3.38Å; Y740-V751 HydrophobicContact CE2-CG2 4.36Å; K749-V751 HydrophobicContact CD-CG2 4.3Å; K749-V751 HydrophobicContact CG-CG2 4.01Å; V751-R770 HydrophobicContact CG1-CB 4.4Å
752	C	88.7	Confident	85.4	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.276	C	S	.	.			trans	-122.1	38.5	-176.3	-58.1	0	0	0	0	111.1	C737 V750 A754 A755 R770 M771 V774	C737-C752 HydrophobicContact CB-CB 4.12Å; C737-C752 WeakPolarHBondContact CB-SG 3.43Å; C737-C752 WeakPolarHBondContact SG-CB 3.29Å; C737-C752 CovalentContact SG-SG 2.03Å; C737-C752 PolarHBondContact SG-SG 2.83Å; V750-C752 VanDerWaalsContact CG1-SG 3.57Å; C752-A754 PolarHBondContact O-N 3.1Å; C752-A755 HydrophobicContact CB-CB 4.22Å; C752-A755 PolarHBondContact O-N 2.73Å; C752-A755 VanDerWaalsContact O-N 3.11Å; C752-R770 PolarHBondContact N-O 2.9Å; C752-M771 HydrophobicContact CB-CG 4.35Å; C752-V774 WeakPolarHBondContact O-CG2 3.48Å
753	S	79.2	Confident	85.5	Confident	36 Å²	36	48.4 Å²	48.4	25%	0.252	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	121.9	-174.7	-50.8	0	0	0	0	111.1	A755 D772	S753-A755 PolarHBondContact O-N 2.98Å; S753-D772 CarbonylContact C-O 3.13Å; S753-D772 VanDerWaalsContact CA-O 3.26Å; S753-D772 WeakPolarHBondContact CA-O 3.49Å; S753-D772 VanDerWaalsContact CB-OD1 3.29Å; S753-D772 WeakPolarHBondContact CB-OD1 3.31Å; S753-D772 VanDerWaalsContact OG-CG 3.29Å; S753-D772 PolarHBondContact OG-OD1 2.93Å; S753-D772 PolarHBondContact OG-OD2 3.4Å
754	A	76.2	Confident	85.8	Confident	79 Å²	79	47.2 Å²	47.2	65%	0.653	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	13.1	-176.4	0	0	0	0	0	116.9	C752 D772	C752-A754 PolarHBondContact O-N 3.1Å; A754-D772 PolarHBondContact N-O 3.17Å
755	A	76.8	Confident	86.1	Confident	7 Å²	7	43.7 Å²	43.7	6%	0.058	24%	0.236	C	C	.	.			trans	-90.3	138.5	176	0	0	0	0	0	112.4	D736 C752 S753 V757 V774	D736-A755 HydrophobicContact CB-CB 3.57Å; C752-A755 HydrophobicContact CB-CB 4.22Å; C752-A755 PolarHBondContact O-N 2.73Å; C752-A755 VanDerWaalsContact O-N 3.11Å; S753-A755 PolarHBondContact O-N 2.98Å; A755-V757 HydrophobicContact CB-CG2 4.01Å; A755-V757 PolarHBondContact O-N 2.75Å; A755-V774 WeakPolarHBondContact O-CG1 3.38Å; A755-V774 WeakPolarHBondContact O-CG2 3.3Å
756	E	76.7	Confident	86.5	Confident	182 Å²	182	41.4 Å²	41.4	85%	0.85	22%	0.224	S	C	*	.			trans	-77.2	61.4	179	-68	-168.4	170.6	0	0	113.4
757	V	81.7	Confident	86.9	Confident	11 Å²	11	37.9 Å²	37.9	7%	0.067	20%	0.203	C	C	.	.			trans	-102.7	126.4	-175.8	179.3	0	0	0	0	111.7	P734 A755 N761 V762	P734-V757 HydrophobicContact CB-CG1 3.88Å; P734-V757 HydrophobicContact CB-CG2 4.15Å; P734-V757 HydrophobicContact CG-CG1 4.03Å; A755-V757 HydrophobicContact CB-CG2 4.01Å; A755-V757 PolarHBondContact O-N 2.75Å; V757-N761 HydrophobicContact CG1-CB 4.28Å; V757-V762 HydrophobicContact CG1-CG2 4.17Å
758	Q	82.8	Confident	87	Confident	80 Å²	80	37.4 Å²	37.4	37%	0.374	20%	0.2	S	C	.	.			trans	-71.7	138.4	174	-66.5	-169.7	3.9	0	0	110.9	K760 N761	Q758-K760 HydrophobicContact CB-CG 4.16Å; Q758-K760 PolarHBondContact O-N 3.23Å; Q758-N761 WeakPolarHBondContact O-CB 3.09Å; Q758-N761 PolarHBondContact O-N 3.23Å
759	P	86.4	Confident	87.1	Confident	9 Å²	9	37.3 Å²	37.3	6%	0.058	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-47.7	-34.8	176.2	-34.6	39.1	0	0	0	115.3	N761 V762 M771 L784 A788 F789	P759-N761 VanDerWaalsContact C-N 3.25Å; P759-N761 PolarHBondContact O-N 3.15Å; P759-V762 PolarHBondContact O-N 3.13Å; P759-M771 HydrophobicContact CG-SD 4.39Å; P759-L784 HydrophobicContact CG-CD1 4.3Å; P759-A788 HydrophobicContact CB-CB 4.12Å; P759-A788 WeakPolarHBondContact CB-O 3.43Å; P759-A788 HydrophobicContact CG-CB 4.32Å; P759-F789 HydrophobicContact CB-CD1 4.01Å; P759-F789 HydrophobicContact CB-CE1 3.71Å; P759-F789 HydrophobicContact CB-CE2 4.43Å; P759-F789 HydrophobicContact CB-CG 4.49Å; P759-F789 HydrophobicContact CB-CZ 3.93Å; P759-F789 HydrophobicContact CG-CE1 4.22Å; P759-F789 HydrophobicContact CG-CZ 4.01Å
760	K	83.5	Confident	87.1	Confident	130 Å²	130	39.9 Å²	39.9	57%	0.565	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-68.5	-17.7	179.7	80.2	-169.2	-169.3	-163.7	0	114.6	Q758 R792	Q758-K760 HydrophobicContact CB-CG 4.16Å; Q758-K760 PolarHBondContact O-N 3.23Å; K760-R792 PolarHBondContact O-NH2 3.11Å
761	N	87.6	Confident	86.8	Confident	91 Å²	91	39.9 Å²	39.9	49%	0.487	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-93.1	-11.5	-177	-66.8	-4	0	0	0	112.5	V757 Q758 P759	V757-N761 HydrophobicContact CG1-CB 4.28Å; Q758-N761 WeakPolarHBondContact O-CB 3.09Å; Q758-N761 PolarHBondContact O-N 3.23Å; P759-N761 VanDerWaalsContact C-N 3.25Å; P759-N761 PolarHBondContact O-N 3.15Å
762	V	90.3	Very high	86.4	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.006	21%	0.211	C	C	.	.	S	Bend	trans	-73.9	139	177.8	173.5	0	0	0	0	110.4	P734 V750 V757 P759 M764 A766 I769 M771 R792	P734-V762 HydrophobicContact CG-CG2 4.46Å; V750-V762 HydrophobicContact CB-CG1 4.05Å; V750-V762 HydrophobicContact CG1-CG1 3.96Å; V750-V762 HydrophobicContact CG1-CG2 4.41Å; V750-V762 HydrophobicContact CG2-CG1 4.01Å; V757-V762 HydrophobicContact CG1-CG2 4.17Å; P759-V762 PolarHBondContact O-N 3.13Å; V762-M764 PolarHBondContact O-N 3.45Å; V762-A766 HydrophobicContact CG1-CB 3.98Å; V762-I769 HydrophobicContact CB-CD1 4.37Å; V762-I769 HydrophobicContact CG1-CD1 3.57Å; V762-I769 HydrophobicContact CG1-CG1 3.79Å; V762-M771 HydrophobicContact CB-CE 4.37Å; V762-M771 HydrophobicContact CG2-CE 3.21Å; V762-R792 PolarHBondContact O-NE 2.9Å; V762-R792 PolarHBondContact O-NH2 2.94Å
763	P	91.1	Very high	85.7	Confident	7 Å²	7	42.4 Å²	42.4	5%	0.045	23%	0.23	C	C	.	.			trans	-42.8	135.8	179	-33.1	31.7	0	0	0	114.6	V732 V750 L765 A766	V732-P763 WeakPolarHBondContact O-CG 3.1Å; V750-P763 HydrophobicContact CG2-CG 4.2Å; P763-L765 PolarHBondContact O-N 3.15Å; P763-A766 WeakPolarHBondContact O-CB 3.35Å; P763-A766 PolarHBondContact O-N 2.96Å; P763-A766 VanDerWaalsContact O-N 3.12Å
764	M	90.1	Very high	85.1	Confident	49 Å²	49	40.8 Å²	40.8	24%	0.241	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-28.2	178.4	-77.4	-173.9	55.8	0	0	113.3	D728 V762 A766	D728-M764 HydrophobicContact CB-CE 3.72Å; D728-M764 HydrophobicContact CB-SD 3.6Å; D728-M764 VanDerWaalsContact OD2-CE 3.3Å; D728-M764 WeakPolarHBondContact OD2-CE 3.27Å; V762-M764 PolarHBondContact O-N 3.45Å; M764-A766 PolarHBondContact O-N 3.23Å
765	L	90.2	Very high	84.4	Confident	22 Å²	22	39.1 Å²	39.1	12%	0.115	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-0	175.9	-61.6	-178.7	0	0	0	113.6	M716 P763 T767	M716-L765 HydrophobicContact CG-CD1 4.05Å; M716-L765 HydrophobicContact SD-CD1 4.05Å; P763-L765 PolarHBondContact O-N 3.15Å; L765-T767 PolarHBondContact O-N 2.96Å
766	A	93	Very high	83.3	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.2	C	C	.	.			trans	-58.6	132.3	-179.4	0	0	0	0	0	111.9	V750 V762 P763 M764 I769 L795	V750-A766 HydrophobicContact CG2-CB 4.06Å; V762-A766 HydrophobicContact CG1-CB 3.98Å; P763-A766 WeakPolarHBondContact O-CB 3.35Å; P763-A766 PolarHBondContact O-N 2.96Å; P763-A766 VanDerWaalsContact O-N 3.12Å; M764-A766 PolarHBondContact O-N 3.23Å; A766-I769 HydrophobicContact CB-CD1 3.99Å; A766-I769 HydrophobicContact CB-CG1 3.81Å; A766-L795 WeakPolarHBondContact O-CA 3.45Å; A766-L795 PolarHBondContact O-N 3.2Å
767	T	93.6	Very high	82.1	Confident	10 Å²	10	31 Å²	31	6%	0.061	17%	0.167	C	C	.	.	S	Bend	trans	-108.7	-25.2	178.9	61.9	0	0	0	0	112.6	T746 N748 L765 R794 R796 Q797	T746-T767 WeakPolarHBondContact O-CG2 3.28Å; N748-T767 PolarHBondContact N-OG1 2.98Å; N748-T767 PolarHBondContact O-N 3.07Å; N748-T767 PolarHBondContact O-OG1 3.08Å; L765-T767 PolarHBondContact O-N 2.96Å; T767-R794 HydrophobicContact CG2-CB 4.14Å; T767-R796 PolarHBondContact O-N 3.22Å; T767-Q797 PolarHBondContact O-N 3.25Å
768	E	93.4	Very high	80.6	Confident	13 Å²	13	31.9 Å²	31.9	6%	0.061	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	127.2	172.5	177.4	178.3	161.1	0	0	108.4	N748 K749 V750 R770 Q797 Y799	N748-E768 PolarHBondContact O-N 2.78Å; N748-E768 VanDerWaalsContact O-N 3.11Å; K749-E768 WeakPolarHBondContact CA-O 3.35Å; K749-E768 HydrophobicContact CB-CB 4.31Å; K749-E768 WeakPolarHBondContact CE-OE1 3.32Å; K749-E768 HydrophobicContact CG-CB 4.2Å; K749-E768 HydrophobicContact CG-CG 4.13Å; K749-E768 IonicContact NZ-OE1 2.8Å; K749-E768 PolarHBondContact NZ-OE1 3.26Å; V750-E768 PolarHBondContact N-O 3.41Å; E768-R770 IonicContact OE1-CZ 2.81Å; E768-R770 IonicContact OE1-NE 2.66Å; E768-R770 PolarHBondContact OE1-NE 2.89Å; E768-R770 IonicContact OE1-NH2 3.93Å; E768-R770 PolarHBondContact OE1-NH2 2.9Å; E768-Q797 WeakPolarHBondContact CA-O 3.32Å; E768-Q797 HydrophobicContact CB-CB 4.43Å; E768-Q797 HydrophobicContact CG-CB 4.14Å; E768-Y799 HydrophobicContact CG-CE2 4.25Å
769	I	93.2	Very high	79.3	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	124.3	176.5	-63.2	171.8	0	0	0	108.2	V750 V762 A766 M771 F789 L795 Q797 L798 Y799	V750-I769 WeakPolarHBondContact O-CA 3.47Å; V762-I769 HydrophobicContact CB-CD1 4.37Å; V762-I769 HydrophobicContact CG1-CD1 3.57Å; V762-I769 HydrophobicContact CG1-CG1 3.79Å; A766-I769 HydrophobicContact CB-CD1 3.99Å; A766-I769 HydrophobicContact CB-CG1 3.81Å; I769-M771 HydrophobicContact CG2-CE 3.98Å; I769-M771 HydrophobicContact CG2-CG 3.8Å; I769-M771 HydrophobicContact CG2-SD 4.16Å; I769-F789 HydrophobicContact CD1-CD1 4.17Å; I769-F789 HydrophobicContact CD1-CE1 4.37Å; I769-L795 HydrophobicContact CB-CD1 4.04Å; I769-L795 HydrophobicContact CD1-CD1 3.58Å; I769-L795 HydrophobicContact CD1-CD2 3.9Å; I769-L795 HydrophobicContact CD1-CG 4.38Å; I769-L795 HydrophobicContact CG1-CD1 3.54Å; I769-Q797 PolarHBondContact N-O 2.99Å; I769-L798 HydrophobicContact CB-CD1 3.88Å; I769-L798 HydrophobicContact CG2-CD1 3.93Å; I769-Y799 PolarHBondContact O-N 2.94Å
770	R	91.2	Very high	77.9	Confident	82 Å²	82	37.6 Å²	37.6	31%	0.309	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	111.8	170	-58.7	-171.9	-175	-153.6	-4.7	109.7	V750 V751 C752 E768 Y799	V750-R770 PolarHBondContact O-N 3.19Å; V751-R770 HydrophobicContact CG1-CB 4.4Å; C752-R770 PolarHBondContact N-O 2.9Å; E768-R770 IonicContact OE1-CZ 2.81Å; E768-R770 IonicContact OE1-NE 2.66Å; E768-R770 PolarHBondContact OE1-NE 2.89Å; E768-R770 IonicContact OE1-NH2 3.93Å; E768-R770 PolarHBondContact OE1-NH2 2.9Å; R770-Y799 HydrophobicContact CG-CD2 3.66Å; R770-Y799 HydrophobicContact CG-CE2 4.31Å; R770-Y799 HydrophobicContact CG-CG 4.12Å
771	M	87.4	Confident	77.1	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	22%	0.224	C	C	.	.			trans	-120.1	44.6	173.6	-65.7	175.4	168.6	0	0	109.8	C752 P759 V762 I769 V774 F789 Y799 L800 S803	C752-M771 HydrophobicContact CB-CG 4.35Å; P759-M771 HydrophobicContact CG-SD 4.39Å; V762-M771 HydrophobicContact CB-CE 4.37Å; V762-M771 HydrophobicContact CG2-CE 3.21Å; I769-M771 HydrophobicContact CG2-CE 3.98Å; I769-M771 HydrophobicContact CG2-CG 3.8Å; I769-M771 HydrophobicContact CG2-SD 4.16Å; M771-V774 HydrophobicContact CB-CB 4.28Å; M771-V774 HydrophobicContact CB-CG2 4.01Å; M771-V774 PolarHBondContact O-N 3.36Å; M771-F789 HydrophobicContact CE-CE1 4.35Å; M771-F789 HydrophobicContact SD-CE1 4.22Å; M771-F789 HydrophobicContact SD-CZ 4.36Å; M771-Y799 PolarHBondContact N-O 2.82Å; M771-L800 HydrophobicContact CB-CD2 3.96Å; M771-L800 HydrophobicContact SD-CD2 4.19Å; M771-S803 PolarHBondContact O-OG 2.8Å
772	D	80.7	Confident	76.8	Confident	42 Å²	42	36.6 Å²	36.6	23%	0.225	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	132.7	179.1	56.5	-50.6	0	0	0	111.1	S753 A754 V774 N801	S753-D772 CarbonylContact C-O 3.13Å; S753-D772 VanDerWaalsContact CA-O 3.26Å; S753-D772 WeakPolarHBondContact CA-O 3.49Å; S753-D772 VanDerWaalsContact CB-OD1 3.29Å; S753-D772 WeakPolarHBondContact CB-OD1 3.31Å; S753-D772 VanDerWaalsContact OG-CG 3.29Å; S753-D772 PolarHBondContact OG-OD1 2.93Å; S753-D772 PolarHBondContact OG-OD2 3.4Å; A754-D772 PolarHBondContact N-O 3.17Å; D772-V774 VanDerWaalsContact C-N 3.26Å; D772-V774 PolarHBondContact O-N 3.49Å; D772-N801 CarbonylContact C-O 3.58Å; D772-N801 WeakPolarHBondContact CA-O 3.4Å; D772-N801 WeakPolarHBondContact CB-ND2 3.18Å; D772-N801 WeakPolarHBondContact CB-OD1 3.34Å
773	G	73.7	Confident	76.6	Confident	39 Å²	39	42.1 Å²	42.1	40%	0.402	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	-1	-178.6	0	0	0	0	0	116	N801 S802	G773-N801 PolarHBondContact N-O 2.99Å; G773-S802 VanDerWaalsContact CA-O 3.27Å; G773-S802 WeakPolarHBondContact CA-O 3.49Å
774	V	67.4	Low	76.5	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.018	24%	0.241	C	C	.	.	S	Bend	trans	-84.1	141.1	179.8	-179.2	0	0	0	0	110.7	C752 A755 M771 D772 A776 S803	C752-V774 WeakPolarHBondContact O-CG2 3.48Å; A755-V774 WeakPolarHBondContact O-CG1 3.38Å; A755-V774 WeakPolarHBondContact O-CG2 3.3Å; M771-V774 HydrophobicContact CB-CB 4.28Å; M771-V774 HydrophobicContact CB-CG2 4.01Å; M771-V774 PolarHBondContact O-N 3.36Å; D772-V774 VanDerWaalsContact C-N 3.26Å; D772-V774 PolarHBondContact O-N 3.49Å; V774-A776 HydrophobicContact CG1-CB 4.5Å; V774-A776 PolarHBondContact O-N 3.16Å; V774-S803 CarbonylContact O-C 3.57Å; V774-S803 WeakPolarHBondContact O-CA 3.45Å; V774-S803 WeakPolarHBondContact O-CB 3.3Å; V774-S803 VanDerWaalsContact O-O 3.06Å; V774-S803 PolarHBondContact O-OG 3.13Å
775	S	60.8	Low	76.5	Confident	43 Å²	43	42.1 Å²	42.1	30%	0.301	25%	0.246	S	C	.	.			trans	-70.7	74.5	159.6	-167.4	0	0	0	0	108.9	G777 G778 G779	S775-G777 PolarHBondContact O-N 2.89Å; S775-G778 PolarHBondContact O-N 2.98Å; S775-G779 PolarHBondContact OG-O 2.8Å
776	A	53.5	Low	76.6	Confident	2 Å²	2	45.9 Å²	45.9	2%	0.017	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-11.5	-171.4	0	0	0	0	0	113.2	V774 G778 L800 L805	V774-A776 HydrophobicContact CG1-CB 4.5Å; V774-A776 PolarHBondContact O-N 3.16Å; A776-G778 VanDerWaalsContact C-N 3.31Å; A776-G778 PolarHBondContact O-N 3.32Å; A776-L800 HydrophobicContact CB-CD2 4.11Å; A776-L805 HydrophobicContact CB-CD2 4.39Å
777	G	51.4	Low	76.5	Confident	16 Å²	16	48.6 Å²	48.6	17%	0.165	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-2.2	175	0	0	0	0	0	116	S775 R783	S775-G777 PolarHBondContact O-N 2.89Å; G777-R783 WeakPolarHBondContact CA-O 3.5Å
778	G	50.8	Low	76.4	Confident	30 Å²	30	48.5 Å²	48.5	31%	0.309	27%	0.274	S	S	.	.	S	Bend	trans	67.6	97.8	-174.9	0	0	0	0	0	111.1	S775 A776	S775-G778 PolarHBondContact O-N 2.98Å; A776-G778 VanDerWaalsContact C-N 3.31Å; A776-G778 PolarHBondContact O-N 3.32Å
779	G	55.3	Low	76.3	Confident	50 Å²	50	48 Å²	48	52%	0.515	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	69.1	-160.1	-177.9	0	0	0	0	0	114.1	S775 S781	S775-G779 PolarHBondContact OG-O 2.8Å; G779-S781 PolarHBondContact O-N 3.21Å
780	D	58.2	Low	76.1	Confident	159 Å²	159	52.5 Å²	52.5	85%	0.85	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-61.3	-5	-171	-105.8	-22.1	0	0	0	115.7	R782	D780-R782 VanDerWaalsContact C-N 3.25Å; D780-R782 PolarHBondContact O-N 2.98Å; D780-R782 VanDerWaalsContact O-N 3.13Å
781	S	65.5	Low	75.9	Confident	83 Å²	83	49.3 Å²	49.3	58%	0.58	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-68.2	-16.4	-167.9	-57.9	0	0	0	0	114.9	G779 R783	G779-S781 PolarHBondContact O-N 3.21Å; S781-R783 WeakPolarHBondContact O-CB 3.43Å; S781-R783 PolarHBondContact O-N 2.91Å
782	R	82.2	Confident	76.1	Confident	118 Å²	118	50.2 Å²	50.2	45%	0.445	29%	0.291	S	S	.	.			trans	42.9	29.4	-175.2	-57.8	-173.4	-165.5	-170.6	4.2	113.5	D780 G806 R807 E828	D780-R782 VanDerWaalsContact C-N 3.25Å; D780-R782 PolarHBondContact O-N 2.98Å; D780-R782 VanDerWaalsContact O-N 3.13Å; R782-G806 PolarHBondContact O-N 3.23Å; R782-R807 PolarHBondContact O-N 3.03Å; R782-R807 VanDerWaalsContact O-N 3.09Å; R782-E828 IonicContact CZ-OE2 3.71Å; R782-E828 IonicContact NH1-OE1 3.6Å; R782-E828 IonicContact NH1-OE2 2.7Å; R782-E828 PolarHBondContact NH1-OE2 2.93Å
783	R	86	Confident	76.5	Confident	116 Å²	116	52.7 Å²	52.7	44%	0.438	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	125.8	-165.4	175.5	-176.6	172.5	-159.8	-3	111.1	G777 S781 P785 R807 D809	G777-R783 WeakPolarHBondContact CA-O 3.5Å; S781-R783 WeakPolarHBondContact O-CB 3.43Å; S781-R783 PolarHBondContact O-N 2.91Å; R783-P785 WeakPolarHBondContact O-CD 3.19Å; R783-R807 CarbonylContact C-O 3.44Å; R783-R807 VanDerWaalsContact CA-O 3.26Å; R783-R807 WeakPolarHBondContact CA-O 3.18Å; R783-D809 IonicContact CZ-OD1 3.41Å; R783-D809 IonicContact CZ-OD2 3.21Å; R783-D809 VanDerWaalsContact NE-CG 3.27Å; R783-D809 IonicContact NE-OD1 2.77Å; R783-D809 PolarHBondContact NE-OD1 3.1Å; R783-D809 IonicContact NE-OD2 3.05Å; R783-D809 PolarHBondContact NE-OD2 3.29Å; R783-D809 VanDerWaalsContact NH2-CG 3.32Å; R783-D809 IonicContact NH2-OD1 3.25Å; R783-D809 PolarHBondContact NH2-OD1 3.01Å; R783-D809 IonicContact NH2-OD2 2.65Å; R783-D809 PolarHBondContact NH2-OD2 2.95Å
784	L	89.7	Confident	77.3	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	115.5	170.4	-169.9	71	0	0	0	110	P759 A788 F789 L800 L805 R807 I808 D809 A812 F813	P759-L784 HydrophobicContact CG-CD1 4.3Å; L784-A788 HydrophobicContact CD1-CB 3.77Å; L784-A788 HydrophobicContact CG-CB 4.01Å; L784-F789 HydrophobicContact CD1-CE2 4.14Å; L784-F789 HydrophobicContact CD2-CE2 4.25Å; L784-L800 HydrophobicContact CD2-CD1 4Å; L784-L805 HydrophobicContact CB-CD2 4.33Å; L784-R807 PolarHBondContact N-O 3.39Å; L784-I808 HydrophobicContact CB-CG1 4.19Å; L784-I808 HydrophobicContact CB-CG2 4.34Å; L784-I808 HydrophobicContact CD2-CG2 4.19Å; L784-D809 PolarHBondContact O-N 3.18Å; L784-A812 HydrophobicContact CD2-CB 4.08Å; L784-A812 HydrophobicContact CG-CB 4.3Å; L784-F813 HydrophobicContact CD2-CD1 4.4Å; L784-F813 HydrophobicContact CD2-CE1 3.51Å; L784-F813 HydrophobicContact CD2-CE2 4.37Å; L784-F813 HydrophobicContact CD2-CZ 3.49Å; L784-F813 VanDerWaalsContact CD2-CZ 3.49Å
785	P	90.1	Very high	78.6	Confident	56 Å²	56	56.3 Å²	56.3	36%	0.364	30%	0.303	S	S	.	.			trans	-74.8	163.9	-173	30.4	-35.5	0	0	0	113.2	R783 A788 D809	R783-P785 WeakPolarHBondContact O-CD 3.19Å; P785-A788 HydrophobicContact CG-CB 4.24Å; P785-A788 WeakPolarHBondContact O-CB 3.3Å; P785-A788 PolarHBondContact O-N 3.34Å; P785-D809 WeakPolarHBondContact CA-OD2 3.26Å
786	R	91.4	Very high	80.3	Confident	101 Å²	101	60.9 Å²	60.9	38%	0.381	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	140.7	171.1	173.1	176	-88	-177.6	-6.5	111.1	A788 D809 E810 K811	R786-A788 PolarHBondContact O-N 2.98Å; R786-D809 HydrophobicContact CB-CB 4.42Å; R786-D809 PolarHBondContact N-OD2 3.27Å; R786-E810 IonicContact CZ-OE1 3.35Å; R786-E810 PolarHBondContact NE-O 3.5Å; R786-E810 IonicContact NH1-OE1 3.86Å; R786-E810 IonicContact NH2-OE1 2.64Å; R786-E810 PolarHBondContact NH2-OE1 2.9Å; R786-E810 IonicContact NH2-OE2 3.33Å; R786-E810 PolarHBondContact NH2-OE2 3.45Å; R786-K811 HydrophobicContact CG-CB 4.28Å
787	N	91.6	Very high	82.3	Confident	57 Å²	57	62.8 Å²	62.8	31%	0.305	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	32.7	179	-59.8	-34.2	0	0	0	113.6	F789 L790 K811 N814	N787-F789 PolarHBondContact O-N 3.41Å; N787-F789 VanDerWaalsContact O-N 3.11Å; N787-L790 HydrophobicContact CB-CB 4.22Å; N787-L790 HydrophobicContact CB-CD1 4.4Å; N787-L790 WeakPolarHBondContact O-CB 3.36Å; N787-L790 PolarHBondContact O-N 3.29Å; N787-L790 VanDerWaalsContact O-N 3.11Å; N787-K811 PolarHBondContact N-O 3.16Å; N787-N814 VanDerWaalsContact OD1-CB 3.26Å; N787-N814 WeakPolarHBondContact OD1-CB 3.17Å; N787-N814 PolarHBondContact OD1-ND2 2.95Å
788	A	89.8	Confident	84.4	Confident	9 Å²	9	62 Å²	62	7%	0.074	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-36.4	-176.4	0	0	0	0	0	113	P759 L784 P785 R786 A812	P759-A788 HydrophobicContact CB-CB 4.12Å; P759-A788 WeakPolarHBondContact CB-O 3.43Å; P759-A788 HydrophobicContact CG-CB 4.32Å; L784-A788 HydrophobicContact CD1-CB 3.77Å; L784-A788 HydrophobicContact CG-CB 4.01Å; P785-A788 HydrophobicContact CG-CB 4.24Å; P785-A788 WeakPolarHBondContact O-CB 3.3Å; P785-A788 PolarHBondContact O-N 3.34Å; R786-A788 PolarHBondContact O-N 2.98Å; A788-A812 PolarHBondContact N-O 2.94Å
789	F	91.8	Very high	86.4	Confident	1 Å²	1	62.5 Å²	62.5	0%	0.004	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	31.6	-178.4	-58.7	-85.2	0	0	0	113.1	P759 I769 M771 L784 N787 G791 R792 L795 L798 L800 F813 L816	P759-F789 HydrophobicContact CB-CD1 4.01Å; P759-F789 HydrophobicContact CB-CE1 3.71Å; P759-F789 HydrophobicContact CB-CE2 4.43Å; P759-F789 HydrophobicContact CB-CG 4.49Å; P759-F789 HydrophobicContact CB-CZ 3.93Å; P759-F789 HydrophobicContact CG-CE1 4.22Å; P759-F789 HydrophobicContact CG-CZ 4.01Å; I769-F789 HydrophobicContact CD1-CD1 4.17Å; I769-F789 HydrophobicContact CD1-CE1 4.37Å; M771-F789 HydrophobicContact CE-CE1 4.35Å; M771-F789 HydrophobicContact SD-CE1 4.22Å; M771-F789 HydrophobicContact SD-CZ 4.36Å; L784-F789 HydrophobicContact CD1-CE2 4.14Å; L784-F789 HydrophobicContact CD2-CE2 4.25Å; N787-F789 PolarHBondContact O-N 3.41Å; N787-F789 VanDerWaalsContact O-N 3.11Å; F789-G791 PolarHBondContact O-N 3.19Å; F789-R792 WeakPolarHBondContact O-CB 3.46Å; F789-R792 WeakPolarHBondContact O-CD 3.31Å; F789-R792 PolarHBondContact O-N 3.01Å; F789-L795 HydrophobicContact CD1-CD2 4.45Å; F789-L798 HydrophobicContact CD1-CD1 4.49Å; F789-L798 HydrophobicContact CD2-CD2 3.95Å; F789-L798 HydrophobicContact CE1-CD1 3.79Å; F789-L798 HydrophobicContact CE1-CD2 4.33Å; F789-L798 HydrophobicContact CE2-CD1 4.4Å; F789-L798 HydrophobicContact CE2-CD2 3.63Å; F789-L798 HydrophobicContact CG-CD2 4.44Å; F789-L798 HydrophobicContact CZ-CD1 3.75Å; F789-L798 HydrophobicContact CZ-CD2 3.85Å; F789-L798 HydrophobicContact CZ-CG 4.43Å; F789-L800 HydrophobicContact CE2-CD1 4.29Å; F789-L800 HydrophobicContact CZ-CD1 4.33Å; F789-L800 HydrophobicContact CZ-CD2 4.16Å; F789-F813 HydrophobicContact CD2-CD1 4.35Å; F789-F813 HydrophobicContact CE2-CD1 4.47Å; F789-F813 HydrophobicContact CE2-CE1 4.27Å; F789-L816 HydrophobicContact CB-CD1 4.18Å; F789-L816 HydrophobicContact CB-CD2 3.94Å
790	L	89.1	Confident	88.2	Confident	95 Å²	95	60.1 Å²	60.1	50%	0.497	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	134.6	-178.1	-172.5	63.8	0	0	0	112.3	N787 R792	N787-L790 HydrophobicContact CB-CB 4.22Å; N787-L790 HydrophobicContact CB-CD1 4.4Å; N787-L790 WeakPolarHBondContact O-CB 3.36Å; N787-L790 PolarHBondContact O-N 3.29Å; N787-L790 VanDerWaalsContact O-N 3.11Å; L790-R792 VanDerWaalsContact C-N 3.29Å; L790-R792 WeakPolarHBondContact O-CD 3.39Å; L790-R792 PolarHBondContact O-N 3.11Å; L790-R792 PolarHBondContact O-NH1 3.14Å
791	G	87	Confident	89.8	Confident	15 Å²	15	54 Å²	54	16%	0.155	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.1	-10.5	177.2	0	0	0	0	0	115.4	F789 H793	F789-G791 PolarHBondContact O-N 3.19Å; G791-H793 PolarHBondContact O-CD2 3.48Å; G791-H793 VanDerWaalsContact O-CD2 3.24Å; G791-H793 PolarHBondContact O-N 3.23Å
792	R	91.8	Very high	91	Very high	19 Å²	19	52 Å²	52	7%	0.072	24%	0.236	C	C	.	.			trans	-82.7	55	178.3	-69.8	84.3	-174.3	160.1	3.5	111.7	K760 V762 F789 L790 R794 L795 L816	K760-R792 PolarHBondContact O-NH2 3.11Å; V762-R792 PolarHBondContact O-NE 2.9Å; V762-R792 PolarHBondContact O-NH2 2.94Å; F789-R792 WeakPolarHBondContact O-CB 3.46Å; F789-R792 WeakPolarHBondContact O-CD 3.31Å; F789-R792 PolarHBondContact O-N 3.01Å; L790-R792 VanDerWaalsContact C-N 3.29Å; L790-R792 WeakPolarHBondContact O-CD 3.39Å; L790-R792 PolarHBondContact O-N 3.11Å; L790-R792 PolarHBondContact O-NH1 3.14Å; R792-R794 PolarHBondContact O-N 2.98Å; R792-R794 VanDerWaalsContact O-N 3.11Å; R792-L795 HydrophobicContact CB-CB 4.15Å; R792-L795 WeakPolarHBondContact O-CB 2.88Å; R792-L795 PolarHBondContact O-N 2.95Å; R792-L816 HydrophobicContact CB-CD2 4.26Å; R792-L816 WeakPolarHBondContact O-CD2 3.5Å
793	H	89.1	Confident	91.3	Very high	95 Å²	95	46.4 Å²	46.4	44%	0.44	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-18.9	-174.2	-55.2	-67	0	0	0	113.9	G791 D815 A818	G791-H793 PolarHBondContact O-CD2 3.48Å; G791-H793 VanDerWaalsContact O-CD2 3.24Å; G791-H793 PolarHBondContact O-N 3.23Å; H793-D815 IonicContact CE1-OD2 3.18Å; H793-D815 PolarHBondContact CE1-OD2 3.21Å; H793-D815 PolarHBondContact ND1-O 2.7Å; H793-D815 IonicContact ND1-OD2 3.58Å; H793-A818 WeakPolarHBondContact O-CB 3.29Å
794	R	91.4	Very high	91.3	Very high	118 Å²	118	49.4 Å²	49.4	45%	0.445	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-5.4	177.1	-62.5	-173.5	176	-171.9	1	113.6	T767 R792 R796	T767-R794 HydrophobicContact CG2-CB 4.14Å; R792-R794 PolarHBondContact O-N 2.98Å; R792-R794 VanDerWaalsContact O-N 3.11Å; R794-R796 PolarHBondContact O-N 3.3Å
795	L	95	Very high	91.3	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.226	C	C	.	.			trans	-64.7	115.9	-176.8	-172.1	61.4	0	0	0	110.9	A766 I769 F789 R792 Q797 L798 L816 A818 L819	A766-L795 WeakPolarHBondContact O-CA 3.45Å; A766-L795 PolarHBondContact O-N 3.2Å; I769-L795 HydrophobicContact CB-CD1 4.04Å; I769-L795 HydrophobicContact CD1-CD1 3.58Å; I769-L795 HydrophobicContact CD1-CD2 3.9Å; I769-L795 HydrophobicContact CD1-CG 4.38Å; I769-L795 HydrophobicContact CG1-CD1 3.54Å; F789-L795 HydrophobicContact CD1-CD2 4.45Å; R792-L795 HydrophobicContact CB-CB 4.15Å; R792-L795 WeakPolarHBondContact O-CB 2.88Å; R792-L795 PolarHBondContact O-N 2.95Å; L795-Q797 WeakPolarHBondContact CD1-O 3.29Å; L795-L798 HydrophobicContact CD2-CB 4.19Å; L795-L798 HydrophobicContact CD2-CD1 4.4Å; L795-L798 HydrophobicContact CD2-CD2 4.29Å; L795-L816 HydrophobicContact CB-CD2 4.22Å; L795-L816 HydrophobicContact CD2-CD1 4.12Å; L795-L816 HydrophobicContact CD2-CD2 4.01Å; L795-A818 CarbonylContact O-C 3.2Å; L795-A818 WeakPolarHBondContact O-CB 3.41Å; L795-L819 HydrophobicContact CD2-CD1 4.4Å; L795-L819 HydrophobicContact CG-CD1 4.08Å; L795-L819 VanDerWaalsContact O-CA 3.26Å; L795-L819 WeakPolarHBondContact O-CA 3.46Å; L795-L819 PolarHBondContact O-N 2.89Å
796	R	95.5	Very high	91.2	Very high	138 Å²	138	47.9 Å²	47.9	52%	0.521	22%	0.22	S	C	.	.			trans	-101.1	-36.8	-178.6	-68.7	-179.2	-174.2	-177.7	3	112.4	T767 R794 A818 W820 L821	T767-R796 PolarHBondContact O-N 3.22Å; R794-R796 PolarHBondContact O-N 3.3Å; R796-A818 WeakPolarHBondContact CA-O 3.14Å; R796-A818 HydrophobicContact CG-CB 4.18Å; R796-W820 PolarHBondContact O-N 2.95Å; R796-L821 PolarHBondContact O-N 3.43Å
797	Q	95.5	Very high	91.2	Very high	43 Å²	43	50.5 Å²	50.5	20%	0.201	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	131.4	-178.5	-54.8	-176.4	28.2	0	0	110.3	T767 E768 I769 L795 Y799 W820 L821	T767-Q797 PolarHBondContact O-N 3.25Å; E768-Q797 WeakPolarHBondContact CA-O 3.32Å; E768-Q797 HydrophobicContact CB-CB 4.43Å; E768-Q797 HydrophobicContact CG-CB 4.14Å; I769-Q797 PolarHBondContact N-O 2.99Å; L795-Q797 WeakPolarHBondContact CD1-O 3.29Å; Q797-Y799 HydrophobicContact CB-CE2 3.85Å; Q797-Y799 PolarHBondContact OE1-OH 3.24Å; Q797-W820 HydrophobicContact CG-CZ2 3.95Å; Q797-L821 WeakPolarHBondContact CA-O 3.29Å; Q797-L821 HydrophobicContact CB-CB 4.42Å; Q797-L821 HydrophobicContact CG-CB 4.18Å
798	L	95.5	Very high	91.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	120.9	178.3	177	58.7	0	0	0	109.8	I769 F789 L795 L800 F813 L816 L819 L821 L822 D823	I769-L798 HydrophobicContact CB-CD1 3.88Å; I769-L798 HydrophobicContact CG2-CD1 3.93Å; F789-L798 HydrophobicContact CD1-CD1 4.49Å; F789-L798 HydrophobicContact CD2-CD2 3.95Å; F789-L798 HydrophobicContact CE1-CD1 3.79Å; F789-L798 HydrophobicContact CE1-CD2 4.33Å; F789-L798 HydrophobicContact CE2-CD1 4.4Å; F789-L798 HydrophobicContact CE2-CD2 3.63Å; F789-L798 HydrophobicContact CG-CD2 4.44Å; F789-L798 HydrophobicContact CZ-CD1 3.75Å; F789-L798 HydrophobicContact CZ-CD2 3.85Å; F789-L798 HydrophobicContact CZ-CG 4.43Å; L795-L798 HydrophobicContact CD2-CB 4.19Å; L795-L798 HydrophobicContact CD2-CD1 4.4Å; L795-L798 HydrophobicContact CD2-CD2 4.29Å; L798-L800 HydrophobicContact CD1-CD2 4.32Å; L798-L800 HydrophobicContact CD1-CG 4.17Å; L798-L800 HydrophobicContact CD2-CD1 4.13Å; L798-L800 HydrophobicContact CD2-CG 4.5Å; L798-L800 HydrophobicContact CG-CD1 4.28Å; L798-L800 HydrophobicContact CG-CG 4.11Å; L798-F813 HydrophobicContact CD2-CD1 3.98Å; L798-F813 HydrophobicContact CD2-CE1 3.83Å; L798-L816 HydrophobicContact CD2-CD1 4.48Å; L798-L819 HydrophobicContact CB-CD1 3.67Å; L798-L821 PolarHBondContact N-O 3.46Å; L798-L822 HydrophobicContact CB-CD1 4.03Å; L798-L822 HydrophobicContact CD2-CD1 3.88Å; L798-L822 HydrophobicContact CG-CD1 3.94Å; L798-L822 WeakPolarHBondContact O-CA 3.44Å; L798-D823 PolarHBondContact O-N 3.07Å
799	Y	93.8	Very high	91.4	Very high	39 Å²	39	48.5 Å²	48.5	15%	0.153	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	118.2	177.4	-56.4	-102.8	0	0	0	109.9	E768 I769 R770 M771 Q797 L821 D823	E768-Y799 HydrophobicContact CG-CE2 4.25Å; I769-Y799 PolarHBondContact O-N 2.94Å; R770-Y799 HydrophobicContact CG-CD2 3.66Å; R770-Y799 HydrophobicContact CG-CE2 4.31Å; R770-Y799 HydrophobicContact CG-CG 4.12Å; M771-Y799 PolarHBondContact N-O 2.82Å; Q797-Y799 HydrophobicContact CB-CE2 3.85Å; Q797-Y799 PolarHBondContact OE1-OH 3.24Å; Y799-L821 HydrophobicContact CD1-CD2 4.26Å; Y799-L821 HydrophobicContact CE1-CD2 3.71Å; Y799-L821 HydrophobicContact CE2-CD2 4.1Å; Y799-D823 HydrophobicContact CD1-CB 3.75Å; Y799-D823 HydrophobicContact CE1-CB 4.47Å; Y799-D823 HydrophobicContact CG-CB 4.34Å
800	L	92.2	Very high	91.5	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	24%	0.241	C	C	.	.			trans	-126.2	28.5	177.6	-64.9	174.3	0	0	0	110.3	M771 A776 L784 F789 L798 S803 L805 F813 D823 L824 N827	M771-L800 HydrophobicContact CB-CD2 3.96Å; M771-L800 HydrophobicContact SD-CD2 4.19Å; A776-L800 HydrophobicContact CB-CD2 4.11Å; L784-L800 HydrophobicContact CD2-CD1 4Å; F789-L800 HydrophobicContact CE2-CD1 4.29Å; F789-L800 HydrophobicContact CZ-CD1 4.33Å; F789-L800 HydrophobicContact CZ-CD2 4.16Å; L798-L800 HydrophobicContact CD1-CD2 4.32Å; L798-L800 HydrophobicContact CD1-CG 4.17Å; L798-L800 HydrophobicContact CD2-CD1 4.13Å; L798-L800 HydrophobicContact CD2-CG 4.5Å; L798-L800 HydrophobicContact CG-CD1 4.28Å; L798-L800 HydrophobicContact CG-CG 4.11Å; L800-S803 VanDerWaalsContact C-OG 3.26Å; L800-S803 WeakPolarHBondContact O-CB 3.41Å; L800-S803 PolarHBondContact O-OG 2.91Å; L800-L805 HydrophobicContact CB-CD1 4.19Å; L800-L805 HydrophobicContact CD1-CD1 4.38Å; L800-F813 HydrophobicContact CD1-CE1 3.94Å; L800-F813 HydrophobicContact CD1-CZ 4.24Å; L800-D823 CarbonylContact C-O 3.59Å; L800-D823 WeakPolarHBondContact CA-O 3.42Å; L800-D823 PolarHBondContact N-O 3.28Å; L800-L824 HydrophobicContact CB-CD2 3.98Å; L800-L824 HydrophobicContact CD1-CD2 3.91Å; L800-N827 PolarHBondContact O-ND2 2.98Å
801	N	92.3	Very high	91.6	Very high	30 Å²	30	52.1 Å²	52.1	16%	0.16	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	149.8	-177.9	61.1	-76.7	0	0	0	111.4	D772 G773 S803 S825	D772-N801 CarbonylContact C-O 3.58Å; D772-N801 WeakPolarHBondContact CA-O 3.4Å; D772-N801 WeakPolarHBondContact CB-ND2 3.18Å; D772-N801 WeakPolarHBondContact CB-OD1 3.34Å; G773-N801 PolarHBondContact N-O 2.99Å; N801-S803 PolarHBondContact O-N 3.19Å; N801-S803 VanDerWaalsContact O-N 3.1Å; N801-S803 PolarHBondContact O-OG 3.05Å; N801-S825 CarbonylContact C-O 3.53Å; N801-S825 WeakPolarHBondContact CA-O 3.4Å; N801-S825 WeakPolarHBondContact CB-O 3.46Å; N801-S825 WeakPolarHBondContact CB-OG 3.17Å
802	S	90.3	Very high	91.9	Very high	42 Å²	42	51.4 Å²	51.4	29%	0.294	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	20.9	177.6	-42.2	0	0	0	0	114.2	G773 S825 E826	G773-S802 VanDerWaalsContact CA-O 3.27Å; G773-S802 WeakPolarHBondContact CA-O 3.49Å; S802-S825 PolarHBondContact N-O 3.32Å; S802-E826 VanDerWaalsContact CA-O 3.24Å; S802-E826 WeakPolarHBondContact CA-O 3.36Å; S802-E826 PolarHBondContact N-O 3.18Å; S802-E826 WeakPolarHBondContact OG-CB 3.49Å; S802-E826 PolarHBondContact OG-OE2 2.88Å; S802-E826 VanDerWaalsContact OG-OE2 3.14Å
803	S	87.8	Confident	92	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.007	22%	0.221	C	C	.	.	S	Bend	trans	-91.6	10.5	-172.9	-62	0	0	0	0	114.6	M771 V774 L800 N801 L805 N827	M771-S803 PolarHBondContact O-OG 2.8Å; V774-S803 CarbonylContact O-C 3.57Å; V774-S803 WeakPolarHBondContact O-CA 3.45Å; V774-S803 WeakPolarHBondContact O-CB 3.3Å; V774-S803 VanDerWaalsContact O-O 3.06Å; V774-S803 PolarHBondContact O-OG 3.13Å; L800-S803 VanDerWaalsContact C-OG 3.26Å; L800-S803 WeakPolarHBondContact O-CB 3.41Å; L800-S803 PolarHBondContact O-OG 2.91Å; N801-S803 PolarHBondContact O-N 3.19Å; N801-S803 VanDerWaalsContact O-N 3.1Å; N801-S803 PolarHBondContact O-OG 3.05Å; S803-L805 PolarHBondContact O-N 3.01Å; S803-L805 VanDerWaalsContact O-N 3.1Å; S803-N827 WeakPolarHBondContact CA-OD1 3.29Å; S803-N827 WeakPolarHBondContact CB-OD1 3.35Å; S803-N827 PolarHBondContact N-OD1 3.4Å
804	R	86.9	Confident	92.1	Very high	179 Å²	179	47.5 Å²	47.5	68%	0.675	21%	0.208	S	C	*	.			trans	52.3	29.8	-178.1	-53.8	179.7	-176.8	178.1	1.3	114.1	G806 N827	R804-G806 PolarHBondContact O-N 2.67Å; R804-N827 PolarHBondContact N-OD1 2.9Å
805	L	89.6	Confident	91.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	20%	0.201	C	C	.	.			trans	-70.9	120.2	179.5	-67	172.6	0	0	0	110.1	A776 L784 L800 S803 L824 N827 E828 L829	A776-L805 HydrophobicContact CB-CD2 4.39Å; L784-L805 HydrophobicContact CB-CD2 4.33Å; L800-L805 HydrophobicContact CB-CD1 4.19Å; L800-L805 HydrophobicContact CD1-CD1 4.38Å; S803-L805 PolarHBondContact O-N 3.01Å; S803-L805 VanDerWaalsContact O-N 3.1Å; L805-L824 HydrophobicContact CD1-CD2 4.27Å; L805-N827 HydrophobicContact CB-CB 4.16Å; L805-N827 PolarHBondContact N-OD1 2.87Å; L805-E828 CarbonylContact O-C 3.45Å; L805-E828 VanDerWaalsContact O-CA 3.32Å; L805-E828 WeakPolarHBondContact O-CA 3.24Å; L805-E828 PolarHBondContact O-N 2.86Å; L805-L829 HydrophobicContact CB-CD2 4.04Å; L805-L829 WeakPolarHBondContact O-CD2 3.48Å; L805-L829 PolarHBondContact O-N 3.38Å; L805-L829 VanDerWaalsContact O-N 3.13Å
806	G	89	Confident	91.7	Very high	23 Å²	23	44.7 Å²	44.7	24%	0.237	20%	0.202	C	C	.	.			trans	-94.6	-31.6	172.9	0	0	0	0	0	113.1	R782 R804	R782-G806 PolarHBondContact O-N 3.23Å; R804-G806 PolarHBondContact O-N 2.67Å
807	R	90.2	Very high	91.4	Very high	157 Å²	157	40.2 Å²	40.2	59%	0.592	19%	0.194	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-140.8	144.3	-178.1	-173.8	175.2	178.1	-178.9	1	112.9	R782 R783 L784	R782-R807 PolarHBondContact O-N 3.03Å; R782-R807 VanDerWaalsContact O-N 3.09Å; R783-R807 CarbonylContact C-O 3.44Å; R783-R807 VanDerWaalsContact CA-O 3.26Å; R783-R807 WeakPolarHBondContact CA-O 3.18Å; L784-R807 PolarHBondContact N-O 3.39Å
808	I	93.2	Very high	91.3	Very high	9 Å²	9	39.2 Å²	39.2	5%	0.046	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	130.8	170.8	-59.3	175.1	0	0	0	108.2	L784 A812 F813 L824 L829 L832 E836	L784-I808 HydrophobicContact CB-CG1 4.19Å; L784-I808 HydrophobicContact CB-CG2 4.34Å; L784-I808 HydrophobicContact CD2-CG2 4.19Å; I808-A812 HydrophobicContact CG2-CB 3.45Å; I808-A812 VanDerWaalsContact CG2-CB 3.45Å; I808-F813 HydrophobicContact CD1-CE2 4.18Å; I808-F813 HydrophobicContact CD1-CZ 4.18Å; I808-F813 HydrophobicContact CG2-CE2 3.88Å; I808-F813 HydrophobicContact CG2-CZ 4.33Å; I808-L824 HydrophobicContact CD1-CD1 3.82Å; I808-L824 HydrophobicContact CD1-CD2 3.83Å; I808-L824 HydrophobicContact CD1-CG 4.49Å; I808-L829 HydrophobicContact CD1-CD1 3.98Å; I808-L829 HydrophobicContact CD1-CD2 3.92Å; I808-L829 HydrophobicContact CG1-CD2 3.81Å; I808-L832 HydrophobicContact CD1-CD2 4.24Å; I808-E836 HydrophobicContact CB-CG 4.09Å; I808-E836 HydrophobicContact CG2-CB 3.84Å; I808-E836 HydrophobicContact CG2-CG 3.79Å
809	D	92.9	Very high	91.3	Very high	15 Å²	15	39.2 Å²	39.2	8%	0.08	19%	0.193	C	C	.	.			trans	-75.4	158.1	179.4	-76	-9.4	0	0	0	113.3	R783 L784 P785 R786 K811 A812	R783-D809 IonicContact CZ-OD1 3.41Å; R783-D809 IonicContact CZ-OD2 3.21Å; R783-D809 VanDerWaalsContact NE-CG 3.27Å; R783-D809 IonicContact NE-OD1 2.77Å; R783-D809 PolarHBondContact NE-OD1 3.1Å; R783-D809 IonicContact NE-OD2 3.05Å; R783-D809 PolarHBondContact NE-OD2 3.29Å; R783-D809 VanDerWaalsContact NH2-CG 3.32Å; R783-D809 IonicContact NH2-OD1 3.25Å; R783-D809 PolarHBondContact NH2-OD1 3.01Å; R783-D809 IonicContact NH2-OD2 2.65Å; R783-D809 PolarHBondContact NH2-OD2 2.95Å; L784-D809 PolarHBondContact O-N 3.18Å; P785-D809 WeakPolarHBondContact CA-OD2 3.26Å; R786-D809 HydrophobicContact CB-CB 4.42Å; R786-D809 PolarHBondContact N-OD2 3.27Å; D809-K811 PolarHBondContact O-N 2.64Å; D809-A812 VanDerWaalsContact O-CB 3.24Å; D809-A812 WeakPolarHBondContact O-CB 3.29Å; D809-A812 PolarHBondContact O-N 2.69Å; D809-A812 VanDerWaalsContact O-N 3.09Å
810	E	92.6	Very high	91.4	Very high	105 Å²	105	41.4 Å²	41.4	49%	0.491	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	133.2	168.7	50.3	160.8	-162.3	0	0	111.7	R786 A812	R786-E810 IonicContact CZ-OE1 3.35Å; R786-E810 PolarHBondContact NE-O 3.5Å; R786-E810 IonicContact NH1-OE1 3.86Å; R786-E810 IonicContact NH2-OE1 2.64Å; R786-E810 PolarHBondContact NH2-OE1 2.9Å; R786-E810 IonicContact NH2-OE2 3.33Å; R786-E810 PolarHBondContact NH2-OE2 3.45Å; E810-A812 PolarHBondContact O-N 3.41Å
811	K	92.9	Very high	91.7	Very high	66 Å²	66	42 Å²	42	29%	0.287	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	27.9	-175.9	-44.3	-177	-180	168.9	0	113.6	R786 N787 D809 F813 N814 S835 Y838	R786-K811 HydrophobicContact CG-CB 4.28Å; N787-K811 PolarHBondContact N-O 3.16Å; D809-K811 PolarHBondContact O-N 2.64Å; K811-F813 VanDerWaalsContact C-N 3.28Å; K811-F813 PolarHBondContact O-N 2.88Å; K811-N814 HydrophobicContact CB-CB 4.05Å; K811-N814 VanDerWaalsContact O-CB 3.3Å; K811-N814 WeakPolarHBondContact O-CB 3.41Å; K811-N814 PolarHBondContact O-N 3.38Å; K811-S835 PolarHBondContact N-O 3.23Å; K811-Y838 HydrophobicContact CD-CD1 3.95Å; K811-Y838 HydrophobicContact CD-CE1 4.41Å; K811-Y838 HydrophobicContact CD-CG 4.37Å; K811-Y838 HydrophobicContact CG-CD1 4.05Å; K811-Y838 HydrophobicContact CG-CG 4.1Å
812	A	92.5	Very high	91.9	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-40.5	173.1	0	0	0	0	0	112.5	L784 A788 I808 D809 E810	L784-A812 HydrophobicContact CD2-CB 4.08Å; L784-A812 HydrophobicContact CG-CB 4.3Å; A788-A812 PolarHBondContact N-O 2.94Å; I808-A812 HydrophobicContact CG2-CB 3.45Å; I808-A812 VanDerWaalsContact CG2-CB 3.45Å; D809-A812 VanDerWaalsContact O-CB 3.24Å; D809-A812 WeakPolarHBondContact O-CB 3.29Å; D809-A812 PolarHBondContact O-N 2.69Å; D809-A812 VanDerWaalsContact O-N 3.09Å; E810-A812 PolarHBondContact O-N 3.41Å
813	F	93.9	Very high	92.2	Very high	1 Å²	1	39.5 Å²	39.5	0%	0.004	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	21.9	-179.4	-56.4	-66.1	0	0	0	113.7	L784 F789 L798 L800 I808 K811 D815 L816 L822 L824 E836 F837 V840	L784-F813 HydrophobicContact CD2-CD1 4.4Å; L784-F813 HydrophobicContact CD2-CE1 3.51Å; L784-F813 HydrophobicContact CD2-CE2 4.37Å; L784-F813 HydrophobicContact CD2-CZ 3.49Å; L784-F813 VanDerWaalsContact CD2-CZ 3.49Å; F789-F813 HydrophobicContact CD2-CD1 4.35Å; F789-F813 HydrophobicContact CE2-CD1 4.47Å; F789-F813 HydrophobicContact CE2-CE1 4.27Å; L798-F813 HydrophobicContact CD2-CD1 3.98Å; L798-F813 HydrophobicContact CD2-CE1 3.83Å; L800-F813 HydrophobicContact CD1-CE1 3.94Å; L800-F813 HydrophobicContact CD1-CZ 4.24Å; I808-F813 HydrophobicContact CD1-CE2 4.18Å; I808-F813 HydrophobicContact CD1-CZ 4.18Å; I808-F813 HydrophobicContact CG2-CE2 3.88Å; I808-F813 HydrophobicContact CG2-CZ 4.33Å; K811-F813 VanDerWaalsContact C-N 3.28Å; K811-F813 PolarHBondContact O-N 2.88Å; F813-D815 PolarHBondContact O-N 3.43Å; F813-L816 HydrophobicContact CB-CD1 4.05Å; F813-L816 HydrophobicContact CD1-CD1 4.22Å; F813-L816 WeakPolarHBondContact O-CG 3.33Å; F813-L822 HydrophobicContact CD1-CD2 4.48Å; F813-L822 HydrophobicContact CD2-CD2 4.23Å; F813-L822 HydrophobicContact CE1-CD1 4.07Å; F813-L822 HydrophobicContact CE1-CD2 4.29Å; F813-L822 HydrophobicContact CE2-CD2 4.03Å; F813-L822 HydrophobicContact CG-CD2 4.45Å; F813-L822 HydrophobicContact CZ-CD1 4.29Å; F813-L822 HydrophobicContact CZ-CD2 4.08Å; F813-L824 HydrophobicContact CE2-CD1 4.38Å; F813-L824 HydrophobicContact CZ-CD1 4.3Å; F813-L824 HydrophobicContact CZ-CD2 4.14Å; F813-E836 PolarHBondContact N-O 3.1Å; F813-F837 HydrophobicContact CD2-CD1 4.02Å; F813-F837 HydrophobicContact CD2-CE1 4.1Å; F813-F837 HydrophobicContact CE2-CD1 4.48Å; F813-F837 HydrophobicContact CE2-CE1 4.09Å; F813-V840 HydrophobicContact CB-CG2 3.88Å; F813-V840 WeakPolarHBondContact O-CG2 3.46Å
814	N	91.1	Very high	92.6	Very high	31 Å²	31	39.4 Å²	39.4	17%	0.166	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	137.2	-172.7	-173.3	32.7	0	0	0	113.2	N787 K811 L816 Y838	N787-N814 VanDerWaalsContact OD1-CB 3.26Å; N787-N814 WeakPolarHBondContact OD1-CB 3.17Å; N787-N814 PolarHBondContact OD1-ND2 2.95Å; K811-N814 HydrophobicContact CB-CB 4.05Å; K811-N814 VanDerWaalsContact O-CB 3.3Å; K811-N814 WeakPolarHBondContact O-CB 3.41Å; K811-N814 PolarHBondContact O-N 3.38Å; N814-L816 PolarHBondContact O-N 2.88Å; N814-Y838 WeakPolarHBondContact OD1-CD1 3.43Å
815	D	84.4	Confident	93	Very high	59 Å²	59	31.1 Å²	31.1	32%	0.316	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.6	17.5	171.1	-141.6	33.1	0	0	0	115.7	H793 F813 A817	H793-D815 IonicContact CE1-OD2 3.18Å; H793-D815 PolarHBondContact CE1-OD2 3.21Å; H793-D815 PolarHBondContact ND1-O 2.7Å; H793-D815 IonicContact ND1-OD2 3.58Å; F813-D815 PolarHBondContact O-N 3.43Å; D815-A817 PolarHBondContact O-N 2.91Å
816	L	93.8	Very high	93.3	Very high	1 Å²	1	35 Å²	35	1%	0.005	17%	0.174	C	C	.	.			trans	-76.1	62.6	169.3	-62.6	-177.7	0	0	0	110.7	F789 R792 L795 L798 F813 N814 A818 L819 V840	F789-L816 HydrophobicContact CB-CD1 4.18Å; F789-L816 HydrophobicContact CB-CD2 3.94Å; R792-L816 HydrophobicContact CB-CD2 4.26Å; R792-L816 WeakPolarHBondContact O-CD2 3.5Å; L795-L816 HydrophobicContact CB-CD2 4.22Å; L795-L816 HydrophobicContact CD2-CD1 4.12Å; L795-L816 HydrophobicContact CD2-CD2 4.01Å; L798-L816 HydrophobicContact CD2-CD1 4.48Å; F813-L816 HydrophobicContact CB-CD1 4.05Å; F813-L816 HydrophobicContact CD1-CD1 4.22Å; F813-L816 WeakPolarHBondContact O-CG 3.33Å; N814-L816 PolarHBondContact O-N 2.88Å; L816-A818 PolarHBondContact O-N 3.45Å; L816-A818 VanDerWaalsContact O-N 3.1Å; L816-L819 HydrophobicContact CB-CB 3.89Å; L816-L819 HydrophobicContact CB-CD2 4.39Å; L816-L819 HydrophobicContact CD1-CD2 4Å; L816-L819 WeakPolarHBondContact O-CB 3.37Å; L816-L819 PolarHBondContact O-N 3.41Å; L816-V840 HydrophobicContact CB-CG1 4.33Å
817	A	89	Confident	93.5	Very high	44 Å²	44	34.3 Å²	34.3	36%	0.364	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-17.8	-170.9	0	0	0	0	0	114.7	D815 K842	D815-A817 PolarHBondContact O-N 2.91Å; A817-K842 WeakPolarHBondContact O-CD 3.38Å; A817-K842 VanDerWaalsContact O-CE 3.31Å; A817-K842 WeakPolarHBondContact O-CE 3.06Å; A817-K842 WeakPolarHBondContact O-CG 3.06Å
818	A	93.5	Very high	93.6	Very high	21 Å²	21	28.8 Å²	28.8	17%	0.174	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-8.6	177	0	0	0	0	0	113.9	H793 L795 R796 L816 W820	H793-A818 WeakPolarHBondContact O-CB 3.29Å; L795-A818 CarbonylContact O-C 3.2Å; L795-A818 WeakPolarHBondContact O-CB 3.41Å; R796-A818 WeakPolarHBondContact CA-O 3.14Å; R796-A818 HydrophobicContact CG-CB 4.18Å; L816-A818 PolarHBondContact O-N 3.45Å; L816-A818 VanDerWaalsContact O-N 3.1Å; A818-W820 PolarHBondContact O-N 3.12Å
819	L	96.5	Very high	93.6	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.144	C	C	.	.			trans	-70.7	119.3	-171.4	-169.9	76.9	0	0	0	110.6	L795 L798 L816 L821 L822 V840 K842 V843	L795-L819 HydrophobicContact CD2-CD1 4.4Å; L795-L819 HydrophobicContact CG-CD1 4.08Å; L795-L819 VanDerWaalsContact O-CA 3.26Å; L795-L819 WeakPolarHBondContact O-CA 3.46Å; L795-L819 PolarHBondContact O-N 2.89Å; L798-L819 HydrophobicContact CB-CD1 3.67Å; L816-L819 HydrophobicContact CB-CB 3.89Å; L816-L819 HydrophobicContact CB-CD2 4.39Å; L816-L819 HydrophobicContact CD1-CD2 4Å; L816-L819 WeakPolarHBondContact O-CB 3.37Å; L816-L819 PolarHBondContact O-N 3.41Å; L819-L821 WeakPolarHBondContact CD1-O 3.35Å; L819-L822 HydrophobicContact CD2-CB 4.19Å; L819-L822 HydrophobicContact CD2-CD2 4.37Å; L819-V840 HydrophobicContact CB-CG1 3.93Å; L819-V840 HydrophobicContact CD2-CG1 3.87Å; L819-V840 HydrophobicContact CG-CG1 4.43Å; L819-K842 CarbonylContact O-C 3.12Å; L819-K842 WeakPolarHBondContact O-CB 3.12Å; L819-V843 HydrophobicContact CD2-CG2 4.18Å; L819-V843 HydrophobicContact CG-CG2 4.34Å; L819-V843 PolarHBondContact O-N 3.22Å; L819-V843 VanDerWaalsContact O-N 3.11Å
820	W	96	Very high	93.6	Very high	85 Å²	85	32.8 Å²	32.8	32%	0.322	16%	0.164	S	C	.	.			trans	-117.3	-23	178.5	72.2	-91.7	0	0	0	113.5	R796 Q797 A818 K842 T844 H845	R796-W820 PolarHBondContact O-N 2.95Å; Q797-W820 HydrophobicContact CG-CZ2 3.95Å; A818-W820 PolarHBondContact O-N 3.12Å; W820-K842 VanDerWaalsContact CA-O 3.3Å; W820-K842 WeakPolarHBondContact CA-O 3.42Å; W820-K842 WeakPolarHBondContact CB-O 3.46Å; W820-T844 PolarHBondContact O-N 3.15Å; W820-T844 PolarHBondContact O-OG1 3.14Å; W820-H845 AromaticContact CE3-ND1 3.6Å; W820-H845 AromaticContact CZ3-CE1 3.79Å; W820-H845 AromaticContact CZ3-CG 3.97Å; W820-H845 AromaticContact CZ3-ND1 3.46Å; W820-H845 WeakPolarHBondContact CZ3-ND1 3.33Å; W820-H845 PolarHBondContact O-N 3.25Å
821	L	97.6	Very high	93.5	Very high	13 Å²	13	31.7 Å²	31.7	7%	0.068	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	126.4	175.5	-174	154.8	0	0	0	109.8	R796 Q797 L798 Y799 L819 H845 F847	R796-L821 PolarHBondContact O-N 3.43Å; Q797-L821 WeakPolarHBondContact CA-O 3.29Å; Q797-L821 HydrophobicContact CB-CB 4.42Å; Q797-L821 HydrophobicContact CG-CB 4.18Å; L798-L821 PolarHBondContact N-O 3.46Å; Y799-L821 HydrophobicContact CD1-CD2 4.26Å; Y799-L821 HydrophobicContact CE1-CD2 3.71Å; Y799-L821 HydrophobicContact CE2-CD2 4.1Å; L819-L821 WeakPolarHBondContact CD1-O 3.35Å; L821-H845 WeakPolarHBondContact CA-O 3.08Å; L821-H845 HydrophobicContact CB-CB 4.37Å; L821-H845 HydrophobicContact CD1-CB 4.46Å; L821-H845 HydrophobicContact CG-CB 4.13Å; L821-F847 HydrophobicContact CD1-CE2 4.11Å; L821-F847 HydrophobicContact CD2-CE2 4.25Å; L821-F847 HydrophobicContact CG-CE2 4.01Å
822	L	97	Very high	93.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	118.5	174.6	176.9	56.3	0	0	0	110.1	L798 F813 L819 L824 F837 H845 L846 F847	L798-L822 HydrophobicContact CB-CD1 4.03Å; L798-L822 HydrophobicContact CD2-CD1 3.88Å; L798-L822 HydrophobicContact CG-CD1 3.94Å; L798-L822 WeakPolarHBondContact O-CA 3.44Å; F813-L822 HydrophobicContact CD1-CD2 4.48Å; F813-L822 HydrophobicContact CD2-CD2 4.23Å; F813-L822 HydrophobicContact CE1-CD1 4.07Å; F813-L822 HydrophobicContact CE1-CD2 4.29Å; F813-L822 HydrophobicContact CE2-CD2 4.03Å; F813-L822 HydrophobicContact CG-CD2 4.45Å; F813-L822 HydrophobicContact CZ-CD1 4.29Å; F813-L822 HydrophobicContact CZ-CD2 4.08Å; L819-L822 HydrophobicContact CD2-CB 4.19Å; L819-L822 HydrophobicContact CD2-CD2 4.37Å; L822-L824 HydrophobicContact CD1-CG 4.23Å; L822-L824 HydrophobicContact CD2-CD1 4.15Å; L822-L824 HydrophobicContact CG-CD1 4.26Å; L822-L824 HydrophobicContact CG-CG 4.13Å; L822-F837 HydrophobicContact CD2-CD1 4.12Å; L822-F837 HydrophobicContact CD2-CE1 3.59Å; L822-H845 PolarHBondContact N-O 3.38Å; L822-L846 HydrophobicContact CB-CD1 4.12Å; L822-L846 HydrophobicContact CD2-CD1 4.04Å; L822-L846 HydrophobicContact CG-CD1 4.01Å; L822-L846 WeakPolarHBondContact O-CA 3.48Å; L822-F847 PolarHBondContact O-N 2.94Å
823	D	96.6	Very high	93.4	Very high	19 Å²	19	31.9 Å²	31.9	10%	0.102	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	116.2	176.5	-166.2	-12.4	0	0	0	110.9	L798 Y799 L800 S825 F847	L798-D823 PolarHBondContact O-N 3.07Å; Y799-D823 HydrophobicContact CD1-CB 3.75Å; Y799-D823 HydrophobicContact CE1-CB 4.47Å; Y799-D823 HydrophobicContact CG-CB 4.34Å; L800-D823 CarbonylContact C-O 3.59Å; L800-D823 WeakPolarHBondContact CA-O 3.42Å; L800-D823 PolarHBondContact N-O 3.28Å; D823-S825 VanDerWaalsContact OD1-CB 3.24Å; D823-S825 WeakPolarHBondContact OD1-CB 3.17Å; D823-S825 PolarHBondContact OD1-N 3.05Å; D823-S825 PolarHBondContact OD1-OG 3.25Å; D823-F847 HydrophobicContact CB-CB 4.28Å; D823-F847 HydrophobicContact CB-CD2 3.94Å; D823-F847 WeakPolarHBondContact OD1-CB 3.25Å
824	L	95.7	Very high	93.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.171	C	C	.	.			trans	-121.1	15.7	176.4	-70.5	171.4	0	0	0	110.6	L800 L805 I808 F813 L822 N827 L829 F837 L846 F847 L848 N851	L800-L824 HydrophobicContact CB-CD2 3.98Å; L800-L824 HydrophobicContact CD1-CD2 3.91Å; L805-L824 HydrophobicContact CD1-CD2 4.27Å; I808-L824 HydrophobicContact CD1-CD1 3.82Å; I808-L824 HydrophobicContact CD1-CD2 3.83Å; I808-L824 HydrophobicContact CD1-CG 4.49Å; F813-L824 HydrophobicContact CE2-CD1 4.38Å; F813-L824 HydrophobicContact CZ-CD1 4.3Å; F813-L824 HydrophobicContact CZ-CD2 4.14Å; L822-L824 HydrophobicContact CD1-CG 4.23Å; L822-L824 HydrophobicContact CD2-CD1 4.15Å; L822-L824 HydrophobicContact CG-CD1 4.26Å; L822-L824 HydrophobicContact CG-CG 4.13Å; L824-N827 PolarHBondContact O-ND2 2.84Å; L824-L829 HydrophobicContact CB-CD1 4.21Å; L824-L829 HydrophobicContact CD1-CD1 4.47Å; L824-F837 HydrophobicContact CD1-CZ 4.45Å; L824-L846 HydrophobicContact CD1-CD1 4.37Å; L824-F847 CarbonylContact C-O 3.52Å; L824-F847 WeakPolarHBondContact CA-O 3.49Å; L824-F847 WeakPolarHBondContact CB-O 3.46Å; L824-F847 PolarHBondContact N-O 3.19Å; L824-L848 HydrophobicContact CB-CD2 3.79Å; L824-L848 HydrophobicContact CD1-CD2 4Å; L824-N851 PolarHBondContact O-ND2 3.09Å
825	S	95.9	Very high	93.2	Very high	4 Å²	4	32 Å²	32	3%	0.028	18%	0.175	C	C	.	.			trans	-64.8	162.4	-178.5	62.2	0	0	0	0	113.5	N801 S802 D823 N827 F847 H849	N801-S825 CarbonylContact C-O 3.53Å; N801-S825 WeakPolarHBondContact CA-O 3.4Å; N801-S825 WeakPolarHBondContact CB-O 3.46Å; N801-S825 WeakPolarHBondContact CB-OG 3.17Å; S802-S825 PolarHBondContact N-O 3.32Å; D823-S825 VanDerWaalsContact OD1-CB 3.24Å; D823-S825 WeakPolarHBondContact OD1-CB 3.17Å; D823-S825 PolarHBondContact OD1-N 3.05Å; D823-S825 PolarHBondContact OD1-OG 3.25Å; S825-N827 VanDerWaalsContact C-N 3.25Å; S825-N827 PolarHBondContact O-N 3.5Å; S825-N827 PolarHBondContact O-ND2 3.15Å; S825-N827 VanDerWaalsContact O-ND2 3.13Å; S825-F847 PolarHBondContact N-O 3.11Å; S825-H849 CarbonylContact C-O 3.58Å; S825-H849 VanDerWaalsContact CA-O 3.23Å; S825-H849 WeakPolarHBondContact CA-O 3.34Å; S825-H849 WeakPolarHBondContact CB-CE1 3.15Å; S825-H849 WeakPolarHBondContact CB-ND1 3.48Å; S825-H849 WeakPolarHBondContact CB-NE2 3.23Å; S825-H849 WeakPolarHBondContact CB-O 3.44Å; S825-H849 PolarHBondContact OG-CE1 2.92Å
826	E	94.4	Very high	93.7	Very high	81 Å²	81	29.6 Å²	29.6	38%	0.379	16%	0.162	S	C	.	.	S	Bend	trans	58.2	33.1	175	-57	-161.7	-178.3	0	0	114.5	S802 H849 K850	S802-E826 VanDerWaalsContact CA-O 3.24Å; S802-E826 WeakPolarHBondContact CA-O 3.36Å; S802-E826 PolarHBondContact N-O 3.18Å; S802-E826 WeakPolarHBondContact OG-CB 3.49Å; S802-E826 PolarHBondContact OG-OE2 2.88Å; S802-E826 VanDerWaalsContact OG-OE2 3.14Å; E826-H849 PolarHBondContact N-O 2.8Å; E826-K850 CarbonylContact C-O 3.51Å; E826-K850 WeakPolarHBondContact CA-O 3.49Å; E826-K850 HydrophobicContact CB-CB 4.48Å; E826-K850 HydrophobicContact CG-CB 3.89Å; E826-K850 HydrophobicContact CG-CD 3.56Å; E826-K850 HydrophobicContact CG-CG 4.41Å; E826-K850 PolarHBondContact N-O 3.22Å; E826-K850 WeakPolarHBondContact OE1-CD 3.43Å; E826-K850 IonicContact OE1-NZ 3.7Å; E826-K850 PolarHBondContact OE1-NZ 3.06Å
827	N	93.2	Very high	93.6	Very high	9 Å²	9	29.6 Å²	29.6	5%	0.048	16%	0.162	C	C	.	.	S	Bend	trans	-108.1	-170.3	176.8	-79.8	-66.7	0	0	0	111.2	L800 S803 R804 L805 L824 S825 L829 K850 N851	L800-N827 PolarHBondContact O-ND2 2.98Å; S803-N827 WeakPolarHBondContact CA-OD1 3.29Å; S803-N827 WeakPolarHBondContact CB-OD1 3.35Å; S803-N827 PolarHBondContact N-OD1 3.4Å; R804-N827 PolarHBondContact N-OD1 2.9Å; L805-N827 HydrophobicContact CB-CB 4.16Å; L805-N827 PolarHBondContact N-OD1 2.87Å; L824-N827 PolarHBondContact O-ND2 2.84Å; S825-N827 VanDerWaalsContact C-N 3.25Å; S825-N827 PolarHBondContact O-N 3.5Å; S825-N827 PolarHBondContact O-ND2 3.15Å; S825-N827 VanDerWaalsContact O-ND2 3.13Å; N827-L829 HydrophobicContact CB-CG 4.15Å; N827-K850 PolarHBondContact N-O 2.88Å; N827-N851 VanDerWaalsContact CA-OD1 3.29Å; N827-N851 WeakPolarHBondContact CA-OD1 3.25Å; N827-N851 WeakPolarHBondContact CB-OD1 3.42Å; N827-N851 PolarHBondContact N-OD1 2.8Å; N827-N851 WeakPolarHBondContact O-CA 3.18Å; N827-N851 PolarHBondContact O-OD1 2.87Å
828	E	92.2	Very high	93.7	Very high	41 Å²	41	31.4 Å²	31.4	19%	0.192	16%	0.16	C	C	.	.			trans	-110.1	23.4	178.6	-57.2	-169.8	149.6	0	0	112.1	R782 L805 E830 R852	R782-E828 IonicContact CZ-OE2 3.71Å; R782-E828 IonicContact NH1-OE1 3.6Å; R782-E828 IonicContact NH1-OE2 2.7Å; R782-E828 PolarHBondContact NH1-OE2 2.93Å; L805-E828 CarbonylContact O-C 3.45Å; L805-E828 VanDerWaalsContact O-CA 3.32Å; L805-E828 WeakPolarHBondContact O-CA 3.24Å; L805-E828 PolarHBondContact O-N 2.86Å; E828-E830 PolarHBondContact O-N 3.17Å; E828-R852 VanDerWaalsContact CD-NH2 3.26Å; E828-R852 IonicContact OE1-CZ 2.82Å; E828-R852 IonicContact OE1-NH2 3.23Å; E828-R852 PolarHBondContact OE1-NH2 2.95Å; E828-R852 IonicContact OE2-NH2 3.84Å
829	L	94.1	Very high	93.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.174	C	C	.	.			trans	-64.5	122.5	-172.7	-61.2	172.8	0	0	0	110.8	L805 I808 L824 N827 L848 N851 R852 L853	L805-L829 HydrophobicContact CB-CD2 4.04Å; L805-L829 WeakPolarHBondContact O-CD2 3.48Å; L805-L829 PolarHBondContact O-N 3.38Å; L805-L829 VanDerWaalsContact O-N 3.13Å; I808-L829 HydrophobicContact CD1-CD1 3.98Å; I808-L829 HydrophobicContact CD1-CD2 3.92Å; I808-L829 HydrophobicContact CG1-CD2 3.81Å; L824-L829 HydrophobicContact CB-CD1 4.21Å; L824-L829 HydrophobicContact CD1-CD1 4.47Å; N827-L829 HydrophobicContact CB-CG 4.15Å; L829-L848 HydrophobicContact CD1-CD2 4.43Å; L829-N851 HydrophobicContact CB-CB 4.39Å; L829-N851 VanDerWaalsContact CB-OD1 3.28Å; L829-N851 WeakPolarHBondContact CB-OD1 3.24Å; L829-N851 WeakPolarHBondContact CG-OD1 3.14Å; L829-N851 PolarHBondContact N-OD1 3.33Å; L829-R852 CarbonylContact O-C 3.52Å; L829-R852 VanDerWaalsContact O-CA 3.29Å; L829-R852 WeakPolarHBondContact O-CA 3.25Å; L829-R852 PolarHBondContact O-N 3.03Å; L829-L853 HydrophobicContact CB-CD2 4.16Å; L829-L853 WeakPolarHBondContact O-CD2 3.32Å; L829-L853 PolarHBondContact O-N 3.45Å; L829-L853 VanDerWaalsContact O-N 3.09Å
830	E	92.6	Very high	93.1	Very high	108 Å²	108	35.7 Å²	35.7	51%	0.505	18%	0.175	S	C	.	.			trans	-94.2	-29.9	178.1	-63.7	-176.9	174.4	0	0	112.3	E828 R852	E828-E830 PolarHBondContact O-N 3.17Å; E830-R852 HydrophobicContact CG-CB 4.02Å
831	T	90.8	Very high	92.7	Very high	83 Å²	83	34.9 Å²	34.9	51%	0.509	18%	0.18	S	C	.	.			trans	-140.6	145.2	-177.2	68.4	0	0	0	0	111.9
832	L	93	Very high	92.4	Very high	4 Å²	4	40 Å²	40	2%	0.021	20%	0.202	C	C	.	.			trans	-139.5	116.4	166.8	-78.4	174.8	0	0	0	108.4	I808 E836 F837 L848 L853 G857 L860	I808-L832 HydrophobicContact CD1-CD2 4.24Å; L832-E836 HydrophobicContact CD2-CG 4.47Å; L832-F837 HydrophobicContact CD2-CE2 4.38Å; L832-F837 HydrophobicContact CD2-CZ 4.37Å; L832-L848 HydrophobicContact CD1-CD1 3.66Å; L832-L848 HydrophobicContact CD1-CD2 3.37Å; L832-L848 HydrophobicContact CD1-CG 4.18Å; L832-L853 HydrophobicContact CB-CD2 4.46Å; L832-L853 HydrophobicContact CD1-CD1 4.1Å; L832-L853 HydrophobicContact CD1-CD2 4.35Å; L832-L853 HydrophobicContact CG-CD2 4.15Å; L832-G857 PolarHBondContact O-N 3.43Å; L832-L860 HydrophobicContact CB-CD1 4.4Å
833	T	90.5	Very high	92.3	Very high	66 Å²	66	40 Å²	40	41%	0.405	20%	0.202	S	C	.	.			trans	-88.6	-25.9	-174.4	60.1	0	0	0	0	113.2	S835 E836 Y859	T833-S835 PolarHBondContact OG1-N 3.34Å; T833-S835 PolarHBondContact OG1-OG 3.15Å; T833-E836 PolarHBondContact N-OE1 3.17Å; T833-E836 PolarHBondContact N-OE2 3.24Å; T833-E836 VanDerWaalsContact OG1-CD 3.28Å; T833-E836 PolarHBondContact OG1-OE1 3.06Å; T833-E836 PolarHBondContact OG1-OE2 3.14Å; T833-Y859 WeakPolarHBondContact O-CB 3.39Å
834	G	89.4	Confident	92.3	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.203	C	C	.	.	S	Bend	trans	103.9	-24.2	-168.7	0	0	0	0	0	113.2	E836 F837 Y859 Q863	G834-E836 VanDerWaalsContact C-OE2 3.23Å; G834-E836 VanDerWaalsContact CA-OE2 3.31Å; G834-E836 WeakPolarHBondContact CA-OE2 3.43Å; G834-E836 PolarHBondContact N-OE2 3.25Å; G834-E836 PolarHBondContact O-N 3.32Å; G834-F837 PolarHBondContact O-N 2.93Å; G834-F837 VanDerWaalsContact O-N 3.17Å; G834-Y859 VanDerWaalsContact C-CD1 3.47Å; G834-Q863 WeakPolarHBondContact O-CG 3.34Å
835	S	92	Very high	92.4	Very high	35 Å²	35	42.5 Å²	42.5	25%	0.245	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-68.1	-19.1	-177.7	67.9	0	0	0	0	113	K811 T833 F837	K811-S835 PolarHBondContact N-O 3.23Å; T833-S835 PolarHBondContact OG1-N 3.34Å; T833-S835 PolarHBondContact OG1-OG 3.15Å; S835-F837 VanDerWaalsContact C-N 3.26Å; S835-F837 PolarHBondContact O-N 2.99Å
836	E	93.5	Very high	92.4	Very high	8 Å²	8	42.3 Å²	42.3	4%	0.037	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-65.3	-30.6	175.4	-51.7	81.8	-176.3	0	0	111.3	I808 F813 L832 T833 G834 Y838	I808-E836 HydrophobicContact CB-CG 4.09Å; I808-E836 HydrophobicContact CG2-CB 3.84Å; I808-E836 HydrophobicContact CG2-CG 3.79Å; F813-E836 PolarHBondContact N-O 3.1Å; L832-E836 HydrophobicContact CD2-CG 4.47Å; T833-E836 PolarHBondContact N-OE1 3.17Å; T833-E836 PolarHBondContact N-OE2 3.24Å; T833-E836 VanDerWaalsContact OG1-CD 3.28Å; T833-E836 PolarHBondContact OG1-OE1 3.06Å; T833-E836 PolarHBondContact OG1-OE2 3.14Å; G834-E836 VanDerWaalsContact C-OE2 3.23Å; G834-E836 VanDerWaalsContact CA-OE2 3.31Å; G834-E836 WeakPolarHBondContact CA-OE2 3.43Å; G834-E836 PolarHBondContact N-OE2 3.25Å; G834-E836 PolarHBondContact O-N 3.32Å; E836-Y838 PolarHBondContact O-N 3.49Å
837	F	92.1	Very high	92.6	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-95.7	24.4	-175.6	-51.1	-80.3	0	0	0	114.1	F813 L822 L824 L832 G834 S835 K839 V840 L846 L860 Q863 L864	F813-F837 HydrophobicContact CD2-CD1 4.02Å; F813-F837 HydrophobicContact CD2-CE1 4.1Å; F813-F837 HydrophobicContact CE2-CD1 4.48Å; F813-F837 HydrophobicContact CE2-CE1 4.09Å; L822-F837 HydrophobicContact CD2-CD1 4.12Å; L822-F837 HydrophobicContact CD2-CE1 3.59Å; L824-F837 HydrophobicContact CD1-CZ 4.45Å; L832-F837 HydrophobicContact CD2-CE2 4.38Å; L832-F837 HydrophobicContact CD2-CZ 4.37Å; G834-F837 PolarHBondContact O-N 2.93Å; G834-F837 VanDerWaalsContact O-N 3.17Å; S835-F837 VanDerWaalsContact C-N 3.26Å; S835-F837 PolarHBondContact O-N 2.99Å; F837-K839 PolarHBondContact O-N 2.62Å; F837-V840 PolarHBondContact O-N 3.33Å; F837-L846 HydrophobicContact CE1-CD1 4.23Å; F837-L846 HydrophobicContact CZ-CD1 4.44Å; F837-L846 HydrophobicContact CZ-CD2 4.3Å; F837-L860 HydrophobicContact CD2-CD1 4.2Å; F837-L860 HydrophobicContact CD2-CG 4.27Å; F837-L860 HydrophobicContact CE2-CD1 3.53Å; F837-L860 HydrophobicContact CE2-CG 4.08Å; F837-L860 HydrophobicContact CZ-CD1 4.23Å; F837-Q863 HydrophobicContact CB-CB 4.18Å; F837-L864 HydrophobicContact CB-CD2 3.82Å; F837-L864 HydrophobicContact CB-CG 4.32Å; F837-L864 HydrophobicContact CD1-CD1 4.23Å; F837-L864 HydrophobicContact CD1-CD2 4.34Å; F837-L864 HydrophobicContact CD2-CD1 4.45Å; F837-L864 HydrophobicContact CG-CD1 4.2Å; F837-L864 HydrophobicContact CG-CD2 4.16Å; F837-L864 HydrophobicContact CG-CG 4.35Å
838	Y	90.3	Very high	92.8	Very high	83 Å²	83	40.1 Å²	40.1	33%	0.325	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	127.1	177.9	-177.1	-104.1	0	0	0	111.8	K811 N814 E836 V840	K811-Y838 HydrophobicContact CD-CD1 3.95Å; K811-Y838 HydrophobicContact CD-CE1 4.41Å; K811-Y838 HydrophobicContact CD-CG 4.37Å; K811-Y838 HydrophobicContact CG-CD1 4.05Å; K811-Y838 HydrophobicContact CG-CG 4.1Å; N814-Y838 WeakPolarHBondContact OD1-CD1 3.43Å; E836-Y838 PolarHBondContact O-N 3.49Å; Y838-V840 PolarHBondContact O-N 3.4Å
839	K	87.4	Confident	93	Very high	110 Å²	110	39.6 Å²	39.6	48%	0.478	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	59	37.3	-177.7	-70.1	-176	168	-168.5	0	115.1	F837 P841	F837-K839 PolarHBondContact O-N 2.62Å; K839-P841 WeakPolarHBondContact O-CD 3.31Å
840	V	91.1	Very high	93.1	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.006	22%	0.219	C	C	.	.			trans	-116.7	61.3	173.6	-157.5	0	0	0	0	111.7	F813 L816 L819 F837 Y838 K842 V843	F813-V840 HydrophobicContact CB-CG2 3.88Å; F813-V840 WeakPolarHBondContact O-CG2 3.46Å; L816-V840 HydrophobicContact CB-CG1 4.33Å; L819-V840 HydrophobicContact CB-CG1 3.93Å; L819-V840 HydrophobicContact CD2-CG1 3.87Å; L819-V840 HydrophobicContact CG-CG1 4.43Å; F837-V840 PolarHBondContact O-N 3.33Å; Y838-V840 PolarHBondContact O-N 3.4Å; V840-K842 VanDerWaalsContact C-N 3.28Å; V840-K842 PolarHBondContact O-N 3.23Å; V840-V843 HydrophobicContact CB-CG2 4.35Å; V840-V843 HydrophobicContact CG1-CG2 3.48Å; V840-V843 VanDerWaalsContact CG1-CG2 3.48Å
841	P	86.7	Confident	93.3	Very high	68 Å²	68	39.5 Å²	39.5	44%	0.442	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-15	-164.4	30.6	-37.7	0	0	0	114.8	K839 N866	K839-P841 WeakPolarHBondContact O-CD 3.31Å; P841-N866 PolarHBondContact O-ND2 3.38Å
842	K	92.6	Very high	93.5	Very high	119 Å²	119	39.3 Å²	39.3	52%	0.517	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-2.6	-172.3	-67.2	-164.6	-171.4	173.5	0	114.4	A817 L819 W820 V840 T844	A817-K842 WeakPolarHBondContact O-CD 3.38Å; A817-K842 VanDerWaalsContact O-CE 3.31Å; A817-K842 WeakPolarHBondContact O-CE 3.06Å; A817-K842 WeakPolarHBondContact O-CG 3.06Å; L819-K842 CarbonylContact O-C 3.12Å; L819-K842 WeakPolarHBondContact O-CB 3.12Å; W820-K842 VanDerWaalsContact CA-O 3.3Å; W820-K842 WeakPolarHBondContact CA-O 3.42Å; W820-K842 WeakPolarHBondContact CB-O 3.46Å; V840-K842 VanDerWaalsContact C-N 3.28Å; V840-K842 PolarHBondContact O-N 3.23Å; K842-T844 PolarHBondContact O-N 3.33Å; K842-T844 VanDerWaalsContact O-N 3.13Å
843	V	95.2	Very high	93.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.187	C	C	.	.			trans	-62.6	119.1	179.9	177.9	0	0	0	0	109.5	L819 V840 L846 L864 N866 L867	L819-V843 HydrophobicContact CD2-CG2 4.18Å; L819-V843 HydrophobicContact CG-CG2 4.34Å; L819-V843 PolarHBondContact O-N 3.22Å; L819-V843 VanDerWaalsContact O-N 3.11Å; V840-V843 HydrophobicContact CB-CG2 4.35Å; V840-V843 HydrophobicContact CG1-CG2 3.48Å; V840-V843 VanDerWaalsContact CG1-CG2 3.48Å; V843-L846 HydrophobicContact CG1-CB 4.32Å; V843-L864 HydrophobicContact CB-CD2 3.93Å; V843-L864 HydrophobicContact CG1-CD1 4.37Å; V843-L864 HydrophobicContact CG2-CD2 4.27Å; V843-N866 CarbonylContact O-C 3.56Å; V843-L867 HydrophobicContact CG1-CD1 4.24Å
844	T	95.6	Very high	93.8	Very high	21 Å²	21	38.6 Å²	38.6	13%	0.129	19%	0.189	C	C	.	.			trans	-113	-25.3	175.8	54.9	0	0	0	0	111.3	W820 K842 N866 R868 V869	W820-T844 PolarHBondContact O-N 3.15Å; W820-T844 PolarHBondContact O-OG1 3.14Å; K842-T844 PolarHBondContact O-N 3.33Å; K842-T844 VanDerWaalsContact O-N 3.13Å; T844-N866 HydrophobicContact CG2-CB 4.29Å; T844-N866 WeakPolarHBondContact CG2-O 3.42Å; T844-R868 HydrophobicContact CG2-CG 4.4Å; T844-R868 WeakPolarHBondContact O-CA 3.4Å; T844-R868 PolarHBondContact O-N 2.79Å; T844-V869 PolarHBondContact O-N 3.13Å
845	H	97.6	Very high	93.8	Very high	51 Å²	51	42.7 Å²	42.7	24%	0.236	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	115.4	-179.8	-64	68.7	0	0	0	109.5	W820 L821 L822 F847 V869	W820-H845 AromaticContact CE3-ND1 3.6Å; W820-H845 AromaticContact CZ3-CE1 3.79Å; W820-H845 AromaticContact CZ3-CG 3.97Å; W820-H845 AromaticContact CZ3-ND1 3.46Å; W820-H845 WeakPolarHBondContact CZ3-ND1 3.33Å; W820-H845 PolarHBondContact O-N 3.25Å; L821-H845 WeakPolarHBondContact CA-O 3.08Å; L821-H845 HydrophobicContact CB-CB 4.37Å; L821-H845 HydrophobicContact CD1-CB 4.46Å; L821-H845 HydrophobicContact CG-CB 4.13Å; L822-H845 PolarHBondContact N-O 3.38Å; H845-F847 HydrophobicContact CB-CE2 4.18Å; H845-F847 HydrophobicContact CB-CZ 4.42Å; H845-V869 HydrophobicContact CB-CB 4.49Å; H845-V869 VanDerWaalsContact CD2-CG2 3.49Å; H845-V869 WeakPolarHBondContact CD2-CG2 3.45Å
846	L	97	Very high	93.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	113.7	177.7	179.9	60.2	0	0	0	109.8	L822 L824 F837 V843 L848 L860 L864 L867 V869 L870 T871	L822-L846 HydrophobicContact CB-CD1 4.12Å; L822-L846 HydrophobicContact CD2-CD1 4.04Å; L822-L846 HydrophobicContact CG-CD1 4.01Å; L822-L846 WeakPolarHBondContact O-CA 3.48Å; L824-L846 HydrophobicContact CD1-CD1 4.37Å; F837-L846 HydrophobicContact CE1-CD1 4.23Å; F837-L846 HydrophobicContact CZ-CD1 4.44Å; F837-L846 HydrophobicContact CZ-CD2 4.3Å; V843-L846 HydrophobicContact CG1-CB 4.32Å; L846-L848 HydrophobicContact CD1-CG 4.33Å; L846-L848 HydrophobicContact CD2-CD1 3.86Å; L846-L848 HydrophobicContact CD2-CG 4.32Å; L846-L848 HydrophobicContact CG-CD1 4.06Å; L846-L848 HydrophobicContact CG-CG 3.99Å; L846-L860 HydrophobicContact CD2-CD1 4.35Å; L846-L860 HydrophobicContact CD2-CD2 4.43Å; L846-L864 HydrophobicContact CD2-CD1 3.67Å; L846-L867 HydrophobicContact CB-CD1 3.65Å; L846-V869 PolarHBondContact N-O 2.99Å; L846-L870 HydrophobicContact CB-CD1 4.24Å; L846-L870 HydrophobicContact CD2-CD1 4.1Å; L846-L870 HydrophobicContact CG-CD1 4.19Å; L846-L870 WeakPolarHBondContact O-CA 3.31Å; L846-T871 PolarHBondContact O-N 2.97Å
847	F	97.8	Very high	93.4	Very high	45 Å²	45	41.9 Å²	41.9	20%	0.197	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	117.7	178.5	-56	-81.6	0	0	0	110.6	L821 L822 D823 L824 S825 H845 V869 T871	L821-F847 HydrophobicContact CD1-CE2 4.11Å; L821-F847 HydrophobicContact CD2-CE2 4.25Å; L821-F847 HydrophobicContact CG-CE2 4.01Å; L822-F847 PolarHBondContact O-N 2.94Å; D823-F847 HydrophobicContact CB-CB 4.28Å; D823-F847 HydrophobicContact CB-CD2 3.94Å; D823-F847 WeakPolarHBondContact OD1-CB 3.25Å; L824-F847 CarbonylContact C-O 3.52Å; L824-F847 WeakPolarHBondContact CA-O 3.49Å; L824-F847 WeakPolarHBondContact CB-O 3.46Å; L824-F847 PolarHBondContact N-O 3.19Å; S825-F847 PolarHBondContact N-O 3.11Å; H845-F847 HydrophobicContact CB-CE2 4.18Å; H845-F847 HydrophobicContact CB-CZ 4.42Å; F847-V869 HydrophobicContact CE1-CG1 4.42Å; F847-T871 VanDerWaalsContact CA-OG1 3.25Å; F847-T871 WeakPolarHBondContact CA-OG1 3.49Å; F847-T871 HydrophobicContact CD1-CG2 3.52Å; F847-T871 HydrophobicContact CE1-CG2 4Å
848	L	97.1	Very high	92.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.236	C	C	.	.			trans	-127.6	11.2	-179	-69.8	173.2	0	0	0	113.4	L824 L829 L832 L846 N851 L853 I856 L870 T871 L872 N875	L824-L848 HydrophobicContact CB-CD2 3.79Å; L824-L848 HydrophobicContact CD1-CD2 4Å; L829-L848 HydrophobicContact CD1-CD2 4.43Å; L832-L848 HydrophobicContact CD1-CD1 3.66Å; L832-L848 HydrophobicContact CD1-CD2 3.37Å; L832-L848 HydrophobicContact CD1-CG 4.18Å; L846-L848 HydrophobicContact CD1-CG 4.33Å; L846-L848 HydrophobicContact CD2-CD1 3.86Å; L846-L848 HydrophobicContact CD2-CG 4.32Å; L846-L848 HydrophobicContact CG-CD1 4.06Å; L846-L848 HydrophobicContact CG-CG 3.99Å; L848-N851 PolarHBondContact O-ND2 3.14Å; L848-L853 HydrophobicContact CB-CD1 4.17Å; L848-L853 HydrophobicContact CD1-CD1 4.26Å; L848-L853 HydrophobicContact CD2-CD1 4.4Å; L848-I856 HydrophobicContact CD1-CD1 4.45Å; L848-L870 HydrophobicContact CD1-CD1 4.02Å; L848-T871 CarbonylContact C-O 3.46Å; L848-T871 VanDerWaalsContact CA-O 3.27Å; L848-T871 WeakPolarHBondContact CA-O 3.29Å; L848-T871 WeakPolarHBondContact CB-O 3.43Å; L848-T871 PolarHBondContact N-O 3.11Å; L848-T871 PolarHBondContact N-OG1 3.04Å; L848-T871 VanDerWaalsContact N-OG1 3.11Å; L848-L872 HydrophobicContact CB-CD2 4.06Å; L848-L872 HydrophobicContact CD1-CD2 4.19Å; L848-N875 PolarHBondContact O-ND2 2.67Å
849	H	97.1	Very high	92.8	Very high	30 Å²	30	47.6 Å²	47.6	14%	0.139	24%	0.241	C	C	.	.			trans	-68.2	158.5	-176.8	62.4	-86.3	0	0	0	111.5	S825 E826 N851 T871 H873	S825-H849 CarbonylContact C-O 3.58Å; S825-H849 VanDerWaalsContact CA-O 3.23Å; S825-H849 WeakPolarHBondContact CA-O 3.34Å; S825-H849 WeakPolarHBondContact CB-CE1 3.15Å; S825-H849 WeakPolarHBondContact CB-ND1 3.48Å; S825-H849 WeakPolarHBondContact CB-NE2 3.23Å; S825-H849 WeakPolarHBondContact CB-O 3.44Å; S825-H849 PolarHBondContact OG-CE1 2.92Å; E826-H849 PolarHBondContact N-O 2.8Å; H849-N851 PolarHBondContact O-N 2.76Å; H849-N851 PolarHBondContact O-ND2 2.83Å; H849-T871 PolarHBondContact N-O 3.46Å; H849-T871 PolarHBondContact N-OG1 2.04Å; H849-T871 PolarHBondContact ND1-OG1 2.97Å; H849-H873 CarbonylContact C-O 3.55Å; H849-H873 WeakPolarHBondContact CA-O 3.07Å; H849-H873 WeakPolarHBondContact CB-CE1 3.25Å; H849-H873 WeakPolarHBondContact CB-ND1 3.29Å; H849-H873 WeakPolarHBondContact CB-NE2 3.4Å; H849-H873 WeakPolarHBondContact CB-O 3.21Å; H849-H873 AromaticContact CD2-CE1 3.48Å; H849-H873 PolarHBondContact CD2-CE1 2.93Å; H849-H873 VanDerWaalsContact CD2-CE1 3.48Å; H849-H873 AromaticContact CD2-NE2 3.27Å; H849-H873 PolarHBondContact CD2-NE2 3.36Å; H849-H873 VanDerWaalsContact CD2-NE2 3.27Å; H849-H873 AromaticContact CG-CE1 3.26Å; H849-H873 AromaticContact CG-ND1 3.93Å; H849-H873 AromaticContact CG-NE2 3.48Å; H849-H873 AromaticContact ND1-CE1 3.87Å
850	K	96.7	Very high	92.8	Very high	96 Å²	96	42.4 Å²	42.4	42%	0.417	22%	0.219	S	C	.	.	S	Bend	trans	55.2	49.4	-179.5	-64.3	173	178.6	179.7	0	113.1	E826 N827 H873 G874	E826-K850 CarbonylContact C-O 3.51Å; E826-K850 WeakPolarHBondContact CA-O 3.49Å; E826-K850 HydrophobicContact CB-CB 4.48Å; E826-K850 HydrophobicContact CG-CB 3.89Å; E826-K850 HydrophobicContact CG-CD 3.56Å; E826-K850 HydrophobicContact CG-CG 4.41Å; E826-K850 PolarHBondContact N-O 3.22Å; E826-K850 WeakPolarHBondContact OE1-CD 3.43Å; E826-K850 IonicContact OE1-NZ 3.7Å; E826-K850 PolarHBondContact OE1-NZ 3.06Å; N827-K850 PolarHBondContact N-O 2.88Å; K850-H873 PolarHBondContact N-O 2.94Å; K850-G874 WeakPolarHBondContact CA-O 3.24Å; K850-G874 PolarHBondContact N-O 2.99Å
851	N	96.4	Very high	92.7	Very high	10 Å²	10	42.7 Å²	42.7	5%	0.053	22%	0.22	C	C	.	.	S	Bend	trans	-118.4	-166.1	173.6	-89.5	-81.4	0	0	0	110.3	L824 N827 L829 L848 H849 L853 G874 N875	L824-N851 PolarHBondContact O-ND2 3.09Å; N827-N851 VanDerWaalsContact CA-OD1 3.29Å; N827-N851 WeakPolarHBondContact CA-OD1 3.25Å; N827-N851 WeakPolarHBondContact CB-OD1 3.42Å; N827-N851 PolarHBondContact N-OD1 2.8Å; N827-N851 WeakPolarHBondContact O-CA 3.18Å; N827-N851 PolarHBondContact O-OD1 2.87Å; L829-N851 HydrophobicContact CB-CB 4.39Å; L829-N851 VanDerWaalsContact CB-OD1 3.28Å; L829-N851 WeakPolarHBondContact CB-OD1 3.24Å; L829-N851 WeakPolarHBondContact CG-OD1 3.14Å; L829-N851 PolarHBondContact N-OD1 3.33Å; L848-N851 PolarHBondContact O-ND2 3.14Å; H849-N851 PolarHBondContact O-N 2.76Å; H849-N851 PolarHBondContact O-ND2 2.83Å; N851-L853 HydrophobicContact CB-CD1 4.42Å; N851-L853 HydrophobicContact CB-CG 4.18Å; N851-G874 PolarHBondContact N-O 3.49Å; N851-N875 VanDerWaalsContact CA-OD1 3.25Å; N851-N875 WeakPolarHBondContact CA-OD1 3.33Å; N851-N875 WeakPolarHBondContact CB-OD1 3.24Å; N851-N875 PolarHBondContact N-OD1 3.08Å; N851-N875 PolarHBondContact O-OD1 3.32Å
852	R	95.4	Very high	92.6	Very high	79 Å²	79	42.7 Å²	42.7	30%	0.298	23%	0.226	S	C	.	.			trans	-110.7	21.3	175.7	-61.8	-178.5	-176.1	166.7	10.1	112.6	E828 L829 E830 A854	E828-R852 VanDerWaalsContact CD-NH2 3.26Å; E828-R852 IonicContact OE1-CZ 2.82Å; E828-R852 IonicContact OE1-NH2 3.23Å; E828-R852 PolarHBondContact OE1-NH2 2.95Å; E828-R852 IonicContact OE2-NH2 3.84Å; L829-R852 CarbonylContact O-C 3.52Å; L829-R852 VanDerWaalsContact O-CA 3.29Å; L829-R852 WeakPolarHBondContact O-CA 3.25Å; L829-R852 PolarHBondContact O-N 3.03Å; E830-R852 HydrophobicContact CG-CB 4.02Å; R852-A854 PolarHBondContact O-N 2.93Å
853	L	95.5	Very high	92.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.21	C	C	.	.			trans	-68.5	123.9	-174.9	-62.4	170.7	0	0	0	110.3	L829 L832 L848 N851 N875 R876 F877	L829-L853 HydrophobicContact CB-CD2 4.16Å; L829-L853 WeakPolarHBondContact O-CD2 3.32Å; L829-L853 PolarHBondContact O-N 3.45Å; L829-L853 VanDerWaalsContact O-N 3.09Å; L832-L853 HydrophobicContact CB-CD2 4.46Å; L832-L853 HydrophobicContact CD1-CD1 4.1Å; L832-L853 HydrophobicContact CD1-CD2 4.35Å; L832-L853 HydrophobicContact CG-CD2 4.15Å; L848-L853 HydrophobicContact CB-CD1 4.17Å; L848-L853 HydrophobicContact CD1-CD1 4.26Å; L848-L853 HydrophobicContact CD2-CD1 4.4Å; N851-L853 HydrophobicContact CB-CD1 4.42Å; N851-L853 HydrophobicContact CB-CG 4.18Å; L853-N875 HydrophobicContact CB-CB 4.43Å; L853-N875 WeakPolarHBondContact CB-OD1 3.22Å; L853-N875 PolarHBondContact N-OD1 3.23Å; L853-R876 CarbonylContact O-C 3.17Å; L853-R876 WeakPolarHBondContact O-CA 3.34Å; L853-R876 PolarHBondContact O-N 3.46Å; L853-F877 HydrophobicContact CB-CE2 3.96Å; L853-F877 HydrophobicContact CB-CZ 3.69Å; L853-F877 PolarHBondContact O-N 3.15Å
854	A	92.7	Very high	92.2	Very high	55 Å²	55	39 Å²	39	46%	0.455	21%	0.21	S	C	.	.	S	Bend	trans	-98.3	-20.4	169.5	0	0	0	0	0	112.5	R852 R876 F877	R852-A854 PolarHBondContact O-N 2.93Å; A854-R876 HydrophobicContact CB-CB 4.37Å; A854-F877 VanDerWaalsContact O-CD1 3.3Å; A854-F877 WeakPolarHBondContact O-CD1 3.22Å
855	T	91	Very high	91.8	Very high	86 Å²	86	40.7 Å²	40.7	53%	0.528	23%	0.226	S	C	.	.			trans	-150.8	161.4	179.4	-173.8	0	0	0	0	110.4
856	I	89.9	Confident	91.5	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.021	23%	0.232	C	C	.	.			trans	-125	130.1	170.5	-69.3	168.7	0	0	0	107.3	L848 L860 F861 L872 F877	L848-I856 HydrophobicContact CD1-CD1 4.45Å; I856-L860 HydrophobicContact CG2-CB 3.89Å; I856-L860 HydrophobicContact CG2-CD1 3.7Å; I856-L860 HydrophobicContact CG2-CD2 4.24Å; I856-L860 HydrophobicContact CG2-CG 4.15Å; I856-F861 HydrophobicContact CG2-CE2 4.02Å; I856-F861 HydrophobicContact CG2-CZ 4.46Å; I856-L872 HydrophobicContact CD1-CD1 3.94Å; I856-L872 HydrophobicContact CD1-CD2 3.43Å; I856-L872 VanDerWaalsContact CD1-CD2 3.43Å; I856-L872 HydrophobicContact CD1-CG 4.35Å; I856-F877 HydrophobicContact CD1-CE1 4.26Å; I856-F877 HydrophobicContact CD1-CZ 3.72Å; I856-F877 HydrophobicContact CG1-CE1 4.03Å; I856-F877 HydrophobicContact CG1-CZ 3.75Å
857	G	87	Confident	91.3	Very high	22 Å²	22	41.5 Å²	41.5	23%	0.227	23%	0.233	C	C	.	.			trans	-65.4	139.2	178.9	0	0	0	0	0	112.3	L832 Y859 L860	L832-G857 PolarHBondContact O-N 3.43Å; G857-Y859 PolarHBondContact O-N 2.93Å; G857-Y859 VanDerWaalsContact O-N 3.13Å; G857-L860 VanDerWaalsContact O-CB 3.25Å; G857-L860 WeakPolarHBondContact O-CB 3.28Å; G857-L860 PolarHBondContact O-N 3.27Å
858	D	81.8	Confident	91.1	Very high	92 Å²	92	44.6 Å²	44.6	49%	0.492	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-29.3	-175.3	-66.6	-27.6	0	0	0	113.7	L860 K883	D858-L860 PolarHBondContact O-N 2.92Å; D858-K883 HydrophobicContact CB-CG 4.06Å; D858-K883 VanDerWaalsContact OD1-CG 3.26Å; D858-K883 WeakPolarHBondContact OD1-CG 3.48Å
859	Y	86.5	Confident	91	Very high	111 Å²	111	46 Å²	46	44%	0.435	25%	0.251	S	S	.	.	H	α-helix	trans	-67.6	-17.7	179.8	-171.8	-109	0	0	0	112.7	T833 G834 G857 F861 A862 Q863	T833-Y859 WeakPolarHBondContact O-CB 3.39Å; G834-Y859 VanDerWaalsContact C-CD1 3.47Å; G857-Y859 PolarHBondContact O-N 2.93Å; G857-Y859 VanDerWaalsContact O-N 3.13Å; Y859-F861 PolarHBondContact O-N 3.46Å; Y859-A862 HydrophobicContact CD2-CB 4.32Å; Y859-A862 PolarHBondContact O-N 3.11Å; Y859-Q863 HydrophobicContact CD1-CG 3.72Å; Y859-Q863 VanDerWaalsContact CE1-CD 3.47Å; Y859-Q863 HydrophobicContact CE1-CG 3.32Å; Y859-Q863 HydrophobicContact CE2-CG 4.47Å; Y859-Q863 HydrophobicContact CG-CG 4.42Å; Y859-Q863 VanDerWaalsContact CZ-CD 3.42Å; Y859-Q863 WeakPolarHBondContact O-CG 3.39Å; Y859-Q863 PolarHBondContact O-N 3.25Å; Y859-Q863 PolarHBondContact OH-NE2 3Å
860	L	89.2	Confident	91	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.4	-49.1	177.2	-176.8	146.4	0	0	0	111.6	L832 F837 L846 I856 G857 D858 A862 Q863 L864	L832-L860 HydrophobicContact CB-CD1 4.4Å; F837-L860 HydrophobicContact CD2-CD1 4.2Å; F837-L860 HydrophobicContact CD2-CG 4.27Å; F837-L860 HydrophobicContact CE2-CD1 3.53Å; F837-L860 HydrophobicContact CE2-CG 4.08Å; F837-L860 HydrophobicContact CZ-CD1 4.23Å; L846-L860 HydrophobicContact CD2-CD1 4.35Å; L846-L860 HydrophobicContact CD2-CD2 4.43Å; I856-L860 HydrophobicContact CG2-CB 3.89Å; I856-L860 HydrophobicContact CG2-CD1 3.7Å; I856-L860 HydrophobicContact CG2-CD2 4.24Å; I856-L860 HydrophobicContact CG2-CG 4.15Å; G857-L860 VanDerWaalsContact O-CB 3.25Å; G857-L860 WeakPolarHBondContact O-CB 3.28Å; G857-L860 PolarHBondContact O-N 3.27Å; D858-L860 PolarHBondContact O-N 2.92Å; L860-A862 VanDerWaalsContact C-N 3.29Å; L860-A862 PolarHBondContact O-N 2.93Å; L860-Q863 PolarHBondContact O-N 3.48Å; L860-L864 HydrophobicContact CD2-CD1 4.1Å; L860-L864 HydrophobicContact CG-CD1 4.25Å; L860-L864 WeakPolarHBondContact O-CB 3.27Å; L860-L864 WeakPolarHBondContact O-CG 3.45Å; L860-L864 PolarHBondContact O-N 3.07Å
861	F	87.7	Confident	91	Very high	8 Å²	8	40.4 Å²	40.4	4%	0.035	23%	0.227	C	C	.	.	H	α-helix	trans	-70	-28.4	-179.2	-59.5	-79.6	0	0	0	112.1	I856 Y859 L864 L867 L870 K883 I884 A889	I856-F861 HydrophobicContact CG2-CE2 4.02Å; I856-F861 HydrophobicContact CG2-CZ 4.46Å; Y859-F861 PolarHBondContact O-N 3.46Å; F861-L864 CarbonylContact O-C 3.6Å; F861-L867 HydrophobicContact CE1-CD2 4.4Å; F861-L870 HydrophobicContact CE1-CD2 3.91Å; F861-L870 HydrophobicContact CZ-CD2 4.13Å; F861-K883 HydrophobicContact CD2-CB 3.43Å; F861-K883 VanDerWaalsContact CD2-CB 3.43Å; F861-K883 HydrophobicContact CD2-CG 4.13Å; F861-K883 HydrophobicContact CE2-CB 3.74Å; F861-K883 HydrophobicContact CG-CB 4.14Å; F861-I884 HydrophobicContact CE1-CG1 4.06Å; F861-I884 HydrophobicContact CE2-CG1 4.38Å; F861-I884 HydrophobicContact CZ-CD1 4.15Å; F861-I884 HydrophobicContact CZ-CG1 3.58Å; F861-A889 HydrophobicContact CD1-CB 4.17Å
862	A	85.8	Confident	91	Very high	68 Å²	68	40 Å²	40	56%	0.562	23%	0.225	S	C	*	.	H	α-helix	trans	-68.1	-36.6	172.8	0	0	0	0	0	112.5	Y859 L860	Y859-A862 HydrophobicContact CD2-CB 4.32Å; Y859-A862 PolarHBondContact O-N 3.11Å; L860-A862 VanDerWaalsContact C-N 3.29Å; L860-A862 PolarHBondContact O-N 2.93Å
863	Q	88.3	Confident	91	Very high	39 Å²	39	38 Å²	38	18%	0.182	22%	0.219	C	C	.	.	H	α-helix	trans	-76.1	-37.6	175.4	-67.8	-54.8	-79.2	0	0	112.5	G834 F837 Y859 L860 A865	G834-Q863 WeakPolarHBondContact O-CG 3.34Å; F837-Q863 HydrophobicContact CB-CB 4.18Å; Y859-Q863 HydrophobicContact CD1-CG 3.72Å; Y859-Q863 VanDerWaalsContact CE1-CD 3.47Å; Y859-Q863 HydrophobicContact CE1-CG 3.32Å; Y859-Q863 HydrophobicContact CE2-CG 4.47Å; Y859-Q863 HydrophobicContact CG-CG 4.42Å; Y859-Q863 VanDerWaalsContact CZ-CD 3.42Å; Y859-Q863 WeakPolarHBondContact O-CG 3.39Å; Y859-Q863 PolarHBondContact O-N 3.25Å; Y859-Q863 PolarHBondContact OH-NE2 3Å; L860-Q863 PolarHBondContact O-N 3.48Å; Q863-A865 PolarHBondContact O-N 2.73Å
864	L	90.7	Very high	91	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	23%	0.228	C	C	.	.			trans	-101.7	54.6	-174.7	-54.9	-172.9	0	0	0	111.8	F837 V843 L846 L860 F861 N866 L867	F837-L864 HydrophobicContact CB-CD2 3.82Å; F837-L864 HydrophobicContact CB-CG 4.32Å; F837-L864 HydrophobicContact CD1-CD1 4.23Å; F837-L864 HydrophobicContact CD1-CD2 4.34Å; F837-L864 HydrophobicContact CD2-CD1 4.45Å; F837-L864 HydrophobicContact CG-CD1 4.2Å; F837-L864 HydrophobicContact CG-CD2 4.16Å; F837-L864 HydrophobicContact CG-CG 4.35Å; V843-L864 HydrophobicContact CB-CD2 3.93Å; V843-L864 HydrophobicContact CG1-CD1 4.37Å; V843-L864 HydrophobicContact CG2-CD2 4.27Å; L846-L864 HydrophobicContact CD2-CD1 3.67Å; L860-L864 HydrophobicContact CD2-CD1 4.1Å; L860-L864 HydrophobicContact CG-CD1 4.25Å; L860-L864 WeakPolarHBondContact O-CB 3.27Å; L860-L864 WeakPolarHBondContact O-CG 3.45Å; L860-L864 PolarHBondContact O-N 3.07Å; F861-L864 CarbonylContact O-C 3.6Å; L864-N866 PolarHBondContact O-N 2.95Å; L864-L867 HydrophobicContact CB-CB 4.3Å; L864-L867 VanDerWaalsContact O-CB 3.27Å; L864-L867 WeakPolarHBondContact O-CB 3.46Å; L864-L867 PolarHBondContact O-N 2.84Å
865	A	87	Confident	91.2	Very high	56 Å²	56	36.7 Å²	36.7	46%	0.463	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-20.4	-174.3	0	0	0	0	0	114.6	Q863 Y891	Q863-A865 PolarHBondContact O-N 2.73Å; A865-Y891 WeakPolarHBondContact O-CD2 3.33Å
866	N	90.5	Very high	91.4	Very high	68 Å²	68	38.8 Å²	38.8	36%	0.364	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	9.8	179.6	-69.5	-52.5	0	0	0	113.8	P841 V843 T844 L864 R868	P841-N866 PolarHBondContact O-ND2 3.38Å; V843-N866 CarbonylContact O-C 3.56Å; T844-N866 HydrophobicContact CG2-CB 4.29Å; T844-N866 WeakPolarHBondContact CG2-O 3.42Å; L864-N866 PolarHBondContact O-N 2.95Å; N866-R868 WeakPolarHBondContact O-CG 3.33Å; N866-R868 PolarHBondContact O-N 3.39Å
867	L	92.8	Very high	91.6	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	21%	0.206	C	C	.	.			trans	-61.1	126.1	-174	-165.8	68.1	0	0	0	111.6	V843 L846 F861 L864 L870 Y891 L892	V843-L867 HydrophobicContact CG1-CD1 4.24Å; L846-L867 HydrophobicContact CB-CD1 3.65Å; F861-L867 HydrophobicContact CE1-CD2 4.4Å; L864-L867 HydrophobicContact CB-CB 4.3Å; L864-L867 VanDerWaalsContact O-CB 3.27Å; L864-L867 WeakPolarHBondContact O-CB 3.46Å; L864-L867 PolarHBondContact O-N 2.84Å; L867-L870 HydrophobicContact CD2-CB 4.07Å; L867-L870 HydrophobicContact CD2-CD1 4.32Å; L867-L870 HydrophobicContact CD2-CD2 4.19Å; L867-L870 HydrophobicContact CD2-CG 4.42Å; L867-Y891 CarbonylContact O-C 3.52Å; L867-L892 HydrophobicContact CD2-CD1 4.29Å; L867-L892 HydrophobicContact CG-CD1 4.14Å; L867-L892 WeakPolarHBondContact O-CA 3.39Å; L867-L892 PolarHBondContact O-N 2.88Å
868	R	94.1	Very high	91.7	Very high	110 Å²	110	41.8 Å²	41.8	42%	0.415	22%	0.215	S	C	.	.			trans	-113.7	-37.8	-179	-61.7	-174.5	-179	175.2	-0.4	112.6	T844 N866 Y891 R893 S894	T844-R868 HydrophobicContact CG2-CG 4.4Å; T844-R868 WeakPolarHBondContact O-CA 3.4Å; T844-R868 PolarHBondContact O-N 2.79Å; N866-R868 WeakPolarHBondContact O-CG 3.33Å; N866-R868 PolarHBondContact O-N 3.39Å; R868-Y891 WeakPolarHBondContact CA-O 3.43Å; R868-R893 PolarHBondContact O-N 3.02Å; R868-S894 PolarHBondContact O-N 3.09Å; R868-S894 VanDerWaalsContact O-N 3.09Å
869	V	95.9	Very high	92.1	Very high	28 Å²	28	43 Å²	43	17%	0.17	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	124.7	-178.4	-178.1	0	0	0	0	108.9	T844 H845 L846 F847 S894	T844-V869 PolarHBondContact O-N 3.13Å; H845-V869 HydrophobicContact CB-CB 4.49Å; H845-V869 VanDerWaalsContact CD2-CG2 3.49Å; H845-V869 WeakPolarHBondContact CD2-CG2 3.45Å; L846-V869 PolarHBondContact N-O 2.99Å; F847-V869 HydrophobicContact CE1-CG1 4.42Å; V869-S894 WeakPolarHBondContact CA-O 3.47Å
870	L	95.4	Very high	92.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	118.7	178.1	177.6	59.9	0	0	0	110.1	L846 L848 F861 L867 L872 I884 L892 S894 V895 T896	L846-L870 HydrophobicContact CB-CD1 4.24Å; L846-L870 HydrophobicContact CD2-CD1 4.1Å; L846-L870 HydrophobicContact CG-CD1 4.19Å; L846-L870 WeakPolarHBondContact O-CA 3.31Å; L848-L870 HydrophobicContact CD1-CD1 4.02Å; F861-L870 HydrophobicContact CE1-CD2 3.91Å; F861-L870 HydrophobicContact CZ-CD2 4.13Å; L867-L870 HydrophobicContact CD2-CB 4.07Å; L867-L870 HydrophobicContact CD2-CD1 4.32Å; L867-L870 HydrophobicContact CD2-CD2 4.19Å; L867-L870 HydrophobicContact CD2-CG 4.42Å; L870-L872 HydrophobicContact CD1-CD2 3.97Å; L870-L872 HydrophobicContact CD1-CG 4.46Å; L870-L872 HydrophobicContact CD2-CD1 4.09Å; L870-L872 HydrophobicContact CD2-CD2 4.35Å; L870-L872 HydrophobicContact CD2-CG 4.25Å; L870-L872 HydrophobicContact CG-CD1 4.38Å; L870-L872 HydrophobicContact CG-CD2 4.05Å; L870-L872 HydrophobicContact CG-CG 4Å; L870-I884 HydrophobicContact CD2-CD1 4.27Å; L870-L892 HydrophobicContact CB-CD1 4.02Å; L870-S894 PolarHBondContact N-O 3.01Å; L870-V895 WeakPolarHBondContact O-CA 3.45Å; L870-T896 PolarHBondContact O-N 2.79Å
871	T	96.9	Very high	92.2	Very high	10 Å²	10	38 Å²	38	6%	0.061	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	121.1	176.8	68.5	0	0	0	0	111.6	L846 F847 L848 H849 T896	L846-T871 PolarHBondContact O-N 2.97Å; F847-T871 VanDerWaalsContact CA-OG1 3.25Å; F847-T871 WeakPolarHBondContact CA-OG1 3.49Å; F847-T871 HydrophobicContact CD1-CG2 3.52Å; F847-T871 HydrophobicContact CE1-CG2 4Å; L848-T871 CarbonylContact C-O 3.46Å; L848-T871 VanDerWaalsContact CA-O 3.27Å; L848-T871 WeakPolarHBondContact CA-O 3.29Å; L848-T871 WeakPolarHBondContact CB-O 3.43Å; L848-T871 PolarHBondContact N-O 3.11Å; L848-T871 PolarHBondContact N-OG1 3.04Å; L848-T871 VanDerWaalsContact N-OG1 3.11Å; H849-T871 PolarHBondContact N-O 3.46Å; H849-T871 PolarHBondContact N-OG1 2.04Å; H849-T871 PolarHBondContact ND1-OG1 2.97Å; T871-T896 WeakPolarHBondContact CA-OG1 3.46Å; T871-T896 VanDerWaalsContact CB-OG1 3.28Å; T871-T896 WeakPolarHBondContact CB-OG1 3.49Å; T871-T896 HydrophobicContact CG2-CG2 4.13Å
872	L	96.2	Very high	92.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.217	C	C	.	.			trans	-120.3	3.7	179.5	-57.5	180	0	0	0	114	L848 I856 L870 N875 F877 I884 V895 T896 L897 N900	L848-L872 HydrophobicContact CB-CD2 4.06Å; L848-L872 HydrophobicContact CD1-CD2 4.19Å; I856-L872 HydrophobicContact CD1-CD1 3.94Å; I856-L872 HydrophobicContact CD1-CD2 3.43Å; I856-L872 VanDerWaalsContact CD1-CD2 3.43Å; I856-L872 HydrophobicContact CD1-CG 4.35Å; L870-L872 HydrophobicContact CD1-CD2 3.97Å; L870-L872 HydrophobicContact CD1-CG 4.46Å; L870-L872 HydrophobicContact CD2-CD1 4.09Å; L870-L872 HydrophobicContact CD2-CD2 4.35Å; L870-L872 HydrophobicContact CD2-CG 4.25Å; L870-L872 HydrophobicContact CG-CD1 4.38Å; L870-L872 HydrophobicContact CG-CD2 4.05Å; L870-L872 HydrophobicContact CG-CG 4Å; L872-N875 WeakPolarHBondContact O-CB 3.4Å; L872-N875 PolarHBondContact O-ND2 3.02Å; L872-F877 HydrophobicContact CB-CD2 4.44Å; L872-F877 HydrophobicContact CB-CE2 4.01Å; L872-F877 HydrophobicContact CD1-CE2 4.4Å; L872-F877 HydrophobicContact CD1-CZ 4.48Å; L872-F877 HydrophobicContact CD2-CE2 4.21Å; L872-F877 HydrophobicContact CD2-CZ 4.34Å; L872-F877 HydrophobicContact CG-CE2 4.44Å; L872-I884 HydrophobicContact CD1-CD1 3.65Å; L872-V895 HydrophobicContact CD1-CG1 4.47Å; L872-T896 CarbonylContact C-O 3.51Å; L872-T896 WeakPolarHBondContact CA-O 3.45Å; L872-T896 WeakPolarHBondContact CB-O 3.08Å; L872-T896 PolarHBondContact N-O 3.47Å; L872-T896 PolarHBondContact N-OG1 3.3Å; L872-L897 HydrophobicContact CB-CD2 4.28Å; L872-L897 HydrophobicContact CD1-CD2 4.13Å; L872-N900 PolarHBondContact O-ND2 2.66Å
873	H	96.5	Very high	92	Very high	38 Å²	38	41.2 Å²	41.2	18%	0.176	20%	0.204	C	C	.	.			trans	-64.1	151.7	-176.7	68.4	-93.4	0	0	0	111.5	H849 K850 T896 G898	H849-H873 CarbonylContact C-O 3.55Å; H849-H873 WeakPolarHBondContact CA-O 3.07Å; H849-H873 WeakPolarHBondContact CB-CE1 3.25Å; H849-H873 WeakPolarHBondContact CB-ND1 3.29Å; H849-H873 WeakPolarHBondContact CB-NE2 3.4Å; H849-H873 WeakPolarHBondContact CB-O 3.21Å; H849-H873 AromaticContact CD2-CE1 3.48Å; H849-H873 PolarHBondContact CD2-CE1 2.93Å; H849-H873 VanDerWaalsContact CD2-CE1 3.48Å; H849-H873 AromaticContact CD2-NE2 3.27Å; H849-H873 PolarHBondContact CD2-NE2 3.36Å; H849-H873 VanDerWaalsContact CD2-NE2 3.27Å; H849-H873 AromaticContact CG-CE1 3.26Å; H849-H873 AromaticContact CG-ND1 3.93Å; H849-H873 AromaticContact CG-NE2 3.48Å; H849-H873 AromaticContact ND1-CE1 3.87Å; K850-H873 PolarHBondContact N-O 2.94Å; H873-T896 PolarHBondContact N-O 3.01Å; H873-T896 VanDerWaalsContact N-O 3.14Å; H873-T896 PolarHBondContact N-OG1 2.98Å; H873-T896 PolarHBondContact ND1-OG1 3.24Å; H873-G898 CarbonylContact C-O 3.59Å; H873-G898 WeakPolarHBondContact CA-O 3.44Å; H873-G898 WeakPolarHBondContact CB-O 3.11Å
874	G	95.7	Very high	91.8	Very high	18 Å²	18	39.7 Å²	39.7	19%	0.186	20%	0.197	C	C	.	.	S	Bend	trans	70.4	32.8	177.9	0	0	0	0	0	114.3	K850 N851 G898 Q899	K850-G874 WeakPolarHBondContact CA-O 3.24Å; K850-G874 PolarHBondContact N-O 2.99Å; N851-G874 PolarHBondContact N-O 3.49Å; G874-G898 PolarHBondContact N-O 3.39Å; G874-Q899 VanDerWaalsContact CA-O 3.28Å; G874-Q899 WeakPolarHBondContact CA-O 3.46Å; G874-Q899 PolarHBondContact N-O 3.44Å
875	N	96.9	Very high	91.4	Very high	10 Å²	10	41 Å²	41	5%	0.053	21%	0.207	C	C	.	.	S	Bend	trans	-111	-158.8	176.7	-86.9	-76.5	0	0	0	110.5	L848 N851 L853 L872 F877 N900	L848-N875 PolarHBondContact O-ND2 2.67Å; N851-N875 VanDerWaalsContact CA-OD1 3.25Å; N851-N875 WeakPolarHBondContact CA-OD1 3.33Å; N851-N875 WeakPolarHBondContact CB-OD1 3.24Å; N851-N875 PolarHBondContact N-OD1 3.08Å; N851-N875 PolarHBondContact O-OD1 3.32Å; L853-N875 HydrophobicContact CB-CB 4.43Å; L853-N875 WeakPolarHBondContact CB-OD1 3.22Å; L853-N875 PolarHBondContact N-OD1 3.23Å; L872-N875 WeakPolarHBondContact O-CB 3.4Å; L872-N875 PolarHBondContact O-ND2 3.02Å; N875-F877 HydrophobicContact CB-CD2 3.54Å; N875-F877 HydrophobicContact CB-CE2 3.56Å; N875-N900 WeakPolarHBondContact CA-OD1 3.21Å; N875-N900 WeakPolarHBondContact CB-OD1 3.38Å; N875-N900 PolarHBondContact N-OD1 3.3Å; N875-N900 VanDerWaalsContact N-OD1 3.15Å; N875-N900 PolarHBondContact O-OD1 3.31Å; N875-N900 VanDerWaalsContact O-OD1 3.11Å
876	R	94.7	Very high	90.9	Very high	130 Å²	130	41 Å²	41	49%	0.491	21%	0.208	S	C	.	.			trans	-116	29	178.8	-62.5	-177.9	177.9	173.9	-2.3	112.6	L853 A854 H878 N900	L853-R876 CarbonylContact O-C 3.17Å; L853-R876 WeakPolarHBondContact O-CA 3.34Å; L853-R876 PolarHBondContact O-N 3.46Å; A854-R876 HydrophobicContact CB-CB 4.37Å; R876-H878 PolarHBondContact O-N 3.28Å; R876-N900 PolarHBondContact N-OD1 3.45Å
877	F	93.3	Very high	89.6	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.219	C	C	.	.			trans	-70.4	121.7	179.7	-67.2	-78.7	0	0	0	111.2	L853 A854 I856 L872 N875 P881 N900 P901 W902	L853-F877 HydrophobicContact CB-CE2 3.96Å; L853-F877 HydrophobicContact CB-CZ 3.69Å; L853-F877 PolarHBondContact O-N 3.15Å; A854-F877 VanDerWaalsContact O-CD1 3.3Å; A854-F877 WeakPolarHBondContact O-CD1 3.22Å; I856-F877 HydrophobicContact CD1-CE1 4.26Å; I856-F877 HydrophobicContact CD1-CZ 3.72Å; I856-F877 HydrophobicContact CG1-CE1 4.03Å; I856-F877 HydrophobicContact CG1-CZ 3.75Å; L872-F877 HydrophobicContact CB-CD2 4.44Å; L872-F877 HydrophobicContact CB-CE2 4.01Å; L872-F877 HydrophobicContact CD1-CE2 4.4Å; L872-F877 HydrophobicContact CD1-CZ 4.48Å; L872-F877 HydrophobicContact CD2-CE2 4.21Å; L872-F877 HydrophobicContact CD2-CZ 4.34Å; L872-F877 HydrophobicContact CG-CE2 4.44Å; N875-F877 HydrophobicContact CB-CD2 3.54Å; N875-F877 HydrophobicContact CB-CE2 3.56Å; F877-P881 HydrophobicContact CD1-CG 4.14Å; F877-P881 HydrophobicContact CE1-CG 3.91Å; F877-N900 HydrophobicContact CB-CB 4.3Å; F877-N900 WeakPolarHBondContact CD2-OD1 3.31Å; F877-N900 PolarHBondContact N-OD1 2.01Å; F877-P901 CarbonylContact O-C 3.5Å; F877-P901 WeakPolarHBondContact O-CD 3.38Å; F877-W902 HydrophobicContact CB-CE3 4.28Å; F877-W902 HydrophobicContact CB-CH2 3.51Å; F877-W902 HydrophobicContact CB-CZ2 4.22Å; F877-W902 HydrophobicContact CB-CZ3 3.54Å; F877-W902 HydrophobicContact CG-CH2 4.22Å
878	H	90.6	Very high	88.3	Confident	89 Å²	89	45.5 Å²	45.5	41%	0.412	24%	0.239	S	C	.	.	S	Bend	trans	-91.5	-26.6	169.4	-69.1	-76.2	0	0	0	112.4	R876 P901 K903	R876-H878 PolarHBondContact O-N 3.28Å; H878-P901 PolarHBondContact ND1-O 3.34Å; H878-K903 HydrophobicContact CB-CB 4.48Å; H878-K903 PolarHBondContact O-N 3.48Å
879	Y	89.6	Confident	87.2	Confident	116 Å²	116	40.9 Å²	40.9	46%	0.455	22%	0.224	S	C	.	.	S	Bend	trans	-136	144.2	-177.2	-52.4	-77.2	0	0	0	110.5	P881 W902 K903 L910	Y879-P881 WeakPolarHBondContact O-CD 2.97Å; Y879-W902 VanDerWaalsContact C-CZ3 3.44Å; Y879-K903 HydrophobicContact CE1-CB 4.02Å; Y879-K903 HydrophobicContact CE1-CD 3.75Å; Y879-K903 HydrophobicContact CE1-CG 4.37Å; Y879-K903 WeakPolarHBondContact OH-CD 3.03Å; Y879-K903 PolarHBondContact OH-NZ 2.93Å; Y879-L910 HydrophobicContact CD1-CD2 3.64Å; Y879-L910 HydrophobicContact CE1-CD2 3.49Å; Y879-L910 VanDerWaalsContact CE1-CD2 3.49Å
880	L	89.6	Confident	86.3	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.016	24%	0.243	C	C	.	.			trans	-63.5	127	177.2	-177.8	70.8	0	0	0	109.2	I884 A885 L897 L911 L912 W915	L880-I884 HydrophobicContact CD1-CB 4.37Å; L880-I884 HydrophobicContact CD1-CD1 4.46Å; L880-I884 HydrophobicContact CD1-CG2 4.17Å; L880-A885 HydrophobicContact CD2-CB 4.03Å; L880-L897 HydrophobicContact CD1-CD1 3.89Å; L880-L897 HydrophobicContact CD1-CD2 4.23Å; L880-L911 HydrophobicContact CB-CB 4.38Å; L880-L912 HydrophobicContact CB-CB 4.12Å; L880-L912 HydrophobicContact CB-CD1 4.36Å; L880-L912 HydrophobicContact CD1-CD1 4.35Å; L880-L912 HydrophobicContact CD2-CD1 4.43Å; L880-W915 HydrophobicContact CD1-CE3 4.49Å; L880-W915 HydrophobicContact CD1-CZ3 4.36Å; L880-W915 HydrophobicContact CD2-CB 4.02Å; L880-W915 HydrophobicContact CD2-CD2 3.62Å; L880-W915 HydrophobicContact CD2-CE3 3.5Å; L880-W915 HydrophobicContact CD2-CG 3.87Å; L880-W915 HydrophobicContact CD2-CZ3 4.14Å
881	P	87.7	Confident	85.9	Confident	5 Å²	5	50 Å²	50	3%	0.032	27%	0.268	C	S	.	.			trans	-52.8	124.5	174.5	-28.5	35.1	0	0	0	111.2	F877 Y879 K883 I884	F877-P881 HydrophobicContact CD1-CG 4.14Å; F877-P881 HydrophobicContact CE1-CG 3.91Å; Y879-P881 WeakPolarHBondContact O-CD 2.97Å; P881-K883 PolarHBondContact O-N 2.86Å; P881-K883 VanDerWaalsContact O-N 3.09Å; P881-I884 HydrophobicContact CB-CD1 4.04Å; P881-I884 HydrophobicContact CB-CG1 4.2Å; P881-I884 HydrophobicContact CG-CD1 3.96Å; P881-I884 WeakPolarHBondContact O-CB 2.95Å; P881-I884 PolarHBondContact O-N 3.3Å
882	P	85.8	Confident	85.5	Confident	77 Å²	77	50.5 Å²	50.5	50%	0.5	27%	0.27	S	S	.	.	H	α-helix	trans	-55.3	-34.8	-172.1	-28.4	34.6	0	0	0	114.2	I884 A885 A886 L911	P882-I884 VanDerWaalsContact C-N 3.3Å; P882-I884 PolarHBondContact O-N 3.22Å; P882-A885 CarbonylContact O-C 3.49Å; P882-A885 WeakPolarHBondContact O-CA 3.43Å; P882-A885 WeakPolarHBondContact O-CB 3.03Å; P882-A885 PolarHBondContact O-N 2.84Å; P882-A886 WeakPolarHBondContact O-CB 3.44Å; P882-A886 PolarHBondContact O-N 3.26Å; P882-L911 HydrophobicContact CB-CD1 4.09Å; P882-L911 HydrophobicContact CG-CD1 4.03Å
883	K	83.9	Confident	85.3	Confident	65 Å²	65	59.4 Å²	59.4	28%	0.283	30%	0.304	S	S	.	.	H	α-helix	trans	-66.1	-25.9	179.3	-67.3	-69	178.4	178.2	0	114.7	D858 F861 P881 D888	D858-K883 HydrophobicContact CB-CG 4.06Å; D858-K883 VanDerWaalsContact OD1-CG 3.26Å; D858-K883 WeakPolarHBondContact OD1-CG 3.48Å; F861-K883 HydrophobicContact CD2-CB 3.43Å; F861-K883 VanDerWaalsContact CD2-CB 3.43Å; F861-K883 HydrophobicContact CD2-CG 4.13Å; F861-K883 HydrophobicContact CE2-CB 3.74Å; F861-K883 HydrophobicContact CG-CB 4.14Å; P881-K883 PolarHBondContact O-N 2.86Å; P881-K883 VanDerWaalsContact O-N 3.09Å; K883-D888 HydrophobicContact CD-CB 4.08Å; K883-D888 WeakPolarHBondContact CD-OD2 3.37Å; K883-D888 WeakPolarHBondContact CE-OD2 3.38Å; K883-D888 IonicContact NZ-OD2 3.86Å; K883-D888 PolarHBondContact NZ-OD2 2.99Å
884	I	84.8	Confident	85.2	Confident	8 Å²	8	59 Å²	59	4%	0.041	31%	0.305	C	S	.	.	H	α-helix	trans	-70.2	-39.5	171.3	-61.6	176.6	0	0	0	109.7	F861 L870 L872 L880 P881 P882 W915	F861-I884 HydrophobicContact CE1-CG1 4.06Å; F861-I884 HydrophobicContact CE2-CG1 4.38Å; F861-I884 HydrophobicContact CZ-CD1 4.15Å; F861-I884 HydrophobicContact CZ-CG1 3.58Å; L870-I884 HydrophobicContact CD2-CD1 4.27Å; L872-I884 HydrophobicContact CD1-CD1 3.65Å; L880-I884 HydrophobicContact CD1-CB 4.37Å; L880-I884 HydrophobicContact CD1-CD1 4.46Å; L880-I884 HydrophobicContact CD1-CG2 4.17Å; P881-I884 HydrophobicContact CB-CD1 4.04Å; P881-I884 HydrophobicContact CB-CG1 4.2Å; P881-I884 HydrophobicContact CG-CD1 3.96Å; P881-I884 WeakPolarHBondContact O-CB 2.95Å; P881-I884 PolarHBondContact O-N 3.3Å; P882-I884 VanDerWaalsContact C-N 3.3Å; P882-I884 PolarHBondContact O-N 3.22Å; I884-W915 HydrophobicContact CG2-CH2 3.93Å; I884-W915 HydrophobicContact CG2-CZ2 3.77Å
885	A	81.2	Confident	85.1	Confident	28 Å²	28	58.1 Å²	58.1	23%	0.231	30%	0.296	C	S	.	.	H	α-helix	trans	-73.9	-33.6	177.5	0	0	0	0	0	113.1	L880 P882 S887 L911 W915	L880-A885 HydrophobicContact CD2-CB 4.03Å; P882-A885 CarbonylContact O-C 3.49Å; P882-A885 WeakPolarHBondContact O-CA 3.43Å; P882-A885 WeakPolarHBondContact O-CB 3.03Å; P882-A885 PolarHBondContact O-N 2.84Å; A885-S887 PolarHBondContact O-N 2.96Å; A885-S887 VanDerWaalsContact O-N 3.13Å; A885-L911 HydrophobicContact CB-CD2 4.29Å; A885-W915 HydrophobicContact CB-CG 4.21Å
886	A	75.8	Confident	85.1	Confident	58 Å²	58	58.5 Å²	58.5	48%	0.479	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	2.6	-176.9	0	0	0	0	0	114.6	P882 D888	P882-A886 WeakPolarHBondContact O-CB 3.44Å; P882-A886 PolarHBondContact O-N 3.26Å; A886-D888 PolarHBondContact O-N 3.14Å; A886-D888 VanDerWaalsContact O-N 3.12Å
887	S	63.7	Low	85.1	Confident	86 Å²	86	52.3 Å²	52.3	60%	0.601	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	19.3	-175.3	-168.3	0	0	0	0	114.3	A885 A889	A885-S887 PolarHBondContact O-N 2.96Å; A885-S887 VanDerWaalsContact O-N 3.13Å; S887-A889 PolarHBondContact O-N 2.8Å; S887-A889 VanDerWaalsContact O-N 3.11Å
888	D	65.7	Low	85.1	Confident	76 Å²	76	52.3 Å²	52.3	41%	0.406	28%	0.275	S	S	.	.			trans	-68.9	-5.8	177.9	-79.6	-31	0	0	0	113.1	K883 A886 P890	K883-D888 HydrophobicContact CD-CB 4.08Å; K883-D888 WeakPolarHBondContact CD-OD2 3.37Å; K883-D888 WeakPolarHBondContact CE-OD2 3.38Å; K883-D888 IonicContact NZ-OD2 3.86Å; K883-D888 PolarHBondContact NZ-OD2 2.99Å; A886-D888 PolarHBondContact O-N 3.14Å; A886-D888 VanDerWaalsContact O-N 3.12Å; D888-P890 VanDerWaalsContact C-CD 3.48Å; D888-P890 WeakPolarHBondContact O-CD 3.3Å
889	A	72	Confident	85.3	Confident	14 Å²	14	54.6 Å²	54.6	12%	0.116	29%	0.286	C	S	.	.			trans	-114	76.4	167.8	0	0	0	0	0	109.6	F861 S887 Y891 L892	F861-A889 HydrophobicContact CD1-CB 4.17Å; S887-A889 PolarHBondContact O-N 2.8Å; S887-A889 VanDerWaalsContact O-N 3.11Å; A889-Y891 PolarHBondContact O-N 3.1Å; A889-Y891 VanDerWaalsContact O-N 3.13Å; A889-L892 HydrophobicContact CB-CB 3.92Å; A889-L892 HydrophobicContact CB-CD2 4.09Å; A889-L892 HydrophobicContact CB-CG 4.5Å; A889-L892 VanDerWaalsContact O-CB 3.23Å; A889-L892 WeakPolarHBondContact O-CB 3.34Å; A889-L892 PolarHBondContact O-N 3.2Å
890	P	76.1	Confident	85.5	Confident	88 Å²	88	49.3 Å²	49.3	57%	0.571	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-21.2	-172	25.9	-35.4	0	0	0	113.5	D888	D888-P890 VanDerWaalsContact C-CD 3.48Å; D888-P890 WeakPolarHBondContact O-CD 3.3Å
891	Y	87.5	Confident	85.5	Confident	130 Å²	130	50.3 Å²	50.3	51%	0.51	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	0.6	179.3	-58.3	-70.2	0	0	0	113.7	A865 L867 R868 A889 R893	A865-Y891 WeakPolarHBondContact O-CD2 3.33Å; L867-Y891 CarbonylContact O-C 3.52Å; R868-Y891 WeakPolarHBondContact CA-O 3.43Å; A889-Y891 PolarHBondContact O-N 3.1Å; A889-Y891 VanDerWaalsContact O-N 3.13Å; Y891-R893 WeakPolarHBondContact O-CG 3.22Å; Y891-R893 PolarHBondContact O-N 3.2Å
892	L	88.1	Confident	85.7	Confident	22 Å²	22	50.1 Å²	50.1	12%	0.115	27%	0.271	C	S	.	.			trans	-65.7	122.9	-178.5	-158.6	62.9	0	0	0	109.3	L867 L870 A889 V895 L922	L867-L892 HydrophobicContact CD2-CD1 4.29Å; L867-L892 HydrophobicContact CG-CD1 4.14Å; L867-L892 WeakPolarHBondContact O-CA 3.39Å; L867-L892 PolarHBondContact O-N 2.88Å; L870-L892 HydrophobicContact CB-CD1 4.02Å; A889-L892 HydrophobicContact CB-CB 3.92Å; A889-L892 HydrophobicContact CB-CD2 4.09Å; A889-L892 HydrophobicContact CB-CG 4.5Å; A889-L892 VanDerWaalsContact O-CB 3.23Å; A889-L892 WeakPolarHBondContact O-CB 3.34Å; A889-L892 PolarHBondContact O-N 3.2Å; L892-V895 HydrophobicContact CD1-CG2 4.07Å; L892-V895 HydrophobicContact CD2-CG2 3.19Å; L892-V895 HydrophobicContact CG-CG2 3.52Å; L892-L922 HydrophobicContact CB-CD1 4.48Å; L892-L922 HydrophobicContact CG-CD1 4.37Å; L892-L922 VanDerWaalsContact O-CD1 3.22Å; L892-L922 WeakPolarHBondContact O-CD1 3.45Å
893	R	91	Very high	85.8	Confident	186 Å²	186	48.2 Å²	48.2	70%	0.702	26%	0.255	S	S	*	.			trans	-114.8	-20.3	-177.5	-65.3	-170.2	179.7	-168.9	-3.3	113.3	R868 Y891	R868-R893 PolarHBondContact O-N 3.02Å; Y891-R893 WeakPolarHBondContact O-CG 3.22Å; Y891-R893 PolarHBondContact O-N 3.2Å
894	S	94.5	Very high	85.9	Confident	30 Å²	30	45.1 Å²	45.1	21%	0.21	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	128.5	179.1	179.1	0	0	0	0	111.2	R868 V869 L870 L922	R868-S894 PolarHBondContact O-N 3.09Å; R868-S894 VanDerWaalsContact O-N 3.09Å; V869-S894 WeakPolarHBondContact CA-O 3.47Å; L870-S894 PolarHBondContact N-O 3.01Å; S894-L922 CarbonylContact C-O 3.55Å; S894-L922 WeakPolarHBondContact CA-O 3.25Å
895	V	94.2	Very high	85.8	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	121.1	173.2	-171.4	0	0	0	0	110.6	L870 L872 L892 L897 L922 V923	L870-V895 WeakPolarHBondContact O-CA 3.45Å; L872-V895 HydrophobicContact CD1-CG1 4.47Å; L892-V895 HydrophobicContact CD1-CG2 4.07Å; L892-V895 HydrophobicContact CD2-CG2 3.19Å; L892-V895 HydrophobicContact CG-CG2 3.52Å; V895-L897 HydrophobicContact CG1-CD2 3.78Å; V895-L897 HydrophobicContact CG1-CG 4.09Å; V895-L922 HydrophobicContact CG2-CD1 4.47Å; V895-L922 HydrophobicContact CG2-CD2 4.13Å; V895-L922 HydrophobicContact CG2-CG 4.09Å; V895-L922 PolarHBondContact N-O 3.48Å; V895-V923 VanDerWaalsContact O-CA 3.29Å; V895-V923 WeakPolarHBondContact O-CA 3.37Å; V895-V923 WeakPolarHBondContact O-CG1 3.33Å
896	T	96.4	Very high	85.4	Confident	17 Å²	17	47.6 Å²	47.6	10%	0.104	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	130.8	175.3	67.9	0	0	0	0	110.7	L870 T871 L872 H873 P924 D925	L870-T896 PolarHBondContact O-N 2.79Å; T871-T896 WeakPolarHBondContact CA-OG1 3.46Å; T871-T896 VanDerWaalsContact CB-OG1 3.28Å; T871-T896 WeakPolarHBondContact CB-OG1 3.49Å; T871-T896 HydrophobicContact CG2-CG2 4.13Å; L872-T896 CarbonylContact C-O 3.51Å; L872-T896 WeakPolarHBondContact CA-O 3.45Å; L872-T896 WeakPolarHBondContact CB-O 3.08Å; L872-T896 PolarHBondContact N-O 3.47Å; L872-T896 PolarHBondContact N-OG1 3.3Å; H873-T896 PolarHBondContact N-O 3.01Å; H873-T896 VanDerWaalsContact N-O 3.14Å; H873-T896 PolarHBondContact N-OG1 2.98Å; H873-T896 PolarHBondContact ND1-OG1 3.24Å; T896-P924 HydrophobicContact CG2-CG 4.22Å; T896-D925 VanDerWaalsContact CA-OD1 3.24Å; T896-D925 WeakPolarHBondContact CA-OD1 3.19Å; T896-D925 WeakPolarHBondContact CB-OD2 3.33Å
897	L	95.5	Very high	85	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.252	C	S	.	.			trans	-124.5	-4.8	-172.7	-66.3	-179.6	0	0	0	114.2	L872 L880 V895 N900 W902 L912 W915 V923 D925 L929	L872-L897 HydrophobicContact CB-CD2 4.28Å; L872-L897 HydrophobicContact CD1-CD2 4.13Å; L880-L897 HydrophobicContact CD1-CD1 3.89Å; L880-L897 HydrophobicContact CD1-CD2 4.23Å; V895-L897 HydrophobicContact CG1-CD2 3.78Å; V895-L897 HydrophobicContact CG1-CG 4.09Å; L897-N900 PolarHBondContact O-ND2 2.89Å; L897-N900 VanDerWaalsContact O-ND2 3.07Å; L897-W902 HydrophobicContact CB-CZ2 3.8Å; L897-W902 HydrophobicContact CD2-CH2 4.15Å; L897-W902 HydrophobicContact CD2-CZ2 4Å; L897-W902 HydrophobicContact CG-CZ2 4.35Å; L897-W902 WeakPolarHBondContact O-CZ2 3.06Å; L897-W902 PolarHBondContact O-NE1 2.92Å; L897-L912 HydrophobicContact CD1-CD1 4.2Å; L897-W915 HydrophobicContact CD1-CZ3 3.92Å; L897-V923 HydrophobicContact CB-CG1 4.24Å; L897-V923 HydrophobicContact CD1-CG1 4.21Å; L897-V923 HydrophobicContact CD1-CG2 4.1Å; L897-V923 HydrophobicContact CG-CG1 4.23Å; L897-D925 PolarHBondContact N-OD1 3.16Å; L897-D925 PolarHBondContact N-OD2 3.13Å; L897-L929 HydrophobicContact CB-CD2 3.65Å; L897-L929 VanDerWaalsContact O-CD2 3.25Å; L897-L929 WeakPolarHBondContact O-CD2 3.43Å
898	G	94	Very high	84.9	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.26	C	S	.	.			trans	-56.7	166.3	-175.9	0	0	0	0	0	114.5	H873 G874 N900 D925	H873-G898 CarbonylContact C-O 3.59Å; H873-G898 WeakPolarHBondContact CA-O 3.44Å; H873-G898 WeakPolarHBondContact CB-O 3.11Å; G874-G898 PolarHBondContact N-O 3.39Å; G898-N900 PolarHBondContact O-N 3.18Å; G898-N900 VanDerWaalsContact O-N 3.11Å; G898-N900 PolarHBondContact O-ND2 2.67Å; G898-D925 WeakPolarHBondContact CA-OD2 3.43Å; G898-D925 PolarHBondContact N-OD2 3.46Å
899	Q	93.3	Very high	84.7	Confident	137 Å²	137	55.6 Å²	55.6	64%	0.64	28%	0.283	S	S	*	.	S	Bend	trans	53.2	35.7	173.6	-53.8	176.7	13.1	0	0	114.9	G874	G874-Q899 VanDerWaalsContact CA-O 3.28Å; G874-Q899 WeakPolarHBondContact CA-O 3.46Å; G874-Q899 PolarHBondContact N-O 3.44Å
900	N	94.2	Very high	84.8	Confident	5 Å²	5	56 Å²	56	3%	0.027	28%	0.283	C	S	.	.	S	Bend	trans	-115.7	150.5	172.3	-81.8	-78.1	0	0	0	109.6	L872 N875 R876 F877 L897 G898 W902	L872-N900 PolarHBondContact O-ND2 2.66Å; N875-N900 WeakPolarHBondContact CA-OD1 3.21Å; N875-N900 WeakPolarHBondContact CB-OD1 3.38Å; N875-N900 PolarHBondContact N-OD1 3.3Å; N875-N900 VanDerWaalsContact N-OD1 3.15Å; N875-N900 PolarHBondContact O-OD1 3.31Å; N875-N900 VanDerWaalsContact O-OD1 3.11Å; R876-N900 PolarHBondContact N-OD1 3.45Å; F877-N900 HydrophobicContact CB-CB 4.3Å; F877-N900 WeakPolarHBondContact CD2-OD1 3.31Å; F877-N900 PolarHBondContact N-OD1 2.01Å; L897-N900 PolarHBondContact O-ND2 2.89Å; L897-N900 VanDerWaalsContact O-ND2 3.07Å; G898-N900 PolarHBondContact O-N 3.18Å; G898-N900 VanDerWaalsContact O-N 3.11Å; G898-N900 PolarHBondContact O-ND2 2.67Å; N900-W902 HydrophobicContact CB-CD2 4.08Å; N900-W902 HydrophobicContact CB-CG 4.37Å; N900-W902 HydrophobicContact CB-CZ2 3.76Å; N900-W902 PolarHBondContact O-N 2.75Å
901	P	90.6	Very high	85	Confident	24 Å²	24	55.4 Å²	55.4	16%	0.156	28%	0.275	C	S	.	.			trans	-78.9	60.7	-179.5	35.1	-37.6	0	0	0	111.8	F877 H878 K903	F877-P901 CarbonylContact O-C 3.5Å; F877-P901 WeakPolarHBondContact O-CD 3.38Å; H878-P901 PolarHBondContact ND1-O 3.34Å; P901-K903 PolarHBondContact O-N 2.86Å
902	W	91.9	Very high	85	Confident	1 Å²	1	49.6 Å²	49.6	0%	0.004	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-60.3	125	-175	-62	112.6	0	0	0	111.3	F877 Y879 L897 N900 L912 L929 C931 Q932	F877-W902 HydrophobicContact CB-CE3 4.28Å; F877-W902 HydrophobicContact CB-CH2 3.51Å; F877-W902 HydrophobicContact CB-CZ2 4.22Å; F877-W902 HydrophobicContact CB-CZ3 3.54Å; F877-W902 HydrophobicContact CG-CH2 4.22Å; Y879-W902 VanDerWaalsContact C-CZ3 3.44Å; L897-W902 HydrophobicContact CB-CZ2 3.8Å; L897-W902 HydrophobicContact CD2-CH2 4.15Å; L897-W902 HydrophobicContact CD2-CZ2 4Å; L897-W902 HydrophobicContact CG-CZ2 4.35Å; L897-W902 WeakPolarHBondContact O-CZ2 3.06Å; L897-W902 PolarHBondContact O-NE1 2.92Å; N900-W902 HydrophobicContact CB-CD2 4.08Å; N900-W902 HydrophobicContact CB-CG 4.37Å; N900-W902 HydrophobicContact CB-CZ2 3.76Å; N900-W902 PolarHBondContact O-N 2.75Å; W902-L912 HydrophobicContact CB-CD2 3.98Å; W902-L912 HydrophobicContact CD2-CD2 3.56Å; W902-L912 HydrophobicContact CE3-CD2 3.74Å; W902-L912 HydrophobicContact CG-CD2 3.68Å; W902-L912 HydrophobicContact CZ3-CD2 4.46Å; W902-L929 VanDerWaalsContact NE1-CD2 3.3Å; W902-C931 WeakPolarHBondContact O-CA 3.13Å; W902-Q932 PolarHBondContact O-N 3.02Å
903	K	87.6	Confident	84.9	Confident	38 Å²	38	49.1 Å²	49.1	17%	0.165	25%	0.249	C	C	.	.			trans	-77.6	126.8	172.8	-167.4	179.6	-176.1	178.5	0	108.7	H878 Y879 P901 D941 T943	H878-K903 HydrophobicContact CB-CB 4.48Å; H878-K903 PolarHBondContact O-N 3.48Å; Y879-K903 HydrophobicContact CE1-CB 4.02Å; Y879-K903 HydrophobicContact CE1-CD 3.75Å; Y879-K903 HydrophobicContact CE1-CG 4.37Å; Y879-K903 WeakPolarHBondContact OH-CD 3.03Å; Y879-K903 PolarHBondContact OH-NZ 2.93Å; P901-K903 PolarHBondContact O-N 2.86Å; K903-D941 IonicContact NZ-OD2 2.79Å; K903-D941 PolarHBondContact NZ-OD2 2.02Å; K903-T943 HydrophobicContact CD-CG2 4.04Å; K903-T943 HydrophobicContact CG-CG2 3.77Å
904	C	86	Confident	84.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.241	C	C	.	.			trans	-125.3	131.3	178.7	-59.9	0	0	0	0	109.6	C931 T943 L945 F964	C904-C931 HydrophobicContact CB-CB 3.53Å; C904-C931 WeakPolarHBondContact CB-SG 3.32Å; C904-C931 WeakPolarHBondContact SG-CA 3.15Å; C904-C931 WeakPolarHBondContact SG-CB 3.28Å; C904-C931 CovalentContact SG-SG 2.02Å; C904-C931 PolarHBondContact SG-SG 2.79Å; C904-T943 WeakPolarHBondContact O-CB 3.43Å; C904-T943 PolarHBondContact O-OG1 3.06Å; C904-L945 HydrophobicContact CB-CD1 4.22Å; C904-F964 HydrophobicContact CB-CD1 3.8Å; C904-F964 HydrophobicContact CB-CD2 4.31Å; C904-F964 HydrophobicContact CB-CE1 3.45Å; C904-F964 VanDerWaalsContact CB-CE1 3.45Å; C904-F964 HydrophobicContact CB-CE2 4Å; C904-F964 HydrophobicContact CB-CG 4.21Å; C904-F964 HydrophobicContact CB-CZ 3.55Å
905	D	82.6	Confident	84.2	Confident	40 Å²	40	44.6 Å²	44.6	21%	0.214	24%	0.235	C	C	.	.			trans	-154.6	166	-174.1	-156.9	5.5	0	0	0	111.7	G907 L910 Q913 T943 V944	D905-G907 PolarHBondContact O-N 2.91Å; D905-L910 HydrophobicContact CB-CD1 3.46Å; D905-L910 VanDerWaalsContact CB-CD1 3.46Å; D905-Q913 VanDerWaalsContact N-NE2 3.13Å; D905-Q913 PolarHBondContact O-NE2 3.11Å; D905-Q913 PolarHBondContact O-OE1 3.07Å; D905-T943 HydrophobicContact CB-CG2 4.11Å; D905-T943 WeakPolarHBondContact OD1-CA 3.17Å; D905-V944 PolarHBondContact OD1-N 3.11Å
906	C	73.6	Confident	84	Confident	48 Å²	48	44.6 Å²	44.6	32%	0.324	24%	0.235	S	C	.	.	S	Bend	trans	-72.2	122.6	173.9	-66.3	0	0	0	0	111.2	V944 C973	C906-V944 HydrophobicContact CB-CG2 4.16Å; C906-V944 WeakPolarHBondContact SG-CG2 3.38Å; C906-C973 VanDerWaalsContact CA-SG 3.58Å; C906-C973 HydrophobicContact CB-CB 3.98Å; C906-C973 WeakPolarHBondContact CB-SG 3.44Å; C906-C973 VanDerWaalsContact SG-CA 3.56Å; C906-C973 WeakPolarHBondContact SG-CB 3.27Å; C906-C973 CovalentContact SG-SG 2.01Å; C906-C973 PolarHBondContact SG-SG 3.29Å
907	G	65.9	Low	83.6	Confident	42 Å²	42	46.6 Å²	46.6	43%	0.433	25%	0.248	S	C	.	.	S	Bend	trans	129.5	155.5	164.8	0	0	0	0	0	114.8	D905 K909	D905-G907 PolarHBondContact O-N 2.91Å; G907-K909 PolarHBondContact O-N 3.27Å
908	D	62.1	Low	83.2	Confident	143 Å²	143	49.9 Å²	49.9	77%	0.765	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-5.5	-171.7	-56.3	-36.4	0	0	0	115	L910 N914	D908-L910 VanDerWaalsContact C-N 3.31Å; D908-L910 PolarHBondContact O-N 3.2Å; D908-N914 PolarHBondContact O-ND2 3.11Å; D908-N914 VanDerWaalsContact O-ND2 3.12Å
909	K	61.2	Low	83	Confident	202 Å²	202	52.7 Å²	52.7	88%	0.878	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-16.2	-176.8	-69.9	-174	178.2	179.4	0	113.9	G907 L911	G907-K909 PolarHBondContact O-N 3.27Å; K909-L911 PolarHBondContact O-N 3.07Å
910	L	74.5	Confident	82.8	Confident	22 Å²	22	52 Å²	52	12%	0.115	29%	0.289	C	S	.	.			trans	-94.9	100.6	-177.2	-66.8	177.1	0	0	0	111.8	Y879 D905 D908 L912 Q913	Y879-L910 HydrophobicContact CD1-CD2 3.64Å; Y879-L910 HydrophobicContact CE1-CD2 3.49Å; Y879-L910 VanDerWaalsContact CE1-CD2 3.49Å; D905-L910 HydrophobicContact CB-CD1 3.46Å; D905-L910 VanDerWaalsContact CB-CD1 3.46Å; D908-L910 VanDerWaalsContact C-N 3.31Å; D908-L910 PolarHBondContact O-N 3.2Å; L910-L912 VanDerWaalsContact C-N 3.27Å; L910-L912 PolarHBondContact O-N 3.08Å; L910-L912 VanDerWaalsContact O-N 3.13Å; L910-Q913 HydrophobicContact CB-CG 4.43Å; L910-Q913 PolarHBondContact O-N 3.25Å; L910-Q913 VanDerWaalsContact O-N 3.16Å
911	L	80.7	Confident	82.6	Confident	77 Å²	77	56.8 Å²	56.8	40%	0.403	33%	0.329	S	S	.	.	H	α-helix	trans	-50.1	-39.1	-176.4	-72.7	167.4	0	0	0	114.3	L880 P882 A885 K909 Q913 N914 W915	L880-L911 HydrophobicContact CB-CB 4.38Å; P882-L911 HydrophobicContact CB-CD1 4.09Å; P882-L911 HydrophobicContact CG-CD1 4.03Å; A885-L911 HydrophobicContact CB-CD2 4.29Å; K909-L911 PolarHBondContact O-N 3.07Å; L911-Q913 PolarHBondContact O-N 3.15Å; L911-N914 PolarHBondContact O-N 3.11Å; L911-W915 WeakPolarHBondContact O-CB 3.33Å; L911-W915 PolarHBondContact O-N 2.73Å
912	L	87.7	Confident	82.6	Confident	8 Å²	8	57 Å²	57	4%	0.042	33%	0.328	C	S	.	.	H	α-helix	trans	-63.7	-41.1	-177	-175.7	64.4	0	0	0	112.7	L880 L897 W902 L910 N914 W915 L916 F961	L880-L912 HydrophobicContact CB-CB 4.12Å; L880-L912 HydrophobicContact CB-CD1 4.36Å; L880-L912 HydrophobicContact CD1-CD1 4.35Å; L880-L912 HydrophobicContact CD2-CD1 4.43Å; L897-L912 HydrophobicContact CD1-CD1 4.2Å; W902-L912 HydrophobicContact CB-CD2 3.98Å; W902-L912 HydrophobicContact CD2-CD2 3.56Å; W902-L912 HydrophobicContact CE3-CD2 3.74Å; W902-L912 HydrophobicContact CG-CD2 3.68Å; W902-L912 HydrophobicContact CZ3-CD2 4.46Å; L910-L912 VanDerWaalsContact C-N 3.27Å; L910-L912 PolarHBondContact O-N 3.08Å; L910-L912 VanDerWaalsContact O-N 3.13Å; L912-N914 VanDerWaalsContact C-N 3.33Å; L912-N914 PolarHBondContact O-N 3.39Å; L912-W915 PolarHBondContact O-N 2.96Å; L912-L916 HydrophobicContact CD1-CB 4.31Å; L912-L916 WeakPolarHBondContact O-CB 3.5Å; L912-L916 PolarHBondContact O-N 3.12Å; L912-F961 HydrophobicContact CD2-CD2 4.28Å; L912-F961 HydrophobicContact CD2-CE2 3.7Å; L912-F961 HydrophobicContact CD2-CZ 4.19Å; L912-F961 HydrophobicContact CG-CE2 3.85Å; L912-F961 HydrophobicContact CG-CZ 3.84Å
913	Q	84.7	Confident	82.7	Confident	12 Å²	12	56.9 Å²	56.9	6%	0.056	33%	0.328	C	S	.	.	H	α-helix	trans	-65.6	-37.2	-178.2	-66.6	-176.8	55.4	0	0	112.2	D905 L910 L911 P917 F961	D905-Q913 VanDerWaalsContact N-NE2 3.13Å; D905-Q913 PolarHBondContact O-NE2 3.11Å; D905-Q913 PolarHBondContact O-OE1 3.07Å; L910-Q913 HydrophobicContact CB-CG 4.43Å; L910-Q913 PolarHBondContact O-N 3.25Å; L910-Q913 VanDerWaalsContact O-N 3.16Å; L911-Q913 PolarHBondContact O-N 3.15Å; Q913-P917 WeakPolarHBondContact O-CD 3.16Å; Q913-P917 WeakPolarHBondContact O-CG 3.28Å; Q913-F961 HydrophobicContact CG-CE2 4.14Å; Q913-F961 HydrophobicContact CG-CZ 4.15Å
914	N	83.1	Confident	82.9	Confident	97 Å²	97	59.2 Å²	59.2	52%	0.519	35%	0.347	S	S	.	.	H	α-helix	trans	-79.8	-38.1	177.7	-67	-17.4	0	0	0	112.2	D908 L911 L912	D908-N914 PolarHBondContact O-ND2 3.11Å; D908-N914 VanDerWaalsContact O-ND2 3.12Å; L911-N914 PolarHBondContact O-N 3.11Å; L912-N914 VanDerWaalsContact C-N 3.33Å; L912-N914 PolarHBondContact O-N 3.39Å
915	W	88.1	Confident	83.3	Confident	23 Å²	23	60.7 Å²	60.7	9%	0.087	36%	0.355	C	S	.	.	H	α-helix	trans	-81.3	-43.4	-171.2	179.2	85.2	0	0	0	113.3	L880 I884 A885 L897 L911 L912 G918 N919 L922 V923	L880-W915 HydrophobicContact CD1-CE3 4.49Å; L880-W915 HydrophobicContact CD1-CZ3 4.36Å; L880-W915 HydrophobicContact CD2-CB 4.02Å; L880-W915 HydrophobicContact CD2-CD2 3.62Å; L880-W915 HydrophobicContact CD2-CE3 3.5Å; L880-W915 HydrophobicContact CD2-CG 3.87Å; L880-W915 HydrophobicContact CD2-CZ3 4.14Å; I884-W915 HydrophobicContact CG2-CH2 3.93Å; I884-W915 HydrophobicContact CG2-CZ2 3.77Å; A885-W915 HydrophobicContact CB-CG 4.21Å; L897-W915 HydrophobicContact CD1-CZ3 3.92Å; L911-W915 WeakPolarHBondContact O-CB 3.33Å; L911-W915 PolarHBondContact O-N 2.73Å; L912-W915 PolarHBondContact O-N 2.96Å; W915-G918 PolarHBondContact O-N 3.45Å; W915-N919 VanDerWaalsContact CD1-ND2 3.31Å; W915-N919 HydrophobicContact CD2-CB 4.04Å; W915-N919 HydrophobicContact CE3-CB 4.29Å; W915-N919 HydrophobicContact CH2-CB 4.08Å; W915-N919 HydrophobicContact CZ2-CB 3.8Å; W915-N919 HydrophobicContact CZ3-CB 4.31Å; W915-N919 PolarHBondContact NE1-ND2 3.09Å; W915-N919 PolarHBondContact O-N 3.23Å; W915-N919 PolarHBondContact O-ND2 3.28Å; W915-L922 HydrophobicContact CH2-CD2 3.8Å; W915-L922 HydrophobicContact CZ2-CD2 3.57Å; W915-V923 HydrophobicContact CH2-CG2 3.78Å; W915-V923 HydrophobicContact CZ3-CG2 3.76Å
916	L	90.1	Very high	83.7	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-62.8	-42.1	-171.6	-172.3	72.7	0	0	0	114.2	L912 G918 N919 R920 V923 H926 L929 F961 W962	L912-L916 HydrophobicContact CD1-CB 4.31Å; L912-L916 WeakPolarHBondContact O-CB 3.5Å; L912-L916 PolarHBondContact O-N 3.12Å; L916-G918 PolarHBondContact O-N 2.9Å; L916-N919 CarbonylContact O-C 3.56Å; L916-N919 PolarHBondContact O-N 3.24Å; L916-R920 WeakPolarHBondContact O-CG 3.27Å; L916-R920 PolarHBondContact O-N 2.76Å; L916-R920 VanDerWaalsContact O-N 3.14Å; L916-V923 HydrophobicContact CD1-CB 3.95Å; L916-V923 HydrophobicContact CD1-CG1 4.12Å; L916-V923 HydrophobicContact CD1-CG2 3.77Å; L916-H926 HydrophobicContact CD1-CB 4.33Å; L916-H926 HydrophobicContact CD2-CB 4.49Å; L916-L929 HydrophobicContact CD1-CD1 4.16Å; L916-L929 HydrophobicContact CD2-CD1 3.34Å; L916-L929 HydrophobicContact CG-CD1 4.4Å; L916-F961 HydrophobicContact CB-CE1 4.19Å; L916-F961 HydrophobicContact CD2-CD1 3.63Å; L916-F961 HydrophobicContact CD2-CE1 3.38Å; L916-F961 HydrophobicContact CD2-CZ 4.23Å; L916-F961 HydrophobicContact CG-CE1 4.38Å; L916-W962 HydrophobicContact CD2-CH2 3.98Å; L916-W962 HydrophobicContact CD2-CZ2 3.64Å; L916-W962 HydrophobicContact CG-CH2 4.13Å; L916-W962 HydrophobicContact CG-CZ2 4.06Å
917	P	87.8	Confident	84.5	Confident	60 Å²	60	65.3 Å²	65.3	39%	0.39	37%	0.371	S	S	.	.	H	α-helix	trans	-56	-36.5	178.6	-27	36.3	0	0	0	113.6	Q913 W962 L965	Q913-P917 WeakPolarHBondContact O-CD 3.16Å; Q913-P917 WeakPolarHBondContact O-CG 3.28Å; P917-W962 HydrophobicContact CG-CZ3 4.42Å; P917-L965 HydrophobicContact CG-CD1 4.22Å
918	G	87.4	Confident	85.8	Confident	69 Å²	69	65.6 Å²	65.6	71%	0.711	37%	0.366	S	S	*	.	H	α-helix	trans	-81.9	-13.2	176.4	0	0	0	0	0	114.9	W915 L916	W915-G918 PolarHBondContact O-N 3.45Å; L916-G918 PolarHBondContact O-N 2.9Å
919	N	90.3	Very high	87.3	Confident	58 Å²	58	58.8 Å²	58.8	31%	0.31	33%	0.329	S	S	.	.			trans	-124.5	21.9	-171.3	-68.4	-85.8	0	0	0	113.5	W915 L916 A921 L922	W915-N919 VanDerWaalsContact CD1-ND2 3.31Å; W915-N919 HydrophobicContact CD2-CB 4.04Å; W915-N919 HydrophobicContact CE3-CB 4.29Å; W915-N919 HydrophobicContact CH2-CB 4.08Å; W915-N919 HydrophobicContact CZ2-CB 3.8Å; W915-N919 HydrophobicContact CZ3-CB 4.31Å; W915-N919 PolarHBondContact NE1-ND2 3.09Å; W915-N919 PolarHBondContact O-N 3.23Å; W915-N919 PolarHBondContact O-ND2 3.28Å; L916-N919 CarbonylContact O-C 3.56Å; L916-N919 PolarHBondContact O-N 3.24Å; N919-A921 VanDerWaalsContact C-N 3.26Å; N919-A921 PolarHBondContact O-N 2.92Å; N919-L922 HydrophobicContact CB-CB 4.5Å; N919-L922 WeakPolarHBondContact O-CB 3.33Å; N919-L922 PolarHBondContact O-N 2.98Å
920	R	89.3	Confident	88.7	Confident	123 Å²	123	53.4 Å²	53.4	46%	0.464	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-51.5	-41.8	-178.2	-67.3	-178	176.6	174.7	-2.6	113.6	L916 L922 V923 W962	L916-R920 WeakPolarHBondContact O-CG 3.27Å; L916-R920 PolarHBondContact O-N 2.76Å; L916-R920 VanDerWaalsContact O-N 3.14Å; R920-L922 PolarHBondContact O-N 2.9Å; R920-V923 CarbonylContact O-C 3.47Å; R920-V923 PolarHBondContact O-N 3.09Å; R920-W962 HydrophobicContact CG-CH2 3.87Å; R920-W962 HydrophobicContact CG-CZ2 4.02Å
921	A	88.6	Confident	89.4	Confident	106 Å²	106	52.4 Å²	52.4	88%	0.876	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-63.9	-24.6	-179.7	0	0	0	0	0	113.6	N919	N919-A921 VanDerWaalsContact C-N 3.26Å; N919-A921 PolarHBondContact O-N 2.92Å
922	L	91.3	Very high	89.7	Confident	27 Å²	27	51.7 Å²	51.7	14%	0.141	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-78.3	-22.2	176.5	-173.8	69.7	0	0	0	112	L892 S894 V895 W915 N919 R920 P924	L892-L922 HydrophobicContact CB-CD1 4.48Å; L892-L922 HydrophobicContact CG-CD1 4.37Å; L892-L922 VanDerWaalsContact O-CD1 3.22Å; L892-L922 WeakPolarHBondContact O-CD1 3.45Å; S894-L922 CarbonylContact C-O 3.55Å; S894-L922 WeakPolarHBondContact CA-O 3.25Å; V895-L922 HydrophobicContact CG2-CD1 4.47Å; V895-L922 HydrophobicContact CG2-CD2 4.13Å; V895-L922 HydrophobicContact CG2-CG 4.09Å; V895-L922 PolarHBondContact N-O 3.48Å; W915-L922 HydrophobicContact CH2-CD2 3.8Å; W915-L922 HydrophobicContact CZ2-CD2 3.57Å; N919-L922 HydrophobicContact CB-CB 4.5Å; N919-L922 WeakPolarHBondContact O-CB 3.33Å; N919-L922 PolarHBondContact O-N 2.98Å; R920-L922 PolarHBondContact O-N 2.9Å; L922-P924 VanDerWaalsContact O-CD 3.28Å; L922-P924 WeakPolarHBondContact O-CD 3.14Å
923	V	93.6	Very high	89.5	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	30%	0.297	C	S	.	.			trans	-115	86.6	-171	-174.8	0	0	0	0	110.1	V895 L897 W915 L916 R920 D925 H926	V895-V923 VanDerWaalsContact O-CA 3.29Å; V895-V923 WeakPolarHBondContact O-CA 3.37Å; V895-V923 WeakPolarHBondContact O-CG1 3.33Å; L897-V923 HydrophobicContact CB-CG1 4.24Å; L897-V923 HydrophobicContact CD1-CG1 4.21Å; L897-V923 HydrophobicContact CD1-CG2 4.1Å; L897-V923 HydrophobicContact CG-CG1 4.23Å; W915-V923 HydrophobicContact CH2-CG2 3.78Å; W915-V923 HydrophobicContact CZ3-CG2 3.76Å; L916-V923 HydrophobicContact CD1-CB 3.95Å; L916-V923 HydrophobicContact CD1-CG1 4.12Å; L916-V923 HydrophobicContact CD1-CG2 3.77Å; R920-V923 CarbonylContact O-C 3.47Å; R920-V923 PolarHBondContact O-N 3.09Å; V923-D925 VanDerWaalsContact CG1-OD1 3.31Å; V923-D925 WeakPolarHBondContact CG1-OD1 3.18Å; V923-D925 PolarHBondContact O-N 3.44Å; V923-D925 VanDerWaalsContact O-N 3.14Å; V923-H926 HydrophobicContact CB-CB 4.2Å; V923-H926 HydrophobicContact CG1-CB 3.99Å; V923-H926 VanDerWaalsContact O-CB 3.31Å; V923-H926 WeakPolarHBondContact O-CB 3.42Å; V923-H926 PolarHBondContact O-CD2 3.17Å; V923-H926 PolarHBondContact O-N 3.2Å; V923-H926 VanDerWaalsContact O-N 3.11Å
924	P	91.6	Very high	89.2	Confident	87 Å²	87	55.7 Å²	55.7	57%	0.565	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-22.6	-173.5	24.8	-34.3	0	0	0	113.9	T896 L922	T896-P924 HydrophobicContact CG2-CG 4.22Å; L922-P924 VanDerWaalsContact O-CD 3.28Å; L922-P924 WeakPolarHBondContact O-CD 3.14Å
925	D	94	Very high	88.8	Confident	30 Å²	30	53.6 Å²	53.6	16%	0.16	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	20.3	178.8	69.2	-19	0	0	0	113.4	T896 L897 G898 V923 E927 S928	T896-D925 VanDerWaalsContact CA-OD1 3.24Å; T896-D925 WeakPolarHBondContact CA-OD1 3.19Å; T896-D925 WeakPolarHBondContact CB-OD2 3.33Å; L897-D925 PolarHBondContact N-OD1 3.16Å; L897-D925 PolarHBondContact N-OD2 3.13Å; G898-D925 WeakPolarHBondContact CA-OD2 3.43Å; G898-D925 PolarHBondContact N-OD2 3.46Å; V923-D925 VanDerWaalsContact CG1-OD1 3.31Å; V923-D925 WeakPolarHBondContact CG1-OD1 3.18Å; V923-D925 PolarHBondContact O-N 3.44Å; V923-D925 VanDerWaalsContact O-N 3.14Å; D925-E927 PolarHBondContact O-N 2.78Å; D925-S928 PolarHBondContact O-N 2.85Å; D925-S928 PolarHBondContact O-OG 2.03Å
926	H	92.6	Very high	88	Confident	42 Å²	42	57.2 Å²	57.2	19%	0.194	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-58.1	-24.9	-174.6	70.6	76.3	0	0	0	114.4	L916 V923 S928 L929 W962	L916-H926 HydrophobicContact CD1-CB 4.33Å; L916-H926 HydrophobicContact CD2-CB 4.49Å; V923-H926 HydrophobicContact CB-CB 4.2Å; V923-H926 HydrophobicContact CG1-CB 3.99Å; V923-H926 VanDerWaalsContact O-CB 3.31Å; V923-H926 WeakPolarHBondContact O-CB 3.42Å; V923-H926 PolarHBondContact O-CD2 3.17Å; V923-H926 PolarHBondContact O-N 3.2Å; V923-H926 VanDerWaalsContact O-N 3.11Å; H926-S928 VanDerWaalsContact C-N 3.28Å; H926-L929 HydrophobicContact CB-CD1 4.38Å; H926-W962 HydrophobicContact CB-CZ2 4.35Å; H926-W962 AromaticContact ND1-CE2 3.78Å; H926-W962 AromaticContact ND1-CZ2 3.8Å; H926-W962 AromaticContact ND1-NE1 3.38Å; H926-W962 PolarHBondContact ND1-NE1 2.49Å; H926-W962 PolarHBondContact O-NE1 3.13Å
927	E	90.4	Very high	86.9	Confident	144 Å²	144	59.3 Å²	59.3	67%	0.673	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-72.2	-24.3	177.8	-60.6	-170.3	160.8	0	0	112.6	D925 L929 N960	D925-E927 PolarHBondContact O-N 2.78Å; E927-L929 VanDerWaalsContact C-N 3.32Å; E927-L929 PolarHBondContact O-N 3.46Å; E927-N960 PolarHBondContact O-ND2 3.15Å
928	S	91.7	Very high	85.8	Confident	47 Å²	47	61.5 Å²	61.5	33%	0.329	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-90.6	10.2	-176.8	75.2	0	0	0	0	114	D925 H926 Y930	D925-S928 PolarHBondContact O-N 2.85Å; D925-S928 PolarHBondContact O-OG 2.03Å; H926-S928 VanDerWaalsContact C-N 3.28Å; S928-Y930 VanDerWaalsContact O-CD2 3.24Å; S928-Y930 WeakPolarHBondContact O-CD2 3.33Å
929	L	93.9	Very high	84.2	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	35%	0.351	C	S	.	.			trans	-81.5	133.7	178.9	-63.6	170.8	0	0	0	110.5	L897 W902 L916 H926 E927 F961	L897-L929 HydrophobicContact CB-CD2 3.65Å; L897-L929 VanDerWaalsContact O-CD2 3.25Å; L897-L929 WeakPolarHBondContact O-CD2 3.43Å; W902-L929 VanDerWaalsContact NE1-CD2 3.3Å; L916-L929 HydrophobicContact CD1-CD1 4.16Å; L916-L929 HydrophobicContact CD2-CD1 3.34Å; L916-L929 HydrophobicContact CG-CD1 4.4Å; H926-L929 HydrophobicContact CB-CD1 4.38Å; E927-L929 VanDerWaalsContact C-N 3.32Å; E927-L929 PolarHBondContact O-N 3.46Å; L929-F961 HydrophobicContact CB-CB 3.69Å; L929-F961 HydrophobicContact CB-CG 4.24Å; L929-F961 VanDerWaalsContact O-CB 3.29Å; L929-F961 WeakPolarHBondContact O-CB 3.34Å; L929-F961 PolarHBondContact O-N 2.91Å
930	Y	91.3	Very high	82.4	Confident	90 Å²	90	63.6 Å²	63.6	35%	0.353	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	137	177.2	-70.1	-97	0	0	0	110.1	S928 K958 V959 N960	S928-Y930 VanDerWaalsContact O-CD2 3.24Å; S928-Y930 WeakPolarHBondContact O-CD2 3.33Å; Y930-K958 HydrophobicContact CD1-CD 4.18Å; Y930-K958 HydrophobicContact CD1-CG 3.68Å; Y930-K958 HydrophobicContact CG-CD 4.32Å; Y930-K958 HydrophobicContact CG-CG 4.01Å; Y930-V959 CarbonylContact C-O 3.52Å; Y930-V959 VanDerWaalsContact CA-O 3.23Å; Y930-V959 WeakPolarHBondContact CA-O 3.41Å; Y930-N960 HydrophobicContact CD1-CB 4.4Å; Y930-N960 HydrophobicContact CE1-CB 4.17Å
931	C	89	Confident	80.6	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	126.7	162.7	-65.7	0	0	0	0	108.5	W902 C904 L945 K958 V959 F964	W902-C931 WeakPolarHBondContact O-CA 3.13Å; C904-C931 HydrophobicContact CB-CB 3.53Å; C904-C931 WeakPolarHBondContact CB-SG 3.32Å; C904-C931 WeakPolarHBondContact SG-CA 3.15Å; C904-C931 WeakPolarHBondContact SG-CB 3.28Å; C904-C931 CovalentContact SG-SG 2.02Å; C904-C931 PolarHBondContact SG-SG 2.79Å; C931-L945 HydrophobicContact CB-CD1 3.93Å; C931-L945 HydrophobicContact CB-CD2 4.02Å; C931-K958 WeakPolarHBondContact O-CA 3.38Å; C931-V959 PolarHBondContact N-O 3.33Å; C931-V959 PolarHBondContact O-N 3.49Å; C931-F964 HydrophobicContact CB-CG 4.5Å
932	Q	86.1	Confident	79	Confident	62 Å²	62	61.1 Å²	61.1	29%	0.29	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	132.5	-178	-173.4	175.4	-31.1	0	0	111.7	W902 F956 V957	W902-Q932 PolarHBondContact O-N 3.02Å; Q932-F956 HydrophobicContact CG-CD2 4.46Å; Q932-V957 VanDerWaalsContact CA-O 3.3Å; Q932-V957 WeakPolarHBondContact CA-O 3.47Å
933	E	83.6	Confident	77.9	Confident	24 Å²	24	60.1 Å²	60.1	11%	0.112	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	135.9	171.1	-170.4	179.7	174.2	0	0	110.3	T943 L945 R946 F956 V957	E933-T943 WeakPolarHBondContact OE2-CB 3.41Å; E933-T943 PolarHBondContact OE2-OG1 2.87Å; E933-L945 HydrophobicContact CB-CB 4.1Å; E933-L945 HydrophobicContact CB-CD1 4.03Å; E933-R946 WeakPolarHBondContact OE1-CG 3.42Å; E933-R946 IonicContact OE1-CZ 2.93Å; E933-R946 IonicContact OE1-NE 2.65Å; E933-R946 PolarHBondContact OE1-NE 2.92Å; E933-R946 IonicContact OE1-NH2 3.78Å; E933-R946 WeakPolarHBondContact OE2-CG 3.5Å; E933-F956 WeakPolarHBondContact O-CA 3.38Å; E933-F956 WeakPolarHBondContact O-CB 3.4Å; E933-V957 PolarHBondContact N-O 3.45Å; E933-V957 VanDerWaalsContact N-O 3.11Å; E933-V957 PolarHBondContact O-N 3.05Å
934	D	79.1	Confident	76.7	Confident	80 Å²	80	61 Å²	61	43%	0.428	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	121.8	171.8	-171.7	-18.7	0	0	0	109.8	T936	D934-T936 VanDerWaalsContact C-N 3.28Å; D934-T936 VanDerWaalsContact CG-OG1 3.23Å; D934-T936 PolarHBondContact O-N 3.07Å; D934-T936 WeakPolarHBondContact OD1-CB 3.18Å; D934-T936 PolarHBondContact OD1-N 3.14Å; D934-T936 PolarHBondContact OD1-OG1 2.87Å; D934-T936 PolarHBondContact OD2-OG1 2.94Å
935	L	74.1	Confident	75.7	Confident	54 Å²	54	56.9 Å²	56.9	28%	0.283	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-14.4	-178.1	-60.4	176.6	0	0	0	112.9	R946 P950 H955 V957	L935-R946 HydrophobicContact CD2-CB 4.22Å; L935-R946 HydrophobicContact CD2-CG 3.82Å; L935-P950 HydrophobicContact CD1-CB 3.94Å; L935-P950 HydrophobicContact CD1-CG 4.44Å; L935-H955 WeakPolarHBondContact CB-O 3.1Å; L935-H955 PolarHBondContact N-O 2.98Å; L935-V957 HydrophobicContact CD1-CG2 4.08Å; L935-V957 HydrophobicContact CD2-CG2 4.06Å; L935-V957 HydrophobicContact CG-CG2 4.22Å
936	T	72.7	Confident	74.4	Confident	98 Å²	98	58.7 Å²	58.7	60%	0.601	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-18.9	177.1	66.6	0	0	0	0	113.2	D934 H955	D934-T936 VanDerWaalsContact C-N 3.28Å; D934-T936 VanDerWaalsContact CG-OG1 3.23Å; D934-T936 PolarHBondContact O-N 3.07Å; D934-T936 WeakPolarHBondContact OD1-CB 3.18Å; D934-T936 PolarHBondContact OD1-N 3.14Å; D934-T936 PolarHBondContact OD1-OG1 2.87Å; D934-T936 PolarHBondContact OD2-OG1 2.94Å; T936-H955 HydrophobicContact CG2-CB 3.8Å
937	A	67.4	Low	73.2	Confident	44 Å²	44	62.6 Å²	62.6	36%	0.364	36%	0.359	S	S	.	.	S	Bend	trans	-66.2	147.1	177.4	0	0	0	0	0	111.3	A939 R946	A937-A939 PolarHBondContact O-N 3.19Å; A937-R946 PolarHBondContact O-NH2 3.06Å
938	P	63.9	Low	72.2	Confident	106 Å²	106	57.7 Å²	57.7	69%	0.688	34%	0.337	S	S	*	.			trans	-56.1	137.9	179.1	19.7	-30.2	0	0	0	111.9	S940	P938-S940 PolarHBondContact O-N 3.47Å
939	A	54.3	Low	71	Confident	66 Å²	66	60.5 Å²	60.5	55%	0.545	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-69.1	10	-171.7	0	0	0	0	0	115.6	A937 D941 S942	A937-A939 PolarHBondContact O-N 3.19Å; A939-D941 PolarHBondContact O-N 3.02Å; A939-S942 PolarHBondContact O-N 2.99Å
940	S	52	Low	69.7	Low	106 Å²	106	64 Å²	64	74%	0.741	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-64.4	-13.8	-173.4	55.2	0	0	0	0	114.1	P938	P938-S940 PolarHBondContact O-N 3.47Å
941	D	52.3	Low	68.7	Low	99 Å²	99	61.3 Å²	61.3	53%	0.529	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-135.6	41.8	-173	-116.1	32.2	0	0	0	110.6	K903 A939 T943	K903-D941 IonicContact NZ-OD2 2.79Å; K903-D941 PolarHBondContact NZ-OD2 2.02Å; A939-D941 PolarHBondContact O-N 3.02Å; D941-T943 PolarHBondContact O-N 3.37Å; D941-T943 VanDerWaalsContact O-N 3.13Å
942	S	54.5	Low	67.5	Low	77 Å²	77	71.4 Å²	71.4	54%	0.538	42%	0.415	S	S	.	.			trans	-54.6	114.6	-173.9	59.6	0	0	0	0	112.1	A939	A939-S942 PolarHBondContact O-N 2.99Å
943	T	68.4	Low	66.3	Low	6 Å²	6	72.3 Å²	72.3	4%	0.037	44%	0.441	C	S	.	.			trans	-90.1	164	169.3	86.5	0	0	0	0	111.2	K903 C904 D905 E933 D941 L945 R946	K903-T943 HydrophobicContact CD-CG2 4.04Å; K903-T943 HydrophobicContact CG-CG2 3.77Å; C904-T943 WeakPolarHBondContact O-CB 3.43Å; C904-T943 PolarHBondContact O-OG1 3.06Å; D905-T943 HydrophobicContact CB-CG2 4.11Å; D905-T943 WeakPolarHBondContact OD1-CA 3.17Å; E933-T943 WeakPolarHBondContact OE2-CB 3.41Å; E933-T943 PolarHBondContact OE2-OG1 2.87Å; D941-T943 PolarHBondContact O-N 3.37Å; D941-T943 VanDerWaalsContact O-N 3.13Å; T943-L945 PolarHBondContact O-N 3.39Å; T943-L945 WeakPolarHBondContact OG1-CB 3.23Å; T943-L945 PolarHBondContact OG1-N 2.8Å; T943-L945 VanDerWaalsContact OG1-N 3.11Å; T943-R946 PolarHBondContact O-N 2.71Å; T943-R946 VanDerWaalsContact O-N 3.15Å
944	V	68.7	Low	65.4	Low	19 Å²	19	76.2 Å²	76.2	12%	0.115	46%	0.459	C	S	.	.	G	3₁₀ helix	trans	-54.3	-23.1	171.5	169.4	0	0	0	0	113.6	D905 C906 R946 L947 F972	D905-V944 PolarHBondContact OD1-N 3.11Å; C906-V944 HydrophobicContact CB-CG2 4.16Å; C906-V944 WeakPolarHBondContact SG-CG2 3.38Å; V944-R946 PolarHBondContact O-N 3.36Å; V944-L947 HydrophobicContact CG1-CD1 4.47Å; V944-L947 WeakPolarHBondContact O-CB 3.42Å; V944-L947 PolarHBondContact O-N 3.33Å; V944-L947 VanDerWaalsContact O-N 3.08Å; V944-F972 HydrophobicContact CG1-CB 3.41Å; V944-F972 VanDerWaalsContact CG1-CB 3.41Å; V944-F972 HydrophobicContact CG1-CD1 4.28Å; V944-F972 HydrophobicContact CG1-CD2 3.95Å; V944-F972 HydrophobicContact CG1-CG 3.63Å
945	L	70.6	Confident	65.2	Low	0 Å²	0	79.4 Å²	79.4	0%	0	47%	0.471	C	S	.	.	G	3₁₀ helix	trans	-62.9	-27.5	178.4	-61.3	171.4	0	0	0	113	C904 C931 E933 T943 L947 L948 V957 F964	C904-L945 HydrophobicContact CB-CD1 4.22Å; C931-L945 HydrophobicContact CB-CD1 3.93Å; C931-L945 HydrophobicContact CB-CD2 4.02Å; E933-L945 HydrophobicContact CB-CB 4.1Å; E933-L945 HydrophobicContact CB-CD1 4.03Å; T943-L945 PolarHBondContact O-N 3.39Å; T943-L945 WeakPolarHBondContact OG1-CB 3.23Å; T943-L945 PolarHBondContact OG1-N 2.8Å; T943-L945 VanDerWaalsContact OG1-N 3.11Å; L945-L947 PolarHBondContact O-N 3.25Å; L945-L948 HydrophobicContact CD2-CD1 4.01Å; L945-L948 WeakPolarHBondContact O-CB 3.29Å; L945-L948 PolarHBondContact O-N 2.91Å; L945-L948 VanDerWaalsContact O-N 3.07Å; L945-V957 HydrophobicContact CB-CB 4.47Å; L945-V957 HydrophobicContact CB-CG1 4.18Å; L945-V957 HydrophobicContact CD2-CG1 4.48Å; L945-F964 HydrophobicContact CD2-CD2 3.82Å; L945-F964 HydrophobicContact CD2-CE2 3.96Å
946	R	66.8	Low	65.3	Low	68 Å²	68	79.3 Å²	79.3	26%	0.257	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-63.9	-19.5	174.6	-65.2	-163.1	177.5	-146.2	-7.5	114.4	E933 L935 A937 T943 V944	E933-R946 WeakPolarHBondContact OE1-CG 3.42Å; E933-R946 IonicContact OE1-CZ 2.93Å; E933-R946 IonicContact OE1-NE 2.65Å; E933-R946 PolarHBondContact OE1-NE 2.92Å; E933-R946 IonicContact OE1-NH2 3.78Å; E933-R946 WeakPolarHBondContact OE2-CG 3.5Å; L935-R946 HydrophobicContact CD2-CB 4.22Å; L935-R946 HydrophobicContact CD2-CG 3.82Å; A937-R946 PolarHBondContact O-NH2 3.06Å; T943-R946 PolarHBondContact O-N 2.71Å; T943-R946 VanDerWaalsContact O-N 3.15Å; V944-R946 PolarHBondContact O-N 3.36Å
947	L	66.9	Low	65.6	Low	124 Å²	124	74.8 Å²	74.8	65%	0.649	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-76.4	-14.5	176.5	-61.4	173.7	0	0	0	112.2	V944 L945 F972	V944-L947 HydrophobicContact CG1-CD1 4.47Å; V944-L947 WeakPolarHBondContact O-CB 3.42Å; V944-L947 PolarHBondContact O-N 3.33Å; V944-L947 VanDerWaalsContact O-N 3.08Å; L945-L947 PolarHBondContact O-N 3.25Å; L947-F972 HydrophobicContact CB-CE1 4.4Å; L947-F972 HydrophobicContact CD1-CD1 4.15Å
948	L	69	Low	66.4	Low	42 Å²	42	77.3 Å²	77.3	22%	0.22	44%	0.444	C	S	.	.	S	Bend	trans	-88.6	145.5	177.4	-65.6	164.5	0	0	0	110.5	L945 V957 V959 F972	L945-L948 HydrophobicContact CD2-CD1 4.01Å; L945-L948 WeakPolarHBondContact O-CB 3.29Å; L945-L948 PolarHBondContact O-N 2.91Å; L945-L948 VanDerWaalsContact O-N 3.07Å; L948-V957 HydrophobicContact CB-CG1 3.89Å; L948-V957 HydrophobicContact CD1-CG1 4.12Å; L948-V959 HydrophobicContact CD1-CG2 3.79Å; L948-F972 HydrophobicContact CD2-CE2 4.04Å; L948-F972 HydrophobicContact CD2-CZ 3.74Å; L948-F972 HydrophobicContact CG-CZ 4.41Å
949	P	65.7	Low	67.5	Low	105 Å²	105	73.8 Å²	73.8	68%	0.682	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-62.2	145	176.5	25.6	-32.8	0	0	0	110.9
950	P	67	Low	69.2	Low	74 Å²	74	72.5 Å²	72.5	48%	0.481	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-58.4	147.7	175.9	20.8	-29.8	0	0	0	111.6	L935 K952 H954	L935-P950 HydrophobicContact CD1-CB 3.94Å; L935-P950 HydrophobicContact CD1-CG 4.44Å; P950-K952 PolarHBondContact O-N 2.96Å; P950-H954 WeakPolarHBondContact CB-O 3.5Å
951	S	69.9	Low	71	Confident	34 Å²	34	67.4 Å²	67.4	24%	0.238	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-60.5	135.9	175.1	-44.7	0	0	0	0	109.3	G953 H954 F956 K958	S951-G953 PolarHBondContact O-N 3.15Å; S951-H954 PolarHBondContact O-N 3.31Å; S951-F956 PolarHBondContact N-O 2.92Å; S951-F956 VanDerWaalsContact N-O 3.11Å; S951-F956 PolarHBondContact OG-O 2.89Å; S951-F956 VanDerWaalsContact OG-O 3.04Å; S951-K958 PolarHBondContact OG-N 2.83Å
952	K	64.1	Low	72.7	Confident	212 Å²	212	64.5 Å²	64.5	92%	0.922	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.7	114.6	-176.5	-84.4	-175.3	176.4	-179.9	0	111.5	P950	P950-K952 PolarHBondContact O-N 2.96Å
953	G	61	Low	74.1	Confident	81 Å²	81	64 Å²	64	84%	0.835	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.6	6.8	175.7	0	0	0	0	0	116.8	S951	S951-G953 PolarHBondContact O-N 3.15Å
954	H	65.9	Low	74.9	Confident	106 Å²	106	64.1 Å²	64.1	49%	0.491	34%	0.344	S	S	.	.	S	Bend	trans	-134.6	151.5	-177	-64.3	-61.3	0	0	0	114	P950 S951 F956	P950-H954 WeakPolarHBondContact CB-O 3.5Å; S951-H954 PolarHBondContact O-N 3.31Å; H954-F956 HydrophobicContact CB-CD1 3.56Å; H954-F956 HydrophobicContact CB-CE1 3.28Å; H954-F956 HydrophobicContact CB-CE2 4.49Å; H954-F956 HydrophobicContact CB-CG 4.28Å; H954-F956 HydrophobicContact CB-CZ 3.79Å; H954-F956 AromaticContact CD2-CE1 3.81Å; H954-F956 AromaticContact CD2-CZ 3.68Å; H954-F956 AromaticContact CG-CE1 3.36Å; H954-F956 AromaticContact CG-CZ 3.72Å; H954-F956 AromaticContact ND1-CE1 3.82Å; H954-F956 PolarHBondContact O-N 3.11Å
955	H	74.2	Confident	75.6	Confident	146 Å²	146	65 Å²	65	68%	0.676	35%	0.347	S	S	*	.	S	Bend	trans	-82.5	22.2	175.8	-62.5	-63.9	0	0	0	114.3	L935 T936	L935-H955 WeakPolarHBondContact CB-O 3.1Å; L935-H955 PolarHBondContact N-O 2.98Å; T936-H955 HydrophobicContact CG2-CB 3.8Å
956	F	75.4	Confident	76	Confident	53 Å²	53	69.8 Å²	69.8	23%	0.232	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	150.7	178.5	66.3	-98.6	0	0	0	112	Q932 E933 S951 H954 K958	Q932-F956 HydrophobicContact CG-CD2 4.46Å; E933-F956 WeakPolarHBondContact O-CA 3.38Å; E933-F956 WeakPolarHBondContact O-CB 3.4Å; S951-F956 PolarHBondContact N-O 2.92Å; S951-F956 VanDerWaalsContact N-O 3.11Å; S951-F956 PolarHBondContact OG-O 2.89Å; S951-F956 VanDerWaalsContact OG-O 3.04Å; H954-F956 HydrophobicContact CB-CD1 3.56Å; H954-F956 HydrophobicContact CB-CE1 3.28Å; H954-F956 HydrophobicContact CB-CE2 4.49Å; H954-F956 HydrophobicContact CB-CG 4.28Å; H954-F956 HydrophobicContact CB-CZ 3.79Å; H954-F956 AromaticContact CD2-CE1 3.81Å; H954-F956 AromaticContact CD2-CZ 3.68Å; H954-F956 AromaticContact CG-CE1 3.36Å; H954-F956 AromaticContact CG-CZ 3.72Å; H954-F956 AromaticContact ND1-CE1 3.82Å; H954-F956 PolarHBondContact O-N 3.11Å; F956-K958 HydrophobicContact CD2-CB 3.91Å; F956-K958 HydrophobicContact CE2-CB 3.81Å; F956-K958 HydrophobicContact CE2-CD 4.23Å
957	V	80.2	Confident	76.2	Confident	2 Å²	2	69.2 Å²	69.2	1%	0.012	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	129.6	170.4	176.9	0	0	0	0	107.9	Q932 E933 L935 L945 L948 V959	Q932-V957 VanDerWaalsContact CA-O 3.3Å; Q932-V957 WeakPolarHBondContact CA-O 3.47Å; E933-V957 PolarHBondContact N-O 3.45Å; E933-V957 VanDerWaalsContact N-O 3.11Å; E933-V957 PolarHBondContact O-N 3.05Å; L935-V957 HydrophobicContact CD1-CG2 4.08Å; L935-V957 HydrophobicContact CD2-CG2 4.06Å; L935-V957 HydrophobicContact CG-CG2 4.22Å; L945-V957 HydrophobicContact CB-CB 4.47Å; L945-V957 HydrophobicContact CB-CG1 4.18Å; L945-V957 HydrophobicContact CD2-CG1 4.48Å; L948-V957 HydrophobicContact CB-CG1 3.89Å; L948-V957 HydrophobicContact CD1-CG1 4.12Å; V957-V959 HydrophobicContact CG1-CG2 4.19Å
958	K	83.7	Confident	76.3	Confident	98 Å²	98	64.6 Å²	64.6	43%	0.426	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	119	177.2	-174.4	176.2	-179.7	177.9	0	110.2	Y930 C931 S951 F956	Y930-K958 HydrophobicContact CD1-CD 4.18Å; Y930-K958 HydrophobicContact CD1-CG 3.68Å; Y930-K958 HydrophobicContact CG-CD 4.32Å; Y930-K958 HydrophobicContact CG-CG 4.01Å; C931-K958 WeakPolarHBondContact O-CA 3.38Å; S951-K958 PolarHBondContact OG-N 2.83Å; F956-K958 HydrophobicContact CD2-CB 3.91Å; F956-K958 HydrophobicContact CE2-CB 3.81Å; F956-K958 HydrophobicContact CE2-CD 4.23Å
959	V	87	Confident	75.8	Confident	32 Å²	32	68.4 Å²	68.4	19%	0.194	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	140.8	-178.9	-178.8	0	0	0	0	109.6	Y930 C931 L948 V957 F961 T963 F964	Y930-V959 CarbonylContact C-O 3.52Å; Y930-V959 VanDerWaalsContact CA-O 3.23Å; Y930-V959 WeakPolarHBondContact CA-O 3.41Å; C931-V959 PolarHBondContact N-O 3.33Å; C931-V959 PolarHBondContact O-N 3.49Å; L948-V959 HydrophobicContact CD1-CG2 3.79Å; V957-V959 HydrophobicContact CG1-CG2 4.19Å; V959-F961 PolarHBondContact O-N 3.47Å; V959-T963 HydrophobicContact CG1-CG2 4.17Å; V959-F964 HydrophobicContact CG1-CB 4.27Å
960	N	89.8	Confident	75.7	Confident	38 Å²	38	72.5 Å²	72.5	20%	0.203	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	134.2	173.9	-178	-76.5	0	0	0	109.8	E927 Y930 W962 T963 F964	E927-N960 PolarHBondContact O-ND2 3.15Å; Y930-N960 HydrophobicContact CD1-CB 4.4Å; Y930-N960 HydrophobicContact CE1-CB 4.17Å; N960-W962 VanDerWaalsContact C-N 3.27Å; N960-W962 PolarHBondContact O-N 3.28Å; N960-W962 WeakPolarHBondContact OD1-CB 3.35Å; N960-W962 PolarHBondContact OD1-N 2.61Å; N960-T963 WeakPolarHBondContact O-CB 3.23Å; N960-T963 PolarHBondContact O-N 2.89Å; N960-T963 VanDerWaalsContact O-N 3.11Å; N960-F964 PolarHBondContact O-N 3.14Å
961	F	90.4	Very high	75.3	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-58.6	-36.9	-174.3	-177.6	-94.5	0	0	0	113	L912 Q913 L916 L929 V959 F964 L965	L912-F961 HydrophobicContact CD2-CD2 4.28Å; L912-F961 HydrophobicContact CD2-CE2 3.7Å; L912-F961 HydrophobicContact CD2-CZ 4.19Å; L912-F961 HydrophobicContact CG-CE2 3.85Å; L912-F961 HydrophobicContact CG-CZ 3.84Å; Q913-F961 HydrophobicContact CG-CE2 4.14Å; Q913-F961 HydrophobicContact CG-CZ 4.15Å; L916-F961 HydrophobicContact CB-CE1 4.19Å; L916-F961 HydrophobicContact CD2-CD1 3.63Å; L916-F961 HydrophobicContact CD2-CE1 3.38Å; L916-F961 HydrophobicContact CD2-CZ 4.23Å; L916-F961 HydrophobicContact CG-CE1 4.38Å; L929-F961 HydrophobicContact CB-CB 3.69Å; L929-F961 HydrophobicContact CB-CG 4.24Å; L929-F961 VanDerWaalsContact O-CB 3.29Å; L929-F961 WeakPolarHBondContact O-CB 3.34Å; L929-F961 PolarHBondContact O-N 2.91Å; V959-F961 PolarHBondContact O-N 3.47Å; F961-F964 PolarHBondContact O-N 2.98Å; F961-L965 HydrophobicContact CD1-CD1 3.71Å; F961-L965 HydrophobicContact CD1-CG 4.4Å; F961-L965 HydrophobicContact CE1-CD1 3.23Å; F961-L965 HydrophobicContact CE1-CG 4.02Å; F961-L965 HydrophobicContact CZ-CD1 3.99Å; F961-L965 HydrophobicContact CZ-CG 4.4Å; F961-L965 PolarHBondContact O-N 3.46Å
962	W	87.5	Confident	74.8	Confident	38 Å²	38	74.9 Å²	74.9	14%	0.144	38%	0.377	C	S	.	.	H	α-helix	trans	-72.1	-38.3	177.2	-64.8	105.3	0	0	0	112.2	L916 P917 R920 H926 N960 F964 L965 I966	L916-W962 HydrophobicContact CD2-CH2 3.98Å; L916-W962 HydrophobicContact CD2-CZ2 3.64Å; L916-W962 HydrophobicContact CG-CH2 4.13Å; L916-W962 HydrophobicContact CG-CZ2 4.06Å; P917-W962 HydrophobicContact CG-CZ3 4.42Å; R920-W962 HydrophobicContact CG-CH2 3.87Å; R920-W962 HydrophobicContact CG-CZ2 4.02Å; H926-W962 HydrophobicContact CB-CZ2 4.35Å; H926-W962 AromaticContact ND1-CE2 3.78Å; H926-W962 AromaticContact ND1-CZ2 3.8Å; H926-W962 AromaticContact ND1-NE1 3.38Å; H926-W962 PolarHBondContact ND1-NE1 2.49Å; H926-W962 PolarHBondContact O-NE1 3.13Å; N960-W962 VanDerWaalsContact C-N 3.27Å; N960-W962 PolarHBondContact O-N 3.28Å; N960-W962 WeakPolarHBondContact OD1-CB 3.35Å; N960-W962 PolarHBondContact OD1-N 2.61Å; W962-F964 VanDerWaalsContact C-N 3.32Å; W962-L965 HydrophobicContact CE3-CD1 3.66Å; W962-L965 HydrophobicContact CH2-CD1 4.43Å; W962-L965 HydrophobicContact CZ3-CD1 3.56Å; W962-L965 PolarHBondContact O-N 3.27Å; W962-I966 VanDerWaalsContact O-CG1 3.29Å; W962-I966 WeakPolarHBondContact O-CG1 3.21Å; W962-I966 PolarHBondContact O-N 2.88Å
963	T	84.4	Confident	74.8	Confident	65 Å²	65	66.5 Å²	66.5	40%	0.399	35%	0.345	S	S	.	.	H	α-helix	trans	-59.3	-47	171.8	-53.6	0	0	0	0	110.4	V959 N960 L965 I966 D967	V959-T963 HydrophobicContact CG1-CG2 4.17Å; N960-T963 WeakPolarHBondContact O-CB 3.23Å; N960-T963 PolarHBondContact O-N 2.89Å; N960-T963 VanDerWaalsContact O-N 3.11Å; T963-L965 PolarHBondContact O-N 2.68Å; T963-I966 PolarHBondContact O-N 2.78Å; T963-D967 WeakPolarHBondContact O-CB 3.49Å; T963-D967 PolarHBondContact O-N 3.17Å
964	F	84.8	Confident	74.4	Confident	10 Å²	10	71.8 Å²	71.8	4%	0.044	34%	0.34	C	S	.	.	H	α-helix	trans	-58.1	-45.8	175	174.2	-94	0	0	0	111.9	C904 C931 L945 V959 N960 F961 W962 I966 D967 L968	C904-F964 HydrophobicContact CB-CD1 3.8Å; C904-F964 HydrophobicContact CB-CD2 4.31Å; C904-F964 HydrophobicContact CB-CE1 3.45Å; C904-F964 VanDerWaalsContact CB-CE1 3.45Å; C904-F964 HydrophobicContact CB-CE2 4Å; C904-F964 HydrophobicContact CB-CG 4.21Å; C904-F964 HydrophobicContact CB-CZ 3.55Å; C931-F964 HydrophobicContact CB-CG 4.5Å; L945-F964 HydrophobicContact CD2-CD2 3.82Å; L945-F964 HydrophobicContact CD2-CE2 3.96Å; V959-F964 HydrophobicContact CG1-CB 4.27Å; N960-F964 PolarHBondContact O-N 3.14Å; F961-F964 PolarHBondContact O-N 2.98Å; W962-F964 VanDerWaalsContact C-N 3.32Å; F964-I966 PolarHBondContact O-N 3.47Å; F964-D967 PolarHBondContact O-N 2.93Å; F964-L968 HydrophobicContact CD1-CD1 3.99Å; F964-L968 HydrophobicContact CE1-CD1 3.14Å; F964-L968 HydrophobicContact CE2-CD1 4.14Å; F964-L968 HydrophobicContact CZ-CD1 3.24Å; F964-L968 WeakPolarHBondContact O-CA 3.47Å; F964-L968 WeakPolarHBondContact O-CB 3.34Å; F964-L968 PolarHBondContact O-N 2.98Å
965	L	82.8	Confident	73.6	Confident	37 Å²	37	72.1 Å²	72.1	19%	0.194	35%	0.352	C	S	.	.	H	α-helix	trans	-61.5	-38.8	176.7	-91.7	170.8	0	0	0	113.5	P917 F961 W962 T963 L968	P917-L965 HydrophobicContact CG-CD1 4.22Å; F961-L965 HydrophobicContact CD1-CD1 3.71Å; F961-L965 HydrophobicContact CD1-CG 4.4Å; F961-L965 HydrophobicContact CE1-CD1 3.23Å; F961-L965 HydrophobicContact CE1-CG 4.02Å; F961-L965 HydrophobicContact CZ-CD1 3.99Å; F961-L965 HydrophobicContact CZ-CG 4.4Å; F961-L965 PolarHBondContact O-N 3.46Å; W962-L965 HydrophobicContact CE3-CD1 3.66Å; W962-L965 HydrophobicContact CH2-CD1 4.43Å; W962-L965 HydrophobicContact CZ3-CD1 3.56Å; W962-L965 PolarHBondContact O-N 3.27Å; T963-L965 PolarHBondContact O-N 2.68Å; L965-L968 WeakPolarHBondContact O-CB 3.48Å
966	I	79.8	Confident	71.9	Confident	100 Å²	100	75.5 Å²	75.5	51%	0.513	36%	0.364	S	S	.	.	H	α-helix	trans	-67.8	-43	177.6	-69.6	165.4	0	0	0	110.4	W962 T963 F964	W962-I966 VanDerWaalsContact O-CG1 3.29Å; W962-I966 WeakPolarHBondContact O-CG1 3.21Å; W962-I966 PolarHBondContact O-N 2.88Å; T963-I966 PolarHBondContact O-N 2.78Å; F964-I966 PolarHBondContact O-N 3.47Å
967	D	70.8	Confident	70	Confident	57 Å²	57	82.2 Å²	82.2	31%	0.305	40%	0.396	S	S	.	.	H	α-helix	trans	-76.7	-27.3	-178.4	-71.4	-19.6	0	0	0	112.6	T963 F964 N969 R970 T971	T963-D967 WeakPolarHBondContact O-CB 3.49Å; T963-D967 PolarHBondContact O-N 3.17Å; F964-D967 PolarHBondContact O-N 2.93Å; D967-N969 PolarHBondContact O-N 3.13Å; D967-R970 PolarHBondContact O-N 3.11Å; D967-T971 PolarHBondContact O-N 3.28Å; D967-T971 PolarHBondContact O-OG1 3.39Å
968	L	68.1	Low	67.8	Low	26 Å²	26	89.4 Å²	89.4	14%	0.136	44%	0.44	C	S	.	.	I	π-helix	trans	-42.7	-50.4	-177.6	-162.9	102.2	0	0	0	112.3	F964 L965 C973	F964-L968 HydrophobicContact CD1-CD1 3.99Å; F964-L968 HydrophobicContact CE1-CD1 3.14Å; F964-L968 HydrophobicContact CE2-CD1 4.14Å; F964-L968 HydrophobicContact CZ-CD1 3.24Å; F964-L968 WeakPolarHBondContact O-CA 3.47Å; F964-L968 WeakPolarHBondContact O-CB 3.34Å; F964-L968 PolarHBondContact O-N 2.98Å; L965-L968 WeakPolarHBondContact O-CB 3.48Å; L968-C973 VanDerWaalsContact CG-SG 3.57Å; L968-C973 VanDerWaalsContact O-CB 3.25Å; L968-C973 WeakPolarHBondContact O-CB 3.49Å; L968-C973 PolarHBondContact O-N 3.13Å; L968-C973 VanDerWaalsContact O-N 3.09Å; L968-C973 PolarHBondContact O-SG 3.07Å
969	N	60	Low	65.2	Low	122 Å²	122	88.4 Å²	88.4	65%	0.652	46%	0.458	S	S	*	.	I	π-helix	trans	-88	-18.3	-178.6	-81.4	-16.5	0	0	0	114.4	D967	D967-N969 PolarHBondContact O-N 3.13Å
970	R	62.6	Low	62.4	Low	191 Å²	191	91.7 Å²	91.7	72%	0.721	49%	0.488	S	S	*	.	I	π-helix	trans	-87.2	-35.5	-176.2	-74.7	-175.9	172.1	-174	-1.1	112.9	D967	D967-R970 PolarHBondContact O-N 3.11Å
971	T	59.3	Low	59.4	Low	77 Å²	77	95.3 Å²	95.3	47%	0.472	52%	0.517	S	S	.	.	I	π-helix	trans	-118.9	-58.5	-166.7	46.3	0	0	0	0	113.4	D967	D967-T971 PolarHBondContact O-N 3.28Å; D967-T971 PolarHBondContact O-OG1 3.39Å
972	F	58.4	Low	56.9	Low	81 Å²	81	100.8 Å²	100.8	36%	0.355	55%	0.552	S	S	.	*	I	π-helix	trans	-104.1	-36.4	-161.7	-56.1	-72.8	0	0	0	115.3	V944 L947 L948 R974	V944-F972 HydrophobicContact CG1-CB 3.41Å; V944-F972 VanDerWaalsContact CG1-CB 3.41Å; V944-F972 HydrophobicContact CG1-CD1 4.28Å; V944-F972 HydrophobicContact CG1-CD2 3.95Å; V944-F972 HydrophobicContact CG1-CG 3.63Å; L947-F972 HydrophobicContact CB-CE1 4.4Å; L947-F972 HydrophobicContact CD1-CD1 4.15Å; L948-F972 HydrophobicContact CD2-CE2 4.04Å; L948-F972 HydrophobicContact CD2-CZ 3.74Å; L948-F972 HydrophobicContact CG-CZ 4.41Å; F972-R974 VanDerWaalsContact C-N 3.33Å; F972-R974 PolarHBondContact O-N 3.17Å
973	C	64.1	Low	53.8	Low	37 Å²	37	103.1 Å²	103.1	25%	0.25	58%	0.579	C	S	.	*	S	Bend	trans	-91.8	16.5	-178.1	-48.7	0	0	0	0	113.7	C906 L968	C906-C973 VanDerWaalsContact CA-SG 3.58Å; C906-C973 HydrophobicContact CB-CB 3.98Å; C906-C973 WeakPolarHBondContact CB-SG 3.44Å; C906-C973 VanDerWaalsContact SG-CA 3.56Å; C906-C973 WeakPolarHBondContact SG-CB 3.27Å; C906-C973 CovalentContact SG-SG 2.01Å; C906-C973 PolarHBondContact SG-SG 3.29Å; L968-C973 VanDerWaalsContact CG-SG 3.57Å; L968-C973 VanDerWaalsContact O-CB 3.25Å; L968-C973 WeakPolarHBondContact O-CB 3.49Å; L968-C973 PolarHBondContact O-N 3.13Å; L968-C973 VanDerWaalsContact O-N 3.09Å; L968-C973 PolarHBondContact O-SG 3.07Å
974	R	53.7	Low	50.9	Low	192 Å²	192	105.9 Å²	105.9	73%	0.725	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-76.8	126.2	-179.9	-146.9	179.1	-172.2	-169	1.9	110	F972 K976	F972-R974 VanDerWaalsContact C-N 3.33Å; F972-R974 PolarHBondContact O-N 3.17Å; R974-K976 PolarHBondContact O-N 2.96Å
975	P	47.8	Very low	48	Very low	113 Å²	113	115 Å²	115	73%	0.734	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-64.2	126.1	-179.8	21.9	-29.8	0	0	0	111.1	Q977	P975-Q977 PolarHBondContact O-N 2.56Å
976	K	40	Very low	45.2	Very low	216 Å²	216	118.3 Å²	118.3	94%	0.939	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-58.2	121.7	178.4	-80.5	-178.1	174.9	177.9	0	110.8	R974	R974-K976 PolarHBondContact O-N 2.96Å
977	Q	35.9	Very low	42.9	Very low	194 Å²	194	122.4 Å²	122.4	91%	0.907	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-87.8	146.4	167.1	-80.3	-144.4	-32.6	0	0	112.3	P975	P975-Q977 PolarHBondContact O-N 2.56Å
978	V	32.9	Very low	40.9	Very low	153 Å²	153	124.8 Å²	124.8	93%	0.927	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-78.9	135.6	-174.2	175.1	0	0	0	0	111.7
979	G	30.1	Very low	38.8	Very low	78 Å²	78	131.4 Å²	131.4	80%	0.804	72%	0.718	S	S	*	*			trans	179.4	137	170.2	0	0	0	0	0	112.4
980	A	27.4	Very low	37	Very low	100 Å²	100	133.8 Å²	133.8	83%	0.826	73%	0.725	S	S	*	*			trans	-98	153.8	-149.6	0	0	0	0	0	117.5
981	S	26.9	Very low	35.3	Very low	115 Å²	115	129.9 Å²	129.9	80%	0.804	73%	0.734	S	S	*	*			trans	68	148.1	141.2	-163	0	0	0	0	120.9
982	P	36.7	Very low	33.6	Very low	115 Å²	115	133 Å²	133	75%	0.747	74%	0.743	S	S	*	*			trans	-109.1	169.9	-153.9	41.4	-30.2	0	0	0	114.1
983	A	23.6	Very low	31.9	Very low	86 Å²	86	136 Å²	136	71%	0.711	76%	0.756	S	S	*	*			trans	125.3	141.2	150	0	0	0	0	0	112.9
984	D	23.6	Very low	30.1	Very low	123 Å²	123	144 Å²	144	66%	0.658	79%	0.79	S	S	*	*			trans	72.4	136.5	167.6	-67.8	-23.2	0	0	0	115.8
985	R	22.6	Very low	28.6	Very low	201 Å²	201	143.3 Å²	143.3	76%	0.758	80%	0.795	S	S	*	*			cis	-176.3	158.5	3.1	-115.4	164.8	-156.5	-166.4	5.9	107.6
986	S	24.7	Very low	27.4	Very low	108 Å²	108	141.1 Å²	141.1	76%	0.755	79%	0.793	S	S	*	*			trans	67.3	117.2	143.9	58.7	0	0	0	0	120.9
987	E	32.3	Very low	26.6	Very low	185 Å²	185	139.2 Å²	139.2	86%	0.864	79%	0.787	S	S	*	*			trans	-47.4	158.8	147.6	-58.3	176	142	0	0	112.1
988	P	28.2	Very low	26.1	Very low	107 Å²	107	138.5 Å²	138.5	70%	0.695	79%	0.79	S	S	*	*				-146.9	144.3	93.6	36.8	-19.2	0	0	0	116.4
989	Q	23.7	Very low	25.5	Very low	166 Å²	166	136 Å²	136	78%	0.776	77%	0.771	S	S	*	*				59	123.8	124.5	-60	176.3	-13.1	0	0	122.3
990	Q	22.5	Very low	25.2	Very low	171 Å²	171	140.5 Å²	140.5	80%	0.799	77%	0.769	S	S	*	*				48.4	99.6	129.1	-67.9	177.4	-39	0	0	118.6
991	A	26.8	Very low	25.6	Very low	110 Å²	110	140.7 Å²	140.7	91%	0.909	76%	0.761	S	S	*	*			trans	-135.3	97.7	134.1	0	0	0	0	0	106.9
992	E	23.6	Very low	25.6	Very low	143 Å²	143	141 Å²	141	67%	0.668	76%	0.759	S	S	*	*			trans	-75.6	147.6	172.3	-105.9	-178.8	-162.5	0	0	110.3
993	K	23.3	Very low	24.9	Very low	143 Å²	143	144 Å²	144	62%	0.622	76%	0.763	S	S	*	*			trans	73.6	92.8	148	-68.6	166.8	178.1	144.9	0	117.5
994	E	26.1	Very low	24.7	Very low	205 Å²	205	145.6 Å²	145.6	96%	0.958	77%	0.768	S	S	*	*			trans	-118.5	88.2	140.8	-76	-176.4	161.4	0	0	107.5
995	E	22.4	Very low	24.6	Very low	177 Å²	177	144.8 Å²	144.8	83%	0.827	77%	0.772	S	S	*	*			trans	-80.8	143.1	158.9	-73.6	174	155.9	0	0	108.5
996	G	22.7	Very low	24.7	Very low	67 Å²	67	142.7 Å²	142.7	69%	0.691	77%	0.774	S	S	*	*			trans	145.9	89.4	-177.9	0	0	0	0	0	107.3
997	E	22.3	Very low	24.6	Very low	176 Å²	176	140.5 Å²	140.5	82%	0.822	77%	0.769	S	S	*	*			cis	49.9	65.7	43.3	-100.7	-174.4	-166.5	0	0	111.8
998	D	26.1	Very low	24.4	Very low	179 Å²	179	142.1 Å²	142.1	96%	0.957	77%	0.769	S	S	*	*			trans	-95.7	92.4	149.3	-85.5	-34.3	0	0	0	107.5
999	D	21.1	Very low	24.1	Very low	101 Å²	101	146.2 Å²	146.2	54%	0.54	78%	0.776	S	S	.	*			trans	-105.8	146.3	179.3	-150.3	0.1	0	0	0	108.7
1000	F	21.8	Very low	24	Very low	173 Å²	173	144.2 Å²	144.2	76%	0.759	78%	0.775	S	S	*	*			trans	69.7	166.3	166.4	-64.7	-74.6	0	0	0	120.2
1001	P	37.5	Very low	24	Very low	103 Å²	103	141.2 Å²	141.2	67%	0.669	77%	0.771	S	S	*	*			cis	-132.5	-176.6	-41.6	31.2	-13.3	0	0	0	110.7
1002	V	25.4	Very low	23.8	Very low	123 Å²	123	144.7 Å²	144.7	75%	0.745	77%	0.766	S	S	*	*				164.1	97.5	119.7	168.2	0	0	0	0	108
1003	E	22.2	Very low	23.7	Very low	178 Å²	178	144.3 Å²	144.3	83%	0.832	77%	0.768	S	S	*	*			trans	22	105.9	135.4	-62.6	-176.1	149	0	0	118.7
1004	S	20.8	Very low	23.9	Very low	118 Å²	118	145.8 Å²	145.8	83%	0.825	78%	0.782	S	S	*	*			trans	-73.5	105.6	140.5	57	0	0	0	0	110
1005	S	21.7	Very low	23.8	Very low	107 Å²	107	146.4 Å²	146.4	75%	0.748	78%	0.776	S	S	*	*			trans	-168.7	163	155.2	-107.5	0	0	0	0	112.4
1006	I	24.4	Very low	23.8	Very low	156 Å²	156	148.9 Å²	148.9	80%	0.8	78%	0.778	S	S	*	*			trans	83.9	96.1	-176	-44.3	163.3	0	0	0	110.9	Y1008	I1006-Y1008 HydrophobicContact CG2-CD2 4.47Å
1007	G	22	Very low	24	Very low	63 Å²	63	155.2 Å²	155.2	65%	0.649	79%	0.786	S	S	*	*			cis	86	93.1	34.3	0	0	0	0	0	109.9
1008	Y	27.2	Very low	24	Very low	218 Å²	218	155.9 Å²	155.9	86%	0.855	79%	0.786	S	S	*	*			trans	-145.9	95.6	150.9	-100.5	-84.4	0	0	0	109.4	I1006	I1006-Y1008 HydrophobicContact CG2-CD2 4.47Å
1009	K	23.3	Very low	23.8	Very low	194 Å²	194	156 Å²	156	84%	0.843	78%	0.779	S	S	*	*			trans	-47.1	143	133.5	-84.2	169	169.5	168.3	0	107.3
1010	V	21.6	Very low	24.1	Very low	123 Å²	123	162.4 Å²	162.4	75%	0.745	80%	0.797	S	S	*	*				169.4	122.2	123.5	154.5	0	0	0	0	111.3
1011	C	22.6	Very low	24	Very low	108 Å²	108	162.6 Å²	162.6	73%	0.73	80%	0.797	S	S	*	*			trans	62.1	114.5	144.4	-69.6	0	0	0	0	122.7
1012	K	21	Very low	23.2	Very low	184 Å²	184	164.8 Å²	164.8	80%	0.8	80%	0.798	S	S	*	*				28.6	131.6	101.8	-94.4	-177.2	177.4	174.4	0	117.2
1013	N	22.4	Very low	23	Very low	134 Å²	134	168.8 Å²	168.8	72%	0.717	80%	0.802	S	S	*	*			trans	93.4	106.4	154.6	-60.6	-35.2	0	0	0	115.3
1014	L	28.5	Very low	23.1	Very low	175 Å²	175	166.9 Å²	166.9	92%	0.916	80%	0.802	S	S	*	*				-148.2	92.4	121	-100.5	150.3	0	0	0	109.4
1015	R	22.1	Very low	23	Very low	218 Å²	218	164.2 Å²	164.2	82%	0.823	79%	0.793	S	S	*	*			trans	-62.9	152.4	151.8	-87.5	177	164.6	174.7	-3.7	109.1
1016	R	23.9	Very low	22.9	Very low	229 Å²	229	168.3 Å²	168.3	86%	0.864	80%	0.8	S	S	*	*			trans	81.9	126.3	166.1	-57.3	168.3	167.9	175.4	-4.9	112.4
1017	K	25.7	Very low	22.9	Very low	200 Å²	200	167.7 Å²	167.7	87%	0.87	80%	0.803	S	S	*	*				-156.8	134.8	55.1	-82.6	173.9	172.4	170.8	0	111.7
1018	K	21.7	Very low	22.8	Very low	189 Å²	189	167.4 Å²	167.4	82%	0.822	80%	0.8	S	S	*	*			trans	-49	151.9	145.5	-77.9	176.4	169.7	178.6	0	109.5
1019	F	22.8	Very low	22.6	Very low	183 Å²	183	163.9 Å²	163.9	80%	0.803	80%	0.802	S	S	*	*			trans	124.1	92	157.9	-81.8	-83.4	0	0	0	112.4
1020	Y	27.4	Very low	22.5	Very low	235 Å²	235	157.7 Å²	157.7	92%	0.922	79%	0.793	S	S	*	*				-147.9	85.6	129.1	-100.4	-77.2	0	0	0	108.3
1021	K	19.8	Very low	22.6	Very low	177 Å²	177	158.6 Å²	158.6	77%	0.77	79%	0.794	S	S	*	*			trans	-72.6	125.5	143.3	-104.2	-179.3	171	-177.7	0	105
1022	H	20.5	Very low	22.6	Very low	149 Å²	149	156.1 Å²	156.1	69%	0.69	78%	0.777	S	S	*	*			trans	161.8	133	131.2	-93.5	90.5	0	0	0	112.8
1023	Y	21.5	Very low	22.7	Very low	207 Å²	207	152.1 Å²	152.1	81%	0.812	77%	0.773	S	S	*	*			trans	89.8	135.7	148.2	-81.9	-69.4	0	0	0	122.5
1024	V	23.6	Very low	22.7	Very low	138 Å²	138	149.7 Å²	149.7	84%	0.836	77%	0.765	S	S	*	*			trans	82.5	105.3	171.1	-160	0	0	0	0	113.7
1025	G	18.2	Very low	22.4	Very low	61 Å²	61	146.6 Å²	146.6	63%	0.629	75%	0.749	S	S	*	*			cis	102.4	111.1	27.6	0	0	0	0	0	108.6
1026	E	19.9	Very low	22.6	Very low	194 Å²	194	140.4 Å²	140.4	91%	0.907	73%	0.733	S	S	*	*			trans	69.9	101.1	170.7	-59.4	179.2	167.3	0	0	117.1
1027	V	24.9	Very low	22.5	Very low	142 Å²	142	131.2 Å²	131.2	86%	0.861	71%	0.709	S	S	*	*				-176.3	99.6	105.6	167.8	0	0	0	0	104.4
1028	G	20.4	Very low	22.5	Very low	58 Å²	58	127.2 Å²	127.2	60%	0.598	70%	0.698	S	S	*	*			trans	-84.5	173.1	167.5	0	0	0	0	0	110.7
1029	T	22.6	Very low	22.6	Very low	143 Å²	143	126.6 Å²	126.6	88%	0.877	69%	0.691	S	S	*	*			trans	79.6	121.2	-174.5	76.4	0	0	0	0	112.3
1030	G	21.4	Very low	22.9	Very low	64 Å²	64	121.4 Å²	121.4	66%	0.66	68%	0.678	S	S	*	*			cis	168.3	91.4	4.2	0	0	0	0	0	106.1
1031	D	22.7	Very low	23	Very low	143 Å²	143	113.6 Å²	113.6	77%	0.765	65%	0.651	S	S	*	*			trans	-128.7	105.2	145.9	-103	-21.2	0	0	0	104.2
1032	S	23.1	Very low	23.5	Very low	55 Å²	55	108.8 Å²	108.8	39%	0.385	64%	0.639	S	S	.	*			trans	-72.1	134.1	-179	4.6	0	0	0	0	110.1
1033	S	22.7	Very low	24.2	Very low	101 Å²	101	103.4 Å²	103.4	71%	0.706	62%	0.62	S	S	*	*			trans	60.9	85.1	177.5	64.8	0	0	0	0	115.5	D1035	S1033-D1035 VanDerWaalsContact C-N 3.28Å; S1033-D1035 PolarHBondContact O-N 2.83Å
1034	C	23.2	Very low	24.7	Very low	82 Å²	82	97.5 Å²	97.5	55%	0.554	61%	0.609	S	S	*	*			trans	-47.6	98.4	135.7	-54.7	0	0	0	0	109.4
1035	D	22.6	Very low	25.2	Very low	110 Å²	110	95.7 Å²	95.7	59%	0.588	59%	0.594	S	S	*	*			trans	-154.4	109.1	147.3	-104.4	-26.3	0	0	0	111.6	S1033 G1037 R1135	S1033-D1035 VanDerWaalsContact C-N 3.28Å; S1033-D1035 PolarHBondContact O-N 2.83Å; D1035-G1037 PolarHBondContact O-N 3.07Å; D1035-R1135 IonicContact OD1-NH2 2.6Å; D1035-R1135 PolarHBondContact OD1-NH2 2.94Å
1036	N	26.3	Very low	26.9	Very low	89 Å²	89	93.6 Å²	93.6	48%	0.476	57%	0.568	S	S	.	*			trans	47.5	59.2	134.3	-54.5	-34.9	0	0	0	117.2	R1135	N1036-R1135 VanDerWaalsContact CG-CZ 3.47Å; N1036-R1135 VanDerWaalsContact ND2-CZ 3.28Å; N1036-R1135 PolarHBondContact ND2-NH1 3.41Å; N1036-R1135 PolarHBondContact ND2-NH2 2.99Å; N1036-R1135 WeakPolarHBondContact OD1-CD 3.45Å; N1036-R1135 VanDerWaalsContact OD1-CG 3.27Å; N1036-R1135 WeakPolarHBondContact OD1-CG 3.29Å; N1036-R1135 PolarHBondContact OD1-NE 3.2Å; N1036-R1135 PolarHBondContact OD1-NH1 3.11Å
1037	G	22.2	Very low	28.9	Very low	36 Å²	36	87.4 Å²	87.4	37%	0.371	54%	0.539	S	S	.	.			trans	-147.4	118.4	162.6	0	0	0	0	0	108.5	D1035 Y1039	D1035-G1037 PolarHBondContact O-N 3.07Å; G1037-Y1039 WeakPolarHBondContact O-CD2 3.3Å; G1037-Y1039 PolarHBondContact O-N 3.37Å
1038	N	24.7	Very low	31.2	Very low	116 Å²	116	82.6 Å²	82.6	62%	0.62	51%	0.507	S	S	*	.			trans	-53.3	95.6	177.4	-79.9	-12.1	0	0	0	111.6	Q1136	N1038-Q1136 VanDerWaalsContact OD1-CG 3.3Å; N1038-Q1136 WeakPolarHBondContact OD1-CG 3.33Å; N1038-Q1136 PolarHBondContact OD1-NE2 3.13Å
1039	Y	24	Very low	34.1	Very low	175 Å²	175	80.3 Å²	80.3	69%	0.686	48%	0.481	S	S	*	.			trans	-107.9	91.1	160.3	-67.4	-76.4	0	0	0	107.8	G1037	G1037-Y1039 WeakPolarHBondContact O-CD2 3.3Å; G1037-Y1039 PolarHBondContact O-N 3.37Å
1040	S	29.9	Very low	37.2	Very low	75 Å²	75	73.5 Å²	73.5	52%	0.524	44%	0.44	S	S	.	.			trans	-64.9	138.7	153.2	44.1	0	0	0	0	107.4
1041	L	28.9	Very low	40.3	Very low	70 Å²	70	70.5 Å²	70.5	37%	0.366	41%	0.408	S	S	.	.			trans	-45.8	133.4	157.1	-82	156.4	0	0	0	107.2	A1043 L1045 L1046 E1101	L1041-A1043 PolarHBondContact O-N 3Å; L1041-L1045 HydrophobicContact CB-CB 4.24Å; L1041-L1045 HydrophobicContact CD2-CB 4.03Å; L1041-L1045 HydrophobicContact CD2-CD1 3.77Å; L1041-L1046 HydrophobicContact CB-CD2 4.22Å; L1041-L1046 HydrophobicContact CB-CG 4.02Å; L1041-L1046 HydrophobicContact CD1-CD2 4.3Å; L1041-E1101 VanDerWaalsContact CD1-O 3.26Å; L1041-E1101 WeakPolarHBondContact CD1-O 3.45Å
1042	P	30.1	Very low	43.5	Very low	77 Å²	77	63.7 Å²	63.7	50%	0.5	37%	0.372	S	S	.	.			trans	-50.4	139.1	174.2	16.9	-28.1	0	0	0	108.8	S1044 L1045	P1042-S1044 PolarHBondContact O-N 2.79Å; P1042-L1045 HydrophobicContact CG-CD1 3.85Å; P1042-L1045 HydrophobicContact CG-CG 4.31Å; P1042-L1045 PolarHBondContact O-N 3.04Å
1043	A	35.2	Very low	46.6	Very low	36 Å²	36	61.1 Å²	61.1	30%	0.298	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-18.4	-170.2	0	0	0	0	0	114.5	L1041 L1045 F1184	L1041-A1043 PolarHBondContact O-N 3Å; A1043-L1045 VanDerWaalsContact C-N 3.34Å; A1043-F1184 HydrophobicContact CB-CB 4.45Å; A1043-F1184 HydrophobicContact CB-CG 4.43Å
1044	S	32.5	Very low	49.8	Very low	83 Å²	83	56.4 Å²	56.4	58%	0.58	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-17.2	172.5	51.7	0	0	0	0	115.5	P1042	P1042-S1044 PolarHBondContact O-N 2.79Å
1045	L	34.5	Very low	52.9	Low	99 Å²	99	52.5 Å²	52.5	52%	0.518	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	-13.2	-179.4	-66.3	175.1	0	0	0	113.7	L1041 P1042 A1043	L1041-L1045 HydrophobicContact CB-CB 4.24Å; L1041-L1045 HydrophobicContact CD2-CB 4.03Å; L1041-L1045 HydrophobicContact CD2-CD1 3.77Å; P1042-L1045 HydrophobicContact CG-CD1 3.85Å; P1042-L1045 HydrophobicContact CG-CG 4.31Å; P1042-L1045 PolarHBondContact O-N 3.04Å; A1043-L1045 VanDerWaalsContact C-N 3.34Å
1046	L	53.2	Low	55.7	Low	18 Å²	18	54.4 Å²	54.4	9%	0.094	29%	0.294	C	S	.	.			trans	-76.7	126.6	177.2	-73.1	160	0	0	0	109.9	L1041 Q1104	L1041-L1046 HydrophobicContact CB-CD2 4.22Å; L1041-L1046 HydrophobicContact CB-CG 4.02Å; L1041-L1046 HydrophobicContact CD1-CD2 4.3Å; L1046-Q1104 HydrophobicContact CD1-CG 3.58Å; L1046-Q1104 HydrophobicContact CD2-CG 4.32Å; L1046-Q1104 HydrophobicContact CG-CG 4.38Å
1047	Q	62.1	Low	58.4	Low	64 Å²	64	56.2 Å²	56.2	30%	0.299	30%	0.299	S	S	.	.			trans	-88.8	-31.7	-177.5	-70.9	-175.5	-13.9	0	0	112.1	R1078 R1102	Q1047-R1078 VanDerWaalsContact O-CD 3.25Å; Q1047-R1078 WeakPolarHBondContact O-CD 3.24Å; Q1047-R1102 HydrophobicContact CB-CB 4.3Å; Q1047-R1102 PolarHBondContact N-O 2.93Å
1048	H	73.6	Confident	61.3	Low	41 Å²	41	56.6 Å²	56.6	19%	0.19	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	148.2	-175.8	-46.9	98.6	0	0	0	111.4	C1080 R1102 S1103 Q1104	H1048-C1080 HydrophobicContact CB-CB 4.09Å; H1048-C1080 VanDerWaalsContact CD2-CB 3.45Å; H1048-C1080 WeakPolarHBondContact CD2-CB 3.48Å; H1048-R1102 PolarHBondContact N-O 3.04Å; H1048-S1103 VanDerWaalsContact O-CA 3.3Å; H1048-S1103 WeakPolarHBondContact O-CA 3.49Å; H1048-Q1104 PolarHBondContact O-N 3.21Å; H1048-Q1104 VanDerWaalsContact O-N 3.15Å
1049	D	81.2	Confident	64.2	Low	9 Å²	9	54 Å²	54	5%	0.048	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-35.9	173.1	-58.3	-49.8	0	0	0	110.7	H1077 R1078 Q1104 R1105 P1181 H1186	D1049-H1077 HydrophobicContact CB-CB 4.22Å; D1049-H1077 VanDerWaalsContact OD2-CA 3.31Å; D1049-H1077 WeakPolarHBondContact OD2-CA 3.48Å; D1049-R1078 PolarHBondContact N-O 3.46Å; D1049-R1078 PolarHBondContact OD2-N 3.27Å; D1049-Q1104 WeakPolarHBondContact O-CB 3.4Å; D1049-Q1104 PolarHBondContact OD1-NE2 2.84Å; D1049-R1105 PolarHBondContact O-N 3.4Å; D1049-P1181 HydrophobicContact CB-CG 4.43Å; D1049-H1186 IonicContact OD1-NE2 2.97Å
1050	L	86.4	Confident	67.1	Low	1 Å²	1	51.9 Å²	51.9	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	129.9	-179.8	-70.6	166.9	0	0	0	111.3	R1078 L1079 C1080 R1105 I1107 V1180	L1050-R1078 PolarHBondContact N-O 3.01Å; L1050-R1078 VanDerWaalsContact N-O 3.09Å; L1050-L1079 HydrophobicContact CB-CG 4.26Å; L1050-L1079 HydrophobicContact CD1-CD1 4.42Å; L1050-L1079 CarbonylContact O-C 3.51Å; L1050-L1079 WeakPolarHBondContact O-CA 3.44Å; L1050-C1080 PolarHBondContact O-N 2.89Å; L1050-R1105 CarbonylContact C-O 3.44Å; L1050-R1105 WeakPolarHBondContact CA-O 3.47Å; L1050-R1105 HydrophobicContact CD2-CB 3.97Å; L1050-R1105 HydrophobicContact CD2-CG 4.44Å; L1050-I1107 HydrophobicContact CD2-CD1 3.85Å; L1050-I1107 HydrophobicContact CD2-CG1 4.39Å; L1050-V1180 HydrophobicContact CD1-CG1 3.95Å; L1050-V1180 HydrophobicContact CD1-CG2 4.06Å; L1050-V1180 HydrophobicContact CD2-CG1 4.28Å; L1050-V1180 HydrophobicContact CD2-CG2 4.13Å; L1050-V1180 HydrophobicContact CG-CG1 4.29Å
1051	L	87.8	Confident	69.8	Low	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	120.9	165.7	176.3	66.3	0	0	0	109.6	C1080 L1086 L1096 A1099 M1100 S1103 R1105 V1106 I1107	L1051-C1080 CarbonylContact C-O 3.39Å; L1051-C1080 VanDerWaalsContact CA-O 3.3Å; L1051-C1080 WeakPolarHBondContact CA-O 3.28Å; L1051-C1080 HydrophobicContact CD1-CB 4.1Å; L1051-L1086 HydrophobicContact CD1-CD1 4.37Å; L1051-L1096 HydrophobicContact CD2-CD1 4.44Å; L1051-A1099 HydrophobicContact CD1-CB 4.29Å; L1051-A1099 HydrophobicContact CD2-CB 3.96Å; L1051-M1100 HydrophobicContact CD2-CB 4.31Å; L1051-M1100 HydrophobicContact CD2-CG 3.58Å; L1051-S1103 WeakPolarHBondContact CB-OG 3.05Å; L1051-R1105 PolarHBondContact N-O 3.13Å; L1051-V1106 HydrophobicContact CB-CG2 4.38Å; L1051-V1106 HydrophobicContact CD2-CG1 4.21Å; L1051-V1106 HydrophobicContact CD2-CG2 4.24Å; L1051-V1106 HydrophobicContact CG-CG1 4.47Å; L1051-V1106 CarbonylContact O-C 3.1Å; L1051-V1106 WeakPolarHBondContact O-CA 3.44Å; L1051-I1107 PolarHBondContact O-N 3.3Å
1052	I	89.6	Confident	72.8	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	120.5	177.7	-55.4	-170.7	0	0	0	109.6	V1062 L1066 V1067 L1070 L1079 C1080 M1081 I1107	I1052-V1062 HydrophobicContact CG2-CG1 3.98Å; I1052-L1066 HydrophobicContact CD1-CD2 4.44Å; I1052-L1066 HydrophobicContact CD1-CG 4.5Å; I1052-L1066 HydrophobicContact CG2-CD2 4.28Å; I1052-V1067 HydrophobicContact CD1-CG2 4.08Å; I1052-L1070 HydrophobicContact CD1-CD1 3.61Å; I1052-L1079 HydrophobicContact CD1-CD1 3.65Å; I1052-L1079 HydrophobicContact CD1-CD2 4.06Å; I1052-L1079 HydrophobicContact CD1-CG 4.02Å; I1052-L1079 HydrophobicContact CG1-CD1 4.44Å; I1052-L1079 HydrophobicContact CG1-CD2 4.31Å; I1052-L1079 HydrophobicContact CG1-CG 4.31Å; I1052-C1080 PolarHBondContact N-O 3.39Å; I1052-M1081 WeakPolarHBondContact O-CA 3.46Å; I1052-M1081 WeakPolarHBondContact O-CG 3.13Å; I1052-I1107 CarbonylContact C-O 3.17Å; I1052-I1107 WeakPolarHBondContact CA-O 3.5Å; I1052-I1107 HydrophobicContact CD1-CD1 4.37Å; I1052-I1107 HydrophobicContact CG1-CB 4.22Å; I1052-I1107 HydrophobicContact CG1-CD1 4.3Å
1053	Y	88.4	Confident	75.5	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.008	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	131.3	176.6	-176.5	-138.3	0	0	0	111.2	L1082 Y1083 L1096 I1107 V1108 V1109 F1114 E1118 I1124 F1128	Y1053-L1082 HydrophobicContact CD2-CB 3.98Å; Y1053-L1082 HydrophobicContact CD2-CD2 3.56Å; Y1053-L1082 HydrophobicContact CD2-CG 4.42Å; Y1053-L1082 HydrophobicContact CE2-CB 4.49Å; Y1053-L1082 HydrophobicContact CE2-CD2 3.27Å; Y1053-Y1083 HydrophobicContact CE2-CE2 4.11Å; Y1053-L1096 HydrophobicContact CD1-CD1 4.45Å; Y1053-L1096 HydrophobicContact CD1-CD2 4.36Å; Y1053-L1096 HydrophobicContact CE1-CD2 3.99Å; Y1053-L1096 HydrophobicContact CG-CD1 4.43Å; Y1053-I1107 PolarHBondContact N-O 2.9Å; Y1053-V1108 HydrophobicContact CD1-CG2 4.44Å; Y1053-V1108 CarbonylContact O-C 3.24Å; Y1053-V1108 VanDerWaalsContact O-CA 3.27Å; Y1053-V1108 WeakPolarHBondContact O-CA 3.32Å; Y1053-V1109 PolarHBondContact O-N 2.82Å; Y1053-F1114 AromaticContact CD1-CE2 3.72Å; Y1053-F1114 HydrophobicContact CD1-CE2 3.72Å; Y1053-F1114 HydrophobicContact CD1-CZ 4.03Å; Y1053-F1114 AromaticContact CE1-CE2 3.35Å; Y1053-F1114 HydrophobicContact CE1-CE2 3.35Å; Y1053-F1114 AromaticContact CE1-CZ 3.6Å; Y1053-F1114 HydrophobicContact CE1-CZ 3.6Å; Y1053-F1114 HydrophobicContact CG-CE2 4.46Å; Y1053-F1114 AromaticContact CZ-CE2 3.79Å; Y1053-E1118 PolarHBondContact OH-OE2 3.12Å; Y1053-I1124 HydrophobicContact CE1-CG2 4.26Å; Y1053-I1124 WeakPolarHBondContact OH-CD1 3.48Å; Y1053-F1128 HydrophobicContact CD1-CE2 4.14Å; Y1053-F1128 HydrophobicContact CD1-CZ 4.36Å; Y1053-F1128 HydrophobicContact CE1-CE2 4.07Å
1054	C	88.9	Confident	77.8	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.007	24%	0.236	C	C	.	.			trans	-146	172	178.8	64.7	0	0	0	0	110.2	V1062 M1081 Y1083 V1109	C1054-V1062 HydrophobicContact CB-CB 4.37Å; C1054-V1062 HydrophobicContact CB-CG1 4.34Å; C1054-V1062 HydrophobicContact CB-CG2 3.76Å; C1054-M1081 WeakPolarHBondContact SG-CE 3.38Å; C1054-Y1083 WeakPolarHBondContact O-CE2 3.18Å; C1054-V1109 HydrophobicContact CB-CB 3.82Å; C1054-V1109 HydrophobicContact CB-CG2 4.15Å
1055	S	88.2	Confident	80.4	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	23%	0.23	C	C	.	.			trans	-65.1	149	174.4	73.4	0	0	0	0	111.6	E1057 E1058 R1059	S1055-E1057 PolarHBondContact O-N 3Å; S1055-E1058 PolarHBondContact O-N 3.3Å; S1055-E1058 WeakPolarHBondContact OG-CB 3.44Å; S1055-E1058 WeakPolarHBondContact OG-CG 3.3Å; S1055-E1058 PolarHBondContact OG-N 3.42Å; S1055-E1058 PolarHBondContact OG-OE2 2.92Å; S1055-R1059 PolarHBondContact O-N 3.03Å; S1055-R1059 VanDerWaalsContact O-N 3.16Å
1056	W	81.5	Confident	83	Confident	151 Å²	151	46.5 Å²	46.5	57%	0.572	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-54.5	-39.8	173.1	179	-99.2	0	0	0	112.7	E1058 R1059 Y1083 E1118	W1056-E1058 VanDerWaalsContact C-N 3.3Å; W1056-E1058 PolarHBondContact O-N 3.18Å; W1056-R1059 WeakPolarHBondContact O-CB 3.47Å; W1056-R1059 PolarHBondContact O-N 2.82Å; W1056-Y1083 HydrophobicContact CB-CE2 4.33Å; W1056-Y1083 AromaticContact CE3-CD1 3.63Å; W1056-Y1083 HydrophobicContact CE3-CD1 3.63Å; W1056-Y1083 HydrophobicContact CE3-CD2 4.1Å; W1056-Y1083 AromaticContact CE3-CE1 4Å; W1056-Y1083 HydrophobicContact CE3-CE1 4Å; W1056-Y1083 HydrophobicContact CE3-CE2 4.4Å; W1056-Y1083 AromaticContact CE3-CG 3.7Å; W1056-Y1083 HydrophobicContact CE3-CG 3.7Å; W1056-Y1083 AromaticContact CZ3-CD1 3.84Å; W1056-Y1083 HydrophobicContact CZ3-CD1 3.84Å; W1056-Y1083 AromaticContact CZ3-CG 3.98Å; W1056-Y1083 HydrophobicContact CZ3-CG 3.98Å; W1056-E1118 PolarHBondContact N-OE1 3.38Å
1057	E	82.8	Confident	84.7	Confident	126 Å²	126	45.7 Å²	45.7	59%	0.589	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-63.3	-32.5	-178.3	-70.3	179.8	-176	0	0	113.1	S1055 S1113 N1117	S1055-E1057 PolarHBondContact O-N 3Å; E1057-S1113 VanDerWaalsContact OE2-CB 3.3Å; E1057-S1113 WeakPolarHBondContact OE2-CB 3.31Å; E1057-S1113 PolarHBondContact OE2-OG 3.5Å; E1057-N1117 PolarHBondContact OE1-ND2 3.31Å
1058	E	84.5	Confident	85.7	Confident	44 Å²	44	47.6 Å²	47.6	21%	0.206	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-101.3	-1.2	-176.6	-66	165.3	150.6	0	0	113.4	S1055 W1056 H1060 W1061 V1062 S1111	S1055-E1058 PolarHBondContact O-N 3.3Å; S1055-E1058 WeakPolarHBondContact OG-CB 3.44Å; S1055-E1058 WeakPolarHBondContact OG-CG 3.3Å; S1055-E1058 PolarHBondContact OG-N 3.42Å; S1055-E1058 PolarHBondContact OG-OE2 2.92Å; W1056-E1058 VanDerWaalsContact C-N 3.3Å; W1056-E1058 PolarHBondContact O-N 3.18Å; E1058-H1060 PolarHBondContact O-N 2.86Å; E1058-H1060 VanDerWaalsContact O-N 3.11Å; E1058-W1061 PolarHBondContact O-N 2.8Å; E1058-V1062 HydrophobicContact CB-CG2 4.34Å; E1058-V1062 WeakPolarHBondContact O-CG2 3.47Å; E1058-V1062 PolarHBondContact O-N 3.49Å; E1058-S1111 WeakPolarHBondContact OE1-CB 3.48Å; E1058-S1111 PolarHBondContact OE1-OG 2.92Å; E1058-S1111 VanDerWaalsContact OE1-OG 3.06Å; E1058-S1111 WeakPolarHBondContact OE2-CB 3.36Å; E1058-S1111 PolarHBondContact OE2-OG 3.05Å
1059	R	85.1	Confident	86.2	Confident	61 Å²	61	50.3 Å²	50.3	23%	0.23	22%	0.217	C	C	.	.	H	α-helix	trans	-43.8	-50.3	-178.6	177.1	-166.5	165.7	154	5.8	112	S1055 W1056 W1061 V1062 E1063 M1081 Y1083	S1055-R1059 PolarHBondContact O-N 3.03Å; S1055-R1059 VanDerWaalsContact O-N 3.16Å; W1056-R1059 WeakPolarHBondContact O-CB 3.47Å; W1056-R1059 PolarHBondContact O-N 2.82Å; R1059-W1061 PolarHBondContact O-N 2.78Å; R1059-V1062 PolarHBondContact O-N 2.97Å; R1059-E1063 IonicContact NE-OE2 2.7Å; R1059-E1063 VanDerWaalsContact O-CB 3.24Å; R1059-E1063 WeakPolarHBondContact O-CB 3.43Å; R1059-E1063 PolarHBondContact O-N 3.19Å; R1059-M1081 HydrophobicContact CB-CE 4.31Å; R1059-M1081 HydrophobicContact CG-CE 3.71Å; R1059-Y1083 PolarHBondContact NH1-O 3.22Å; R1059-Y1083 PolarHBondContact NH2-O 3.11Å; R1059-Y1083 VanDerWaalsContact NH2-O 3.12Å
1060	H	83.9	Confident	86.5	Confident	131 Å²	131	50.3 Å²	50.3	61%	0.606	22%	0.216	S	C	*	.	H	α-helix	trans	-66	-38.3	-176.1	-165.9	66.8	0	0	0	112.7	E1058 Q1064	E1058-H1060 PolarHBondContact O-N 2.86Å; E1058-H1060 VanDerWaalsContact O-N 3.11Å; H1060-Q1064 WeakPolarHBondContact O-CB 3.24Å; H1060-Q1064 WeakPolarHBondContact O-CG 3.42Å; H1060-Q1064 PolarHBondContact O-N 2.88Å; H1060-Q1064 VanDerWaalsContact O-N 3.08Å
1061	W	88.4	Confident	86.4	Confident	91 Å²	91	53.2 Å²	53.2	35%	0.345	23%	0.23	S	C	.	.	H	α-helix	trans	-68.1	-45.2	176.3	176.5	88.1	0	0	0	111.3	E1058 R1059 E1063 Q1064 Q1065 W1167	E1058-W1061 PolarHBondContact O-N 2.8Å; R1059-W1061 PolarHBondContact O-N 2.78Å; W1061-E1063 VanDerWaalsContact C-N 3.34Å; W1061-E1063 PolarHBondContact O-N 2.86Å; W1061-Q1064 PolarHBondContact O-N 2.99Å; W1061-Q1065 HydrophobicContact CD2-CG 4.44Å; W1061-Q1065 HydrophobicContact CG-CG 4.34Å; W1061-Q1065 VanDerWaalsContact O-CB 3.31Å; W1061-Q1065 WeakPolarHBondContact O-CB 3.37Å; W1061-Q1065 WeakPolarHBondContact O-CG 3.48Å; W1061-Q1065 PolarHBondContact O-N 2.9Å; W1061-W1167 AromaticContact CH2-CD2 3.61Å; W1061-W1167 HydrophobicContact CH2-CD2 3.61Å; W1061-W1167 AromaticContact CH2-CE2 3.63Å; W1061-W1167 AromaticContact CH2-CE3 3.8Å; W1061-W1167 HydrophobicContact CH2-CE3 3.8Å; W1061-W1167 HydrophobicContact CH2-CG 4.16Å; W1061-W1167 HydrophobicContact CH2-CH2 4.03Å; W1061-W1167 AromaticContact CH2-CZ2 3.86Å; W1061-W1167 HydrophobicContact CH2-CZ2 3.86Å; W1061-W1167 AromaticContact CH2-CZ3 3.99Å; W1061-W1167 HydrophobicContact CH2-CZ3 3.99Å; W1061-W1167 AromaticContact CZ2-CD2 3.95Å; W1061-W1167 HydrophobicContact CZ2-CD2 3.95Å; W1061-W1167 AromaticContact CZ2-CE2 3.48Å; W1061-W1167 VanDerWaalsContact CZ2-CE2 3.48Å; W1061-W1167 HydrophobicContact CZ2-CE3 4.49Å; W1061-W1167 HydrophobicContact CZ2-CG 4.41Å; W1061-W1167 HydrophobicContact CZ2-CH2 4.22Å; W1061-W1167 AromaticContact CZ2-CZ2 3.65Å; W1061-W1167 HydrophobicContact CZ2-CZ2 3.65Å; W1061-W1167 AromaticContact CZ2-NE1 3.69Å
1062	V	90.8	Very high	85.7	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.6	-43.3	176.6	176.3	0	0	0	0	110.8	I1052 C1054 E1058 R1059 Q1064 L1066 V1067 M1081 V1109	I1052-V1062 HydrophobicContact CG2-CG1 3.98Å; C1054-V1062 HydrophobicContact CB-CB 4.37Å; C1054-V1062 HydrophobicContact CB-CG1 4.34Å; C1054-V1062 HydrophobicContact CB-CG2 3.76Å; E1058-V1062 HydrophobicContact CB-CG2 4.34Å; E1058-V1062 WeakPolarHBondContact O-CG2 3.47Å; E1058-V1062 PolarHBondContact O-N 3.49Å; R1059-V1062 PolarHBondContact O-N 2.97Å; V1062-Q1064 PolarHBondContact O-N 2.62Å; V1062-L1066 HydrophobicContact CG1-CB 4.16Å; V1062-L1066 HydrophobicContact CG1-CD2 4.05Å; V1062-L1066 WeakPolarHBondContact O-CA 2.99Å; V1062-L1066 VanDerWaalsContact O-CB 3.3Å; V1062-L1066 WeakPolarHBondContact O-CB 3.11Å; V1062-L1066 PolarHBondContact O-N 2.82Å; V1062-V1067 HydrophobicContact CG1-CG2 4.24Å; V1062-V1067 PolarHBondContact O-N 2.86Å; V1062-M1081 HydrophobicContact CB-CE 4.26Å; V1062-M1081 HydrophobicContact CG1-CE 4.12Å; V1062-V1109 HydrophobicContact CG1-CG2 4.14Å; V1062-V1109 HydrophobicContact CG2-CB 4.31Å; V1062-V1109 HydrophobicContact CG2-CG1 4.24Å; V1062-V1109 HydrophobicContact CG2-CG2 3.96Å
1063	E	87	Confident	85.1	Confident	52 Å²	52	61.7 Å²	61.7	24%	0.243	27%	0.273	C	S	.	.	I	π-helix	trans	-62	-44.3	178.7	-170.1	169.3	-171.4	0	0	111.9	R1059 W1061 K1068 R1084	R1059-E1063 IonicContact NE-OE2 2.7Å; R1059-E1063 VanDerWaalsContact O-CB 3.24Å; R1059-E1063 WeakPolarHBondContact O-CB 3.43Å; R1059-E1063 PolarHBondContact O-N 3.19Å; W1061-E1063 VanDerWaalsContact C-N 3.34Å; W1061-E1063 PolarHBondContact O-N 2.86Å; E1063-K1068 PolarHBondContact O-N 3.03Å; E1063-R1084 WeakPolarHBondContact OE1-CD 3.48Å
1064	Q	84.3	Confident	84.5	Confident	89 Å²	89	62.9 Å²	62.9	42%	0.416	28%	0.279	S	S	.	.	I	π-helix	trans	-76.4	-38.8	-179.1	-71.9	-67	-24.5	0	0	114.3	H1060 W1061 V1062 K1068	H1060-Q1064 WeakPolarHBondContact O-CB 3.24Å; H1060-Q1064 WeakPolarHBondContact O-CG 3.42Å; H1060-Q1064 PolarHBondContact O-N 2.88Å; H1060-Q1064 VanDerWaalsContact O-N 3.08Å; W1061-Q1064 PolarHBondContact O-N 2.99Å; V1062-Q1064 PolarHBondContact O-N 2.62Å; Q1064-K1068 WeakPolarHBondContact O-CB 3.38Å
1065	Q	85.8	Confident	83.2	Confident	96 Å²	96	67 Å²	67	45%	0.449	31%	0.307	S	S	.	.	I	π-helix	trans	-97.3	-38.8	-170.8	-60.7	-60.4	-40.2	0	0	112.9	W1061 W1167 W1173	W1061-Q1065 HydrophobicContact CD2-CG 4.44Å; W1061-Q1065 HydrophobicContact CG-CG 4.34Å; W1061-Q1065 VanDerWaalsContact O-CB 3.31Å; W1061-Q1065 WeakPolarHBondContact O-CB 3.37Å; W1061-Q1065 WeakPolarHBondContact O-CG 3.48Å; W1061-Q1065 PolarHBondContact O-N 2.9Å; Q1065-W1167 HydrophobicContact CB-CH2 3.98Å; Q1065-W1167 HydrophobicContact CB-CZ2 4.01Å; Q1065-W1173 VanDerWaalsContact O-CH2 3.27Å; Q1065-W1173 WeakPolarHBondContact O-CH2 3.47Å
1066	L	90	Very high	82.2	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	34%	0.339	C	S	.	.	I	π-helix	trans	-97.1	-57.6	-176.9	-178.6	62.1	0	0	0	112	I1052 V1062 R1069 L1070 V1109 I1142 W1167 W1173 L1176	I1052-L1066 HydrophobicContact CD1-CD2 4.44Å; I1052-L1066 HydrophobicContact CD1-CG 4.5Å; I1052-L1066 HydrophobicContact CG2-CD2 4.28Å; V1062-L1066 HydrophobicContact CG1-CB 4.16Å; V1062-L1066 HydrophobicContact CG1-CD2 4.05Å; V1062-L1066 WeakPolarHBondContact O-CA 2.99Å; V1062-L1066 VanDerWaalsContact O-CB 3.3Å; V1062-L1066 WeakPolarHBondContact O-CB 3.11Å; V1062-L1066 PolarHBondContact O-N 2.82Å; L1066-R1069 PolarHBondContact O-N 3.31Å; L1066-L1070 HydrophobicContact CD1-CD1 3.89Å; L1066-L1070 HydrophobicContact CD1-CG 4.37Å; L1066-L1070 HydrophobicContact CG-CD1 4.02Å; L1066-L1070 WeakPolarHBondContact O-CG 3.41Å; L1066-L1070 PolarHBondContact O-N 2.91Å; L1066-L1070 VanDerWaalsContact O-N 3.08Å; L1066-V1109 HydrophobicContact CD2-CG2 4Å; L1066-I1142 HydrophobicContact CD1-CD1 4.14Å; L1066-I1142 HydrophobicContact CD2-CD1 3.58Å; L1066-W1167 HydrophobicContact CB-CH2 4.45Å; L1066-W1167 HydrophobicContact CB-CZ3 4.34Å; L1066-W1167 HydrophobicContact CD1-CZ3 4.19Å; L1066-W1173 HydrophobicContact CD1-CH2 3.97Å; L1066-W1173 HydrophobicContact CD1-CZ3 3.92Å; L1066-L1176 HydrophobicContact CD1-CD2 3.43Å; L1066-L1176 VanDerWaalsContact CD1-CD2 3.43Å
1067	V	88.5	Confident	81.9	Confident	0 Å²	0	70 Å²	70	0%	0	32%	0.32	C	S	.	.	I	π-helix	trans	-66.3	-51.2	-172.1	-179.5	0	0	0	0	111.1	I1052 V1062 R1069 L1070 E1071 L1079 M1081 R1084	I1052-V1067 HydrophobicContact CD1-CG2 4.08Å; V1062-V1067 HydrophobicContact CG1-CG2 4.24Å; V1062-V1067 PolarHBondContact O-N 2.86Å; V1067-R1069 VanDerWaalsContact C-N 3.27Å; V1067-R1069 PolarHBondContact O-N 2.85Å; V1067-L1070 PolarHBondContact O-N 2.86Å; V1067-E1071 HydrophobicContact CG1-CG 4.16Å; V1067-E1071 WeakPolarHBondContact O-CG 3.07Å; V1067-E1071 PolarHBondContact O-N 2.81Å; V1067-L1079 HydrophobicContact CG1-CD1 4.21Å; V1067-L1079 HydrophobicContact CG1-CD2 3.61Å; V1067-L1079 HydrophobicContact CG2-CD2 4.48Å; V1067-M1081 HydrophobicContact CG2-SD 4.31Å; V1067-R1084 VanDerWaalsContact CG1-NH1 3.28Å
1068	K	82.6	Confident	81.6	Confident	104 Å²	104	69.5 Å²	69.5	45%	0.452	31%	0.313	S	S	.	.	H	α-helix	trans	-53.1	-44.7	179.2	-173.9	-179.7	-179.6	-178.6	0	112.6	E1063 Q1064 E1071 D1072	E1063-K1068 PolarHBondContact O-N 3.03Å; Q1064-K1068 WeakPolarHBondContact O-CB 3.38Å; K1068-E1071 PolarHBondContact O-N 3.39Å; K1068-D1072 WeakPolarHBondContact O-CB 3.29Å; K1068-D1072 PolarHBondContact O-N 2.8Å
1069	R	85.3	Confident	81.6	Confident	99 Å²	99	68.5 Å²	68.5	37%	0.374	31%	0.309	S	S	.	.	H	α-helix	trans	-70	-36.4	179.5	-173.9	167.8	178.3	174.6	-0.2	112.8	L1066 V1067 E1073 W1173	L1066-R1069 PolarHBondContact O-N 3.31Å; V1067-R1069 VanDerWaalsContact C-N 3.27Å; V1067-R1069 PolarHBondContact O-N 2.85Å; R1069-E1073 HydrophobicContact CG-CG 4.3Å; R1069-E1073 IonicContact CZ-OE1 3.14Å; R1069-E1073 IonicContact NE-OE1 2.73Å; R1069-E1073 PolarHBondContact NE-OE1 3.07Å; R1069-E1073 IonicContact NH2-OE1 3.03Å; R1069-E1073 PolarHBondContact NH2-OE1 3.34Å; R1069-E1073 VanDerWaalsContact NH2-OE1 3.11Å; R1069-E1073 WeakPolarHBondContact O-CB 3.03Å; R1069-E1073 WeakPolarHBondContact O-CG 3.25Å; R1069-E1073 PolarHBondContact O-N 3.45Å; R1069-W1173 HydrophobicContact CB-CH2 4.01Å; R1069-W1173 HydrophobicContact CB-CZ3 4.12Å; R1069-W1173 HydrophobicContact CG-CE3 4.38Å; R1069-W1173 HydrophobicContact CG-CH2 4.16Å; R1069-W1173 HydrophobicContact CG-CZ3 4.02Å; R1069-W1173 VanDerWaalsContact NH1-CE2 3.34Å
1070	L	87.1	Confident	81.4	Confident	8 Å²	8	65.6 Å²	65.6	4%	0.042	30%	0.298	C	S	.	.	H	α-helix	trans	-65.6	-41.6	172.9	-73	170.2	0	0	0	111.3	I1052 L1066 V1067 E1073 L1074 L1079 I1107 L1176	I1052-L1070 HydrophobicContact CD1-CD1 3.61Å; L1066-L1070 HydrophobicContact CD1-CD1 3.89Å; L1066-L1070 HydrophobicContact CD1-CG 4.37Å; L1066-L1070 HydrophobicContact CG-CD1 4.02Å; L1066-L1070 WeakPolarHBondContact O-CG 3.41Å; L1066-L1070 PolarHBondContact O-N 2.91Å; L1066-L1070 VanDerWaalsContact O-N 3.08Å; V1067-L1070 PolarHBondContact O-N 2.86Å; L1070-E1073 PolarHBondContact O-N 2.87Å; L1070-L1074 HydrophobicContact CD2-CD1 3.85Å; L1070-L1074 WeakPolarHBondContact O-CA 3.35Å; L1070-L1074 WeakPolarHBondContact O-CB 3.34Å; L1070-L1074 PolarHBondContact O-N 3.09Å; L1070-L1079 HydrophobicContact CB-CD1 3.88Å; L1070-L1079 HydrophobicContact CD1-CD1 4.1Å; L1070-I1107 HydrophobicContact CD1-CD1 4.48Å; L1070-L1176 HydrophobicContact CD1-CD2 4.43Å; L1070-L1176 HydrophobicContact CD2-CD2 4.08Å
1071	E	83.1	Confident	81.4	Confident	62 Å²	62	59.4 Å²	59.4	29%	0.29	27%	0.27	S	S	.	.	H	α-helix	trans	-65.4	-38.3	176.6	-70.6	174.6	163.2	0	0	112.1	V1067 K1068 L1079 R1084	V1067-E1071 HydrophobicContact CG1-CG 4.16Å; V1067-E1071 WeakPolarHBondContact O-CG 3.07Å; V1067-E1071 PolarHBondContact O-N 2.81Å; K1068-E1071 PolarHBondContact O-N 3.39Å; E1071-L1079 HydrophobicContact CG-CD1 4.45Å; E1071-R1084 IonicContact OE1-CZ 2.8Å; E1071-R1084 VanDerWaalsContact OE1-CZ 3.23Å; E1071-R1084 IonicContact OE1-NH1 3.9Å; E1071-R1084 PolarHBondContact OE1-NH1 3.02Å; E1071-R1084 IonicContact OE1-NH2 3.58Å; E1071-R1084 PolarHBondContact OE1-NH2 2.85Å; E1071-R1084 IonicContact OE2-NH1 3.58Å
1072	D	74.9	Confident	80.6	Confident	111 Å²	111	55.1 Å²	55.1	59%	0.594	25%	0.254	S	S	*	.	H	α-helix	trans	-69.3	-43.2	175.8	-70.8	-21.7	0	0	0	112.5	K1068	K1068-D1072 WeakPolarHBondContact O-CB 3.29Å; K1068-D1072 PolarHBondContact O-N 2.8Å
1073	E	75.4	Confident	79.7	Confident	67 Å²	67	56.6 Å²	56.6	31%	0.313	26%	0.259	S	S	.	.	H	α-helix	trans	-84.7	-22.4	-176.5	-69.2	-173.6	-171.5	0	0	113.6	R1069 L1070 P1075 R1177	R1069-E1073 HydrophobicContact CG-CG 4.3Å; R1069-E1073 IonicContact CZ-OE1 3.14Å; R1069-E1073 IonicContact NE-OE1 2.73Å; R1069-E1073 PolarHBondContact NE-OE1 3.07Å; R1069-E1073 IonicContact NH2-OE1 3.03Å; R1069-E1073 PolarHBondContact NH2-OE1 3.34Å; R1069-E1073 VanDerWaalsContact NH2-OE1 3.11Å; R1069-E1073 WeakPolarHBondContact O-CB 3.03Å; R1069-E1073 WeakPolarHBondContact O-CG 3.25Å; R1069-E1073 PolarHBondContact O-N 3.45Å; L1070-E1073 PolarHBondContact O-N 2.87Å; E1073-P1075 VanDerWaalsContact C-CD 3.46Å; E1073-R1177 IonicContact OE2-CZ 2.74Å; E1073-R1177 IonicContact OE2-NE 3.19Å; E1073-R1177 IonicContact OE2-NH2 2.75Å; E1073-R1177 PolarHBondContact OE2-NH2 3.27Å
1074	L	77.3	Confident	79.1	Confident	27 Å²	27	57.3 Å²	57.3	14%	0.141	26%	0.26	C	S	.	.			trans	-128.4	61.4	-177.1	-56.4	166.3	0	0	0	111.6	L1070 Y1076 H1077 V1180	L1070-L1074 HydrophobicContact CD2-CD1 3.85Å; L1070-L1074 WeakPolarHBondContact O-CA 3.35Å; L1070-L1074 WeakPolarHBondContact O-CB 3.34Å; L1070-L1074 PolarHBondContact O-N 3.09Å; L1074-Y1076 PolarHBondContact O-N 3.32Å; L1074-H1077 HydrophobicContact CB-CB 4.28Å; L1074-H1077 PolarHBondContact O-N 2.89Å; L1074-V1180 HydrophobicContact CD1-CB 4.46Å; L1074-V1180 HydrophobicContact CD1-CG1 4.01Å; L1074-V1180 HydrophobicContact CD1-CG2 3.99Å
1075	P	60.8	Low	78.3	Confident	89 Å²	89	56.6 Å²	56.6	58%	0.578	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-10.9	-172.2	27.1	-36.3	0	0	0	114.6	E1073	E1073-P1075 VanDerWaalsContact C-CD 3.46Å
1076	Y	66.7	Low	77.3	Confident	174 Å²	174	54 Å²	54	68%	0.682	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-6.2	-178.6	-55.5	-68.2	0	0	0	114	L1074	L1074-Y1076 PolarHBondContact O-N 3.32Å
1077	H	76.3	Confident	75.4	Confident	38 Å²	38	61.9 Å²	61.9	18%	0.176	28%	0.278	C	S	.	.	S	Bend	trans	-94.8	135	-179.6	-71	77.6	0	0	0	111.1	D1049 L1074 L1079 P1181	D1049-H1077 HydrophobicContact CB-CB 4.22Å; D1049-H1077 VanDerWaalsContact OD2-CA 3.31Å; D1049-H1077 WeakPolarHBondContact OD2-CA 3.48Å; L1074-H1077 HydrophobicContact CB-CB 4.28Å; L1074-H1077 PolarHBondContact O-N 2.89Å; H1077-L1079 PolarHBondContact O-N 3.43Å; H1077-P1181 PolarHBondContact NE2-O 3.18Å
1078	R	76.2	Confident	73.6	Confident	116 Å²	116	63.7 Å²	63.7	44%	0.438	29%	0.288	S	S	.	.			trans	-81.2	105.1	176	-64.7	179.8	-174.6	171.9	3.9	110.2	Q1047 D1049 L1050	Q1047-R1078 VanDerWaalsContact O-CD 3.25Å; Q1047-R1078 WeakPolarHBondContact O-CD 3.24Å; D1049-R1078 PolarHBondContact N-O 3.46Å; D1049-R1078 PolarHBondContact OD2-N 3.27Å; L1050-R1078 PolarHBondContact N-O 3.01Å; L1050-R1078 VanDerWaalsContact N-O 3.09Å
1079	L	84.2	Confident	71.7	Confident	23 Å²	23	67.3 Å²	67.3	12%	0.12	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	134.1	178.4	-169.3	155.1	0	0	0	111	L1050 I1052 V1067 L1070 E1071 H1077	L1050-L1079 HydrophobicContact CB-CG 4.26Å; L1050-L1079 HydrophobicContact CD1-CD1 4.42Å; L1050-L1079 CarbonylContact O-C 3.51Å; L1050-L1079 WeakPolarHBondContact O-CA 3.44Å; I1052-L1079 HydrophobicContact CD1-CD1 3.65Å; I1052-L1079 HydrophobicContact CD1-CD2 4.06Å; I1052-L1079 HydrophobicContact CD1-CG 4.02Å; I1052-L1079 HydrophobicContact CG1-CD1 4.44Å; I1052-L1079 HydrophobicContact CG1-CD2 4.31Å; I1052-L1079 HydrophobicContact CG1-CG 4.31Å; V1067-L1079 HydrophobicContact CG1-CD1 4.21Å; V1067-L1079 HydrophobicContact CG1-CD2 3.61Å; V1067-L1079 HydrophobicContact CG2-CD2 4.48Å; L1070-L1079 HydrophobicContact CB-CD1 3.88Å; L1070-L1079 HydrophobicContact CD1-CD1 4.1Å; E1071-L1079 HydrophobicContact CG-CD1 4.45Å; H1077-L1079 PolarHBondContact O-N 3.43Å
1080	C	82.1	Confident	70	Confident	1 Å²	1	71.7 Å²	71.7	1%	0.007	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	138.5	176.1	-175.8	0	0	0	0	110.3	H1048 L1050 L1051 I1052 D1085	H1048-C1080 HydrophobicContact CB-CB 4.09Å; H1048-C1080 VanDerWaalsContact CD2-CB 3.45Å; H1048-C1080 WeakPolarHBondContact CD2-CB 3.48Å; L1050-C1080 PolarHBondContact O-N 2.89Å; L1051-C1080 CarbonylContact C-O 3.39Å; L1051-C1080 VanDerWaalsContact CA-O 3.3Å; L1051-C1080 WeakPolarHBondContact CA-O 3.28Å; L1051-C1080 HydrophobicContact CD1-CB 4.1Å; I1052-C1080 PolarHBondContact N-O 3.39Å; C1080-D1085 WeakPolarHBondContact CA-OD2 3.03Å
1081	M	83.1	Confident	68.6	Low	1 Å²	1	78.4 Å²	78.4	1%	0.005	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	129.6	173.6	-176.3	-169.4	-166.5	0	0	110	I1052 C1054 R1059 V1062 V1067 Y1083 R1084 D1085	I1052-M1081 WeakPolarHBondContact O-CA 3.46Å; I1052-M1081 WeakPolarHBondContact O-CG 3.13Å; C1054-M1081 WeakPolarHBondContact SG-CE 3.38Å; R1059-M1081 HydrophobicContact CB-CE 4.31Å; R1059-M1081 HydrophobicContact CG-CE 3.71Å; V1062-M1081 HydrophobicContact CB-CE 4.26Å; V1062-M1081 HydrophobicContact CG1-CE 4.12Å; V1067-M1081 HydrophobicContact CG2-SD 4.31Å; M1081-Y1083 PolarHBondContact O-N 3.03Å; M1081-R1084 HydrophobicContact CB-CB 3.9Å; M1081-R1084 HydrophobicContact CG-CB 4.27Å; M1081-R1084 PolarHBondContact O-N 2.78Å; M1081-R1084 HydrophobicContact SD-CB 4.06Å; M1081-D1085 PolarHBondContact N-OD2 3.48Å; M1081-D1085 PolarHBondContact O-N 2.91Å
1082	L	71.9	Confident	67.8	Low	1 Å²	1	77 Å²	77	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-51.6	-48.3	-171.3	-176.7	75.6	0	0	0	113.9	Y1053 L1086 T1088 V1092 L1096	Y1053-L1082 HydrophobicContact CD2-CB 3.98Å; Y1053-L1082 HydrophobicContact CD2-CD2 3.56Å; Y1053-L1082 HydrophobicContact CD2-CG 4.42Å; Y1053-L1082 HydrophobicContact CE2-CB 4.49Å; Y1053-L1082 HydrophobicContact CE2-CD2 3.27Å; L1082-L1086 HydrophobicContact CD1-CB 4.13Å; L1082-L1086 HydrophobicContact CD1-CD1 3.54Å; L1082-L1086 HydrophobicContact CD1-CG 4.43Å; L1082-L1086 WeakPolarHBondContact O-CB 3.35Å; L1082-L1086 PolarHBondContact O-N 3.18Å; L1082-T1088 HydrophobicContact CG-CG2 4.21Å; L1082-V1092 HydrophobicContact CD2-CG1 4.15Å; L1082-L1096 HydrophobicContact CD1-CB 4.34Å; L1082-L1096 HydrophobicContact CD1-CD1 4.16Å; L1082-L1096 HydrophobicContact CD2-CD1 4.39Å
1083	Y	71.2	Confident	67.4	Low	30 Å²	30	72.5 Å²	72.5	12%	0.118	33%	0.33	C	S	.	.	H	α-helix	trans	-83.4	-12.9	-177.4	-64.8	-60.5	0	0	0	114.1	Y1053 C1054 W1056 R1059 M1081 T1088 E1118	Y1053-Y1083 HydrophobicContact CE2-CE2 4.11Å; C1054-Y1083 WeakPolarHBondContact O-CE2 3.18Å; W1056-Y1083 HydrophobicContact CB-CE2 4.33Å; W1056-Y1083 AromaticContact CE3-CD1 3.63Å; W1056-Y1083 HydrophobicContact CE3-CD1 3.63Å; W1056-Y1083 HydrophobicContact CE3-CD2 4.1Å; W1056-Y1083 AromaticContact CE3-CE1 4Å; W1056-Y1083 HydrophobicContact CE3-CE1 4Å; W1056-Y1083 HydrophobicContact CE3-CE2 4.4Å; W1056-Y1083 AromaticContact CE3-CG 3.7Å; W1056-Y1083 HydrophobicContact CE3-CG 3.7Å; W1056-Y1083 AromaticContact CZ3-CD1 3.84Å; W1056-Y1083 HydrophobicContact CZ3-CD1 3.84Å; W1056-Y1083 AromaticContact CZ3-CG 3.98Å; W1056-Y1083 HydrophobicContact CZ3-CG 3.98Å; R1059-Y1083 PolarHBondContact NH1-O 3.22Å; R1059-Y1083 PolarHBondContact NH2-O 3.11Å; R1059-Y1083 VanDerWaalsContact NH2-O 3.12Å; M1081-Y1083 PolarHBondContact O-N 3.03Å; Y1083-T1088 HydrophobicContact CD1-CG2 3.83Å; Y1083-T1088 HydrophobicContact CE1-CG2 4.12Å; Y1083-E1118 VanDerWaalsContact OH-CD 3.27Å; Y1083-E1118 PolarHBondContact OH-OE1 3.13Å; Y1083-E1118 PolarHBondContact OH-OE2 2.98Å
1084	R	73.6	Confident	67	Low	67 Å²	67	73.6 Å²	73.6	25%	0.253	34%	0.338	S	S	.	.	H	α-helix	trans	-95	-44.3	179.5	-166.9	-177.7	69.5	169.3	-0.1	111.8	E1063 V1067 E1071 M1081	E1063-R1084 WeakPolarHBondContact OE1-CD 3.48Å; V1067-R1084 VanDerWaalsContact CG1-NH1 3.28Å; E1071-R1084 IonicContact OE1-CZ 2.8Å; E1071-R1084 VanDerWaalsContact OE1-CZ 3.23Å; E1071-R1084 IonicContact OE1-NH1 3.9Å; E1071-R1084 PolarHBondContact OE1-NH1 3.02Å; E1071-R1084 IonicContact OE1-NH2 3.58Å; E1071-R1084 PolarHBondContact OE1-NH2 2.85Å; E1071-R1084 IonicContact OE2-NH1 3.58Å; M1081-R1084 HydrophobicContact CB-CB 3.9Å; M1081-R1084 HydrophobicContact CG-CB 4.27Å; M1081-R1084 PolarHBondContact O-N 2.78Å; M1081-R1084 HydrophobicContact SD-CB 4.06Å
1085	D	68.7	Low	66.6	Low	74 Å²	74	75.7 Å²	75.7	40%	0.396	35%	0.347	S	S	.	.	H	α-helix	trans	-116	-18.4	-163	-54.4	-38.5	0	0	0	113	C1080 M1081	C1080-D1085 WeakPolarHBondContact CA-OD2 3.03Å; M1081-D1085 PolarHBondContact N-OD2 3.48Å; M1081-D1085 PolarHBondContact O-N 2.91Å
1086	L	64	Low	67.4	Low	41 Å²	41	71.4 Å²	71.4	22%	0.215	32%	0.319	C	S	.	.	S	Bend	trans	-106	150.5	178.7	-60	170.6	0	0	0	112.5	L1051 L1082 T1088 A1099	L1051-L1086 HydrophobicContact CD1-CD1 4.37Å; L1082-L1086 HydrophobicContact CD1-CB 4.13Å; L1082-L1086 HydrophobicContact CD1-CD1 3.54Å; L1082-L1086 HydrophobicContact CD1-CG 4.43Å; L1082-L1086 WeakPolarHBondContact O-CB 3.35Å; L1082-L1086 PolarHBondContact O-N 3.18Å; L1086-T1088 PolarHBondContact O-N 2.78Å; L1086-T1088 VanDerWaalsContact O-N 3.09Å; L1086-A1099 HydrophobicContact CD1-CB 3.39Å; L1086-A1099 HydrophobicContact CD2-CB 4.44Å
1087	R	51.7	Low	67.8	Low	167 Å²	167	64.5 Å²	64.5	63%	0.63	29%	0.294	S	S	*	.			trans	-85	81.3	-171	-67.1	-170.7	-168.4	-163.8	2.6	111.8	H1089 E1095	R1087-H1089 PolarHBondContact O-N 2.78Å; R1087-E1095 VanDerWaalsContact O-OE2 3.06Å
1088	T	50.2	Low	67.6	Low	37 Å²	37	64.1 Å²	64.1	23%	0.227	30%	0.297	C	S	.	.			trans	-75.1	70.2	-174	45	0	0	0	0	116.1	L1082 Y1083 L1086	L1082-T1088 HydrophobicContact CG-CG2 4.21Å; Y1083-T1088 HydrophobicContact CD1-CG2 3.83Å; Y1083-T1088 HydrophobicContact CE1-CG2 4.12Å; L1086-T1088 PolarHBondContact O-N 2.78Å; L1086-T1088 VanDerWaalsContact O-N 3.09Å
1089	H	43.1	Very low	67.6	Low	181 Å²	181	58.8 Å²	58.8	84%	0.838	28%	0.278	S	S	*	.	S	Bend	trans	-134.8	102.3	163.2	-67.9	-36.3	0	0	0	112.4	R1087	R1087-H1089 PolarHBondContact O-N 2.78Å
1090	Q	49	Very low	67.3	Low	191 Å²	191	58.4 Å²	58.4	89%	0.893	28%	0.276	S	S	*	.	S	Bend	trans	87	-12.1	165.5	-58.3	-171.8	-13	0	0	121.1
1091	R	57.5	Low	66.7	Low	148 Å²	148	63.2 Å²	63.2	56%	0.558	30%	0.298	S	S	*	.			trans	-130.5	59.2	171.3	-68.4	-169.7	-178.4	-176.5	3.4	113.3	A1093 D1094 E1095	R1091-A1093 VanDerWaalsContact C-N 3.27Å; R1091-A1093 PolarHBondContact O-N 3.46Å; R1091-D1094 HydrophobicContact CB-CB 4.5Å; R1091-D1094 WeakPolarHBondContact CD-OD2 3.28Å; R1091-D1094 IonicContact NH1-OD2 3.8Å; R1091-D1094 PolarHBondContact O-N 2.9Å; R1091-E1095 PolarHBondContact O-N 2.04Å
1092	V	66	Low	66.3	Low	34 Å²	34	68.4 Å²	68.4	21%	0.206	32%	0.318	C	S	.	.	H	α-helix	trans	-56.4	-39.9	-177.3	-177.5	0	0	0	0	112	L1082 L1096	L1082-V1092 HydrophobicContact CD2-CG1 4.15Å; V1092-L1096 WeakPolarHBondContact O-CB 3Å; V1092-L1096 PolarHBondContact O-N 3.35Å
1093	A	66.8	Low	66.6	Low	15 Å²	15	68.5 Å²	68.5	12%	0.124	32%	0.318	C	S	.	.	H	α-helix	trans	-64.9	-50.3	-179.4	0	0	0	0	0	113.7	R1091 E1095 L1096 I1097 A1123	R1091-A1093 VanDerWaalsContact C-N 3.27Å; R1091-A1093 PolarHBondContact O-N 3.46Å; A1093-E1095 PolarHBondContact O-N 3.36Å; A1093-L1096 PolarHBondContact O-N 3.1Å; A1093-I1097 WeakPolarHBondContact O-CB 3.1Å; A1093-I1097 VanDerWaalsContact O-CG1 3.23Å; A1093-I1097 WeakPolarHBondContact O-CG1 3.48Å; A1093-I1097 PolarHBondContact O-N 3.02Å; A1093-A1123 HydrophobicContact CB-CB 3.83Å
1094	D	65.9	Low	66.9	Low	91 Å²	91	68.4 Å²	68.4	49%	0.487	32%	0.319	S	S	.	.	H	α-helix	trans	-65.9	-41.4	-175.8	-61.9	-20.4	0	0	0	111.1	R1091 A1098	R1091-D1094 HydrophobicContact CB-CB 4.5Å; R1091-D1094 WeakPolarHBondContact CD-OD2 3.28Å; R1091-D1094 IonicContact NH1-OD2 3.8Å; R1091-D1094 PolarHBondContact O-N 2.9Å; D1094-A1098 VanDerWaalsContact O-CB 3.26Å; D1094-A1098 WeakPolarHBondContact O-CB 3.47Å; D1094-A1098 PolarHBondContact O-N 3.05Å
1095	E	70.5	Confident	67.5	Low	70 Å²	70	67.7 Å²	67.7	33%	0.327	32%	0.316	S	S	.	.	H	α-helix	trans	-67.4	-39.8	175.4	-71.8	-163.9	166.3	0	0	112.1	R1087 R1091 A1093 A1098 A1099	R1087-E1095 VanDerWaalsContact O-OE2 3.06Å; R1091-E1095 PolarHBondContact O-N 2.04Å; A1093-E1095 PolarHBondContact O-N 3.36Å; E1095-A1098 PolarHBondContact O-N 3.49Å; E1095-A1099 WeakPolarHBondContact O-CB 3.19Å; E1095-A1099 PolarHBondContact O-N 3.4Å
1096	L	76.5	Confident	68.5	Low	0 Å²	0	64.2 Å²	64.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.5	-47.3	177	180	60.1	0	0	0	110.5	L1051 Y1053 L1082 V1092 A1093 A1098 A1099 M1100 A1127	L1051-L1096 HydrophobicContact CD2-CD1 4.44Å; Y1053-L1096 HydrophobicContact CD1-CD1 4.45Å; Y1053-L1096 HydrophobicContact CD1-CD2 4.36Å; Y1053-L1096 HydrophobicContact CE1-CD2 3.99Å; Y1053-L1096 HydrophobicContact CG-CD1 4.43Å; L1082-L1096 HydrophobicContact CD1-CB 4.34Å; L1082-L1096 HydrophobicContact CD1-CD1 4.16Å; L1082-L1096 HydrophobicContact CD2-CD1 4.39Å; V1092-L1096 WeakPolarHBondContact O-CB 3Å; V1092-L1096 PolarHBondContact O-N 3.35Å; A1093-L1096 PolarHBondContact O-N 3.1Å; L1096-A1098 PolarHBondContact O-N 3Å; L1096-A1099 PolarHBondContact O-N 3.32Å; L1096-M1100 HydrophobicContact CD1-CG 4.16Å; L1096-M1100 HydrophobicContact CD1-SD 3.96Å; L1096-M1100 HydrophobicContact CD2-SD 4.46Å; L1096-M1100 HydrophobicContact CG-CG 4.42Å; L1096-M1100 HydrophobicContact CG-SD 3.66Å; L1096-M1100 WeakPolarHBondContact O-CB 3.38Å; L1096-M1100 WeakPolarHBondContact O-CG 3.48Å; L1096-M1100 PolarHBondContact O-N 3.29Å; L1096-M1100 VanDerWaalsContact O-SD 3.4Å; L1096-A1127 HydrophobicContact CD2-CB 3.96Å; L1096-A1127 HydrophobicContact CG-CB 4.31Å
1097	I	75.9	Confident	69.7	Low	29 Å²	29	62.4 Å²	62.4	15%	0.149	29%	0.288	C	S	.	.	H	α-helix	trans	-59	-49.6	176.1	-68.2	165.1	0	0	0	110.2	A1093 A1099 M1100 E1101 A1127	A1093-I1097 WeakPolarHBondContact O-CB 3.1Å; A1093-I1097 VanDerWaalsContact O-CG1 3.23Å; A1093-I1097 WeakPolarHBondContact O-CG1 3.48Å; A1093-I1097 PolarHBondContact O-N 3.02Å; I1097-A1099 VanDerWaalsContact C-N 3.31Å; I1097-A1099 PolarHBondContact O-N 2.85Å; I1097-M1100 PolarHBondContact O-N 3.11Å; I1097-E1101 WeakPolarHBondContact O-CG 3.34Å; I1097-E1101 PolarHBondContact O-N 3.23Å; I1097-A1127 HydrophobicContact CD1-CB 4.24Å; I1097-A1127 HydrophobicContact CG1-CB 3.7Å
1098	A	71.8	Confident	71.6	Confident	29 Å²	29	54.5 Å²	54.5	24%	0.24	26%	0.258	C	S	.	.	H	α-helix	trans	-62	-37.5	178.7	0	0	0	0	0	112.5	D1094 E1095 L1096 R1102	D1094-A1098 VanDerWaalsContact O-CB 3.26Å; D1094-A1098 WeakPolarHBondContact O-CB 3.47Å; D1094-A1098 PolarHBondContact O-N 3.05Å; E1095-A1098 PolarHBondContact O-N 3.49Å; L1096-A1098 PolarHBondContact O-N 3Å; A1098-R1102 WeakPolarHBondContact O-CB 3.1Å; A1098-R1102 WeakPolarHBondContact O-CD 3.26Å; A1098-R1102 WeakPolarHBondContact O-CG 3.27Å; A1098-R1102 PolarHBondContact O-N 3.45Å; A1098-R1102 VanDerWaalsContact O-N 3.1Å
1099	A	75.3	Confident	73.5	Confident	5 Å²	5	52.7 Å²	52.7	4%	0.041	25%	0.247	C	C	.	.	H	α-helix	trans	-68.7	-40.1	175.9	0	0	0	0	0	111.9	L1051 L1086 E1095 L1096 I1097 R1102 S1103	L1051-A1099 HydrophobicContact CD1-CB 4.29Å; L1051-A1099 HydrophobicContact CD2-CB 3.96Å; L1086-A1099 HydrophobicContact CD1-CB 3.39Å; L1086-A1099 HydrophobicContact CD2-CB 4.44Å; E1095-A1099 WeakPolarHBondContact O-CB 3.19Å; E1095-A1099 PolarHBondContact O-N 3.4Å; L1096-A1099 PolarHBondContact O-N 3.32Å; I1097-A1099 VanDerWaalsContact C-N 3.31Å; I1097-A1099 PolarHBondContact O-N 2.85Å; A1099-R1102 PolarHBondContact O-N 2.92Å; A1099-S1103 WeakPolarHBondContact O-CB 3.24Å; A1099-S1103 PolarHBondContact O-N 3.28Å; A1099-S1103 PolarHBondContact O-OG 3.37Å
1100	M	77.6	Confident	75.8	Confident	15 Å²	15	44.1 Å²	44.1	7%	0.074	21%	0.208	C	C	.	.	H	α-helix	trans	-63.6	-42.6	176.4	-66.7	161.6	103.1	0	0	111.1	L1051 L1096 I1097 R1102 S1103 V1106 A1127 L1131	L1051-M1100 HydrophobicContact CD2-CB 4.31Å; L1051-M1100 HydrophobicContact CD2-CG 3.58Å; L1096-M1100 HydrophobicContact CD1-CG 4.16Å; L1096-M1100 HydrophobicContact CD1-SD 3.96Å; L1096-M1100 HydrophobicContact CD2-SD 4.46Å; L1096-M1100 HydrophobicContact CG-CG 4.42Å; L1096-M1100 HydrophobicContact CG-SD 3.66Å; L1096-M1100 WeakPolarHBondContact O-CB 3.38Å; L1096-M1100 WeakPolarHBondContact O-CG 3.48Å; L1096-M1100 PolarHBondContact O-N 3.29Å; L1096-M1100 VanDerWaalsContact O-SD 3.4Å; I1097-M1100 PolarHBondContact O-N 3.11Å; M1100-R1102 VanDerWaalsContact C-N 3.3Å; M1100-R1102 PolarHBondContact O-N 2.74Å; M1100-S1103 PolarHBondContact O-N 3.18Å; M1100-V1106 HydrophobicContact CB-CG2 4.09Å; M1100-V1106 HydrophobicContact CE-CG1 4.17Å; M1100-V1106 HydrophobicContact CG-CG1 4.38Å; M1100-V1106 HydrophobicContact CG-CG2 4.02Å; M1100-A1127 HydrophobicContact SD-CB 4.46Å; M1100-L1131 HydrophobicContact CE-CD1 3.04Å; M1100-L1131 HydrophobicContact CE-CD2 3.82Å; M1100-L1131 HydrophobicContact CE-CG 3.27Å; M1100-L1131 HydrophobicContact SD-CG 4.47Å
1101	E	71	Confident	77.7	Confident	102 Å²	102	35.1 Å²	35.1	48%	0.477	17%	0.166	S	C	.	.	H	α-helix	trans	-64.5	-32.8	175.1	-72.2	176.4	173.4	0	0	112.7	L1041 I1097 S1103 H1130	L1041-E1101 VanDerWaalsContact CD1-O 3.26Å; L1041-E1101 WeakPolarHBondContact CD1-O 3.45Å; I1097-E1101 WeakPolarHBondContact O-CG 3.34Å; I1097-E1101 PolarHBondContact O-N 3.23Å; E1101-S1103 VanDerWaalsContact C-N 3.3Å; E1101-S1103 PolarHBondContact O-N 3.43Å; E1101-H1130 IonicContact OE1-CE1 3.11Å; E1101-H1130 PolarHBondContact OE1-CE1 3.16Å; E1101-H1130 IonicContact OE1-ND1 2.8Å; E1101-H1130 IonicContact OE1-NE2 3.68Å
1102	R	74.8	Confident	79	Confident	110 Å²	110	31.3 Å²	31.3	42%	0.415	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	2.4	179.4	-68.7	173.3	-172.3	-175	7.3	114.3	Q1047 H1048 A1098 A1099 M1100	Q1047-R1102 HydrophobicContact CB-CB 4.3Å; Q1047-R1102 PolarHBondContact N-O 2.93Å; H1048-R1102 PolarHBondContact N-O 3.04Å; A1098-R1102 WeakPolarHBondContact O-CB 3.1Å; A1098-R1102 WeakPolarHBondContact O-CD 3.26Å; A1098-R1102 WeakPolarHBondContact O-CG 3.27Å; A1098-R1102 PolarHBondContact O-N 3.45Å; A1098-R1102 VanDerWaalsContact O-N 3.1Å; A1099-R1102 PolarHBondContact O-N 2.92Å; M1100-R1102 VanDerWaalsContact C-N 3.3Å; M1100-R1102 PolarHBondContact O-N 2.74Å
1103	S	78.1	Confident	79.9	Confident	3 Å²	3	30 Å²	30	2%	0.021	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	134.6	-174.8	-57.2	0	0	0	0	111.4	H1048 L1051 A1099 M1100 E1101	H1048-S1103 VanDerWaalsContact O-CA 3.3Å; H1048-S1103 WeakPolarHBondContact O-CA 3.49Å; L1051-S1103 WeakPolarHBondContact CB-OG 3.05Å; A1099-S1103 WeakPolarHBondContact O-CB 3.24Å; A1099-S1103 PolarHBondContact O-N 3.28Å; A1099-S1103 PolarHBondContact O-OG 3.37Å; M1100-S1103 PolarHBondContact O-N 3.18Å; E1101-S1103 VanDerWaalsContact C-N 3.3Å; E1101-S1103 PolarHBondContact O-N 3.43Å
1104	Q	77.3	Confident	81	Confident	27 Å²	27	29.3 Å²	29.3	13%	0.126	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	-35.1	179.5	-70.1	-180	11.5	0	0	113	L1046 H1048 D1049 N1138 P1181	L1046-Q1104 HydrophobicContact CD1-CG 3.58Å; L1046-Q1104 HydrophobicContact CD2-CG 4.32Å; L1046-Q1104 HydrophobicContact CG-CG 4.38Å; H1048-Q1104 PolarHBondContact O-N 3.21Å; H1048-Q1104 VanDerWaalsContact O-N 3.15Å; D1049-Q1104 WeakPolarHBondContact O-CB 3.4Å; D1049-Q1104 PolarHBondContact OD1-NE2 2.84Å; Q1104-N1138 PolarHBondContact O-OD1 2.99Å; Q1104-P1181 HydrophobicContact CB-CB 4.13Å; Q1104-P1181 HydrophobicContact CB-CG 3.76Å; Q1104-P1181 VanDerWaalsContact OE1-CG 3.29Å
1105	R	86.4	Confident	81.9	Confident	53 Å²	53	26.4 Å²	26.4	20%	0.2	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	137.2	175.3	-166.1	84.1	86.4	178.5	-0.3	111.3	D1049 L1050 L1051 R1137 N1138 V1140 S1179 P1181	D1049-R1105 PolarHBondContact O-N 3.4Å; L1050-R1105 CarbonylContact C-O 3.44Å; L1050-R1105 WeakPolarHBondContact CA-O 3.47Å; L1050-R1105 HydrophobicContact CD2-CB 3.97Å; L1050-R1105 HydrophobicContact CD2-CG 4.44Å; L1051-R1105 PolarHBondContact N-O 3.13Å; R1105-R1137 PolarHBondContact NH1-O 3.42Å; R1105-N1138 CarbonylContact C-O 3.48Å; R1105-N1138 WeakPolarHBondContact CA-O 3.06Å; R1105-N1138 WeakPolarHBondContact CD-O 3.48Å; R1105-N1138 VanDerWaalsContact CG-O 3.3Å; R1105-N1138 WeakPolarHBondContact CG-O 3.32Å; R1105-V1140 HydrophobicContact CG-CG2 3.98Å; R1105-S1179 PolarHBondContact NE-O 3.01Å; R1105-S1179 PolarHBondContact NH2-O 3.46Å; R1105-P1181 HydrophobicContact CB-CG 4.33Å
1106	V	88	Confident	82.5	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.006	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	119.5	176	-173.9	0	0	0	0	109.2	L1051 M1100 V1108 N1138 L1139 V1140	L1051-V1106 HydrophobicContact CB-CG2 4.38Å; L1051-V1106 HydrophobicContact CD2-CG1 4.21Å; L1051-V1106 HydrophobicContact CD2-CG2 4.24Å; L1051-V1106 HydrophobicContact CG-CG1 4.47Å; L1051-V1106 CarbonylContact O-C 3.1Å; L1051-V1106 WeakPolarHBondContact O-CA 3.44Å; M1100-V1106 HydrophobicContact CB-CG2 4.09Å; M1100-V1106 HydrophobicContact CE-CG1 4.17Å; M1100-V1106 HydrophobicContact CG-CG1 4.38Å; M1100-V1106 HydrophobicContact CG-CG2 4.02Å; V1106-V1108 HydrophobicContact CG1-CG2 4.15Å; V1106-N1138 PolarHBondContact N-O 3.25Å; V1106-L1139 HydrophobicContact CB-CD1 4.29Å; V1106-L1139 HydrophobicContact CG1-CD1 4.12Å; V1106-L1139 CarbonylContact O-C 3.43Å; V1106-L1139 VanDerWaalsContact O-CA 3.29Å; V1106-L1139 WeakPolarHBondContact O-CA 3.43Å; V1106-V1140 PolarHBondContact O-N 2.99Å
1107	I	90.2	Very high	82.8	Confident	3 Å²	3	33.8 Å²	33.8	2%	0.015	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	125.9	172.4	-62.2	170.3	0	0	0	108	L1050 L1051 I1052 Y1053 L1070 V1140 I1142 L1176	L1050-I1107 HydrophobicContact CD2-CD1 3.85Å; L1050-I1107 HydrophobicContact CD2-CG1 4.39Å; L1051-I1107 PolarHBondContact O-N 3.3Å; I1052-I1107 CarbonylContact C-O 3.17Å; I1052-I1107 WeakPolarHBondContact CA-O 3.5Å; I1052-I1107 HydrophobicContact CD1-CD1 4.37Å; I1052-I1107 HydrophobicContact CG1-CB 4.22Å; I1052-I1107 HydrophobicContact CG1-CD1 4.3Å; Y1053-I1107 PolarHBondContact N-O 2.9Å; L1070-I1107 HydrophobicContact CD1-CD1 4.48Å; I1107-V1140 CarbonylContact C-O 3.05Å; I1107-V1140 WeakPolarHBondContact CA-O 3.36Å; I1107-V1140 HydrophobicContact CG1-CB 4.16Å; I1107-I1142 HydrophobicContact CG2-CD1 3.42Å; I1107-I1142 VanDerWaalsContact CG2-CD1 3.42Å; I1107-I1142 HydrophobicContact CG2-CG1 4.01Å; I1107-L1176 HydrophobicContact CD1-CD1 4.04Å
1108	V	90.8	Very high	83.2	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	123.1	174.7	176.5	0	0	0	0	109.5	Y1053 V1106 L1110 F1114 F1128 L1139 V1140 L1141 I1142	Y1053-V1108 HydrophobicContact CD1-CG2 4.44Å; Y1053-V1108 CarbonylContact O-C 3.24Å; Y1053-V1108 VanDerWaalsContact O-CA 3.27Å; Y1053-V1108 WeakPolarHBondContact O-CA 3.32Å; V1106-V1108 HydrophobicContact CG1-CG2 4.15Å; V1108-L1110 HydrophobicContact CG1-CD1 4.27Å; V1108-L1110 PolarHBondContact O-N 2.86Å; V1108-F1114 HydrophobicContact CG1-CE1 4.33Å; V1108-F1114 HydrophobicContact CG1-CE2 4.06Å; V1108-F1114 HydrophobicContact CG1-CZ 3.89Å; V1108-F1128 HydrophobicContact CB-CZ 4.27Å; V1108-F1128 HydrophobicContact CG1-CE1 4.32Å; V1108-F1128 HydrophobicContact CG1-CZ 3.82Å; V1108-F1128 HydrophobicContact CG2-CE1 4.02Å; V1108-F1128 HydrophobicContact CG2-CZ 3.6Å; V1108-L1139 HydrophobicContact CB-CD1 4.2Å; V1108-L1139 HydrophobicContact CG2-CD1 3.48Å; V1108-L1139 VanDerWaalsContact CG2-CD1 3.48Å; V1108-V1140 PolarHBondContact N-O 3.12Å; V1108-L1141 HydrophobicContact CB-CD2 3.83Å; V1108-L1141 HydrophobicContact CG1-CD2 4.3Å; V1108-L1141 WeakPolarHBondContact O-CA 3.5Å; V1108-I1142 PolarHBondContact O-N 3.44Å
1109	V	91.7	Very high	83.9	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	103.5	170	-175.7	0	0	0	0	108.2	Y1053 C1054 V1062 L1066 S1111 I1142 P1144	Y1053-V1109 PolarHBondContact O-N 2.82Å; C1054-V1109 HydrophobicContact CB-CB 3.82Å; C1054-V1109 HydrophobicContact CB-CG2 4.15Å; V1062-V1109 HydrophobicContact CG1-CG2 4.14Å; V1062-V1109 HydrophobicContact CG2-CB 4.31Å; V1062-V1109 HydrophobicContact CG2-CG1 4.24Å; V1062-V1109 HydrophobicContact CG2-CG2 3.96Å; L1066-V1109 HydrophobicContact CD2-CG2 4Å; V1109-S1111 PolarHBondContact O-N 3.03Å; V1109-I1142 CarbonylContact C-O 3.5Å; V1109-I1142 HydrophobicContact CG2-CB 4.41Å; V1109-P1144 HydrophobicContact CG1-CG 3.82Å
1110	L	90.7	Very high	84.2	Confident	0 Å²	0	37 Å²	37	0%	0	17%	0.166	C	C	.	.			trans	-95.9	81.7	-174	-160	92.8	0	0	0	110.7	V1108 F1114 I1115 I1142 L1143 L1147 L1155 L1159	V1108-L1110 HydrophobicContact CG1-CD1 4.27Å; V1108-L1110 PolarHBondContact O-N 2.86Å; L1110-F1114 HydrophobicContact CD1-CD1 3.59Å; L1110-F1114 HydrophobicContact CD1-CE1 3.68Å; L1110-F1114 HydrophobicContact CG-CD1 4.37Å; L1110-I1115 HydrophobicContact CD2-CD1 4.3Å; L1110-I1115 HydrophobicContact CG-CD1 4.4Å; L1110-I1115 HydrophobicContact CG-CG1 4.42Å; L1110-I1142 PolarHBondContact N-O 3.44Å; L1110-L1143 HydrophobicContact CD2-CD2 4.26Å; L1110-L1147 HydrophobicContact CD2-CD1 3.7Å; L1110-L1147 HydrophobicContact CD2-CD2 4.33Å; L1110-L1155 HydrophobicContact CD1-CD1 3.61Å; L1110-L1155 HydrophobicContact CD1-CD2 4.22Å; L1110-L1155 HydrophobicContact CD2-CD1 3.9Å; L1110-L1155 HydrophobicContact CD2-CD2 4.17Å; L1110-L1155 HydrophobicContact CD2-CG 4.27Å; L1110-L1155 HydrophobicContact CG-CD1 4.4Å; L1110-L1159 HydrophobicContact CD2-CD1 4.41Å; L1110-L1159 HydrophobicContact CD2-CD2 4.04Å; L1110-L1159 HydrophobicContact CD2-CG 4.49Å
1111	S	88.5	Confident	84.4	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.014	18%	0.18	C	C	.	.			trans	-93.7	172.6	176.8	65.1	0	0	0	0	113.7	E1058 V1109 S1113 F1114 I1115	E1058-S1111 WeakPolarHBondContact OE1-CB 3.48Å; E1058-S1111 PolarHBondContact OE1-OG 2.92Å; E1058-S1111 VanDerWaalsContact OE1-OG 3.06Å; E1058-S1111 WeakPolarHBondContact OE2-CB 3.36Å; E1058-S1111 PolarHBondContact OE2-OG 3.05Å; V1109-S1111 PolarHBondContact O-N 3.03Å; S1111-S1113 PolarHBondContact O-N 3.19Å; S1111-S1113 PolarHBondContact OG-N 2.65Å; S1111-F1114 WeakPolarHBondContact O-CB 3.46Å; S1111-F1114 PolarHBondContact O-N 3.29Å; S1111-F1114 PolarHBondContact OG-N 3.01Å; S1111-I1115 WeakPolarHBondContact O-CG1 3.48Å; S1111-I1115 PolarHBondContact O-N 3.04Å; S1111-I1115 VanDerWaalsContact O-N 3.1Å
1112	D	84.2	Confident	84.6	Confident	69 Å²	69	40.2 Å²	40.2	37%	0.369	19%	0.188	S	C	.	.	H	α-helix	trans	-59.5	-35.3	170.5	-68	-40.1	0	0	0	112.1	I1115 R1116	D1112-I1115 PolarHBondContact O-N 3.19Å; D1112-R1116 WeakPolarHBondContact O-CB 3.38Å; D1112-R1116 WeakPolarHBondContact O-CG 3.17Å; D1112-R1116 PolarHBondContact O-N 3.03Å
1113	S	84.9	Confident	84.6	Confident	6 Å²	6	36.6 Å²	36.6	4%	0.042	18%	0.182	C	C	.	.	H	α-helix	trans	-68.1	-42.3	175.8	-175.3	0	0	0	0	111.7	E1057 S1111 I1115 R1116 N1117	E1057-S1113 VanDerWaalsContact OE2-CB 3.3Å; E1057-S1113 WeakPolarHBondContact OE2-CB 3.31Å; E1057-S1113 PolarHBondContact OE2-OG 3.5Å; S1111-S1113 PolarHBondContact O-N 3.19Å; S1111-S1113 PolarHBondContact OG-N 2.65Å; S1113-I1115 VanDerWaalsContact C-N 3.29Å; S1113-I1115 PolarHBondContact O-N 2.79Å; S1113-R1116 PolarHBondContact O-N 3.09Å; S1113-N1117 VanDerWaalsContact O-CB 3.32Å; S1113-N1117 WeakPolarHBondContact O-CB 2.85Å; S1113-N1117 PolarHBondContact O-N 3.42Å; S1113-N1117 PolarHBondContact OG-ND2 3.11Å; S1113-N1117 VanDerWaalsContact OG-ND2 3.14Å
1114	F	89.9	Confident	84.7	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.181	C	C	.	.	I	π-helix	trans	-56.9	-45	175.4	-174	-86.3	0	0	0	111.2	Y1053 V1108 L1110 S1111 E1118 W1119 F1128	Y1053-F1114 AromaticContact CD1-CE2 3.72Å; Y1053-F1114 HydrophobicContact CD1-CE2 3.72Å; Y1053-F1114 HydrophobicContact CD1-CZ 4.03Å; Y1053-F1114 AromaticContact CE1-CE2 3.35Å; Y1053-F1114 HydrophobicContact CE1-CE2 3.35Å; Y1053-F1114 AromaticContact CE1-CZ 3.6Å; Y1053-F1114 HydrophobicContact CE1-CZ 3.6Å; Y1053-F1114 HydrophobicContact CG-CE2 4.46Å; Y1053-F1114 AromaticContact CZ-CE2 3.79Å; V1108-F1114 HydrophobicContact CG1-CE1 4.33Å; V1108-F1114 HydrophobicContact CG1-CE2 4.06Å; V1108-F1114 HydrophobicContact CG1-CZ 3.89Å; L1110-F1114 HydrophobicContact CD1-CD1 3.59Å; L1110-F1114 HydrophobicContact CD1-CE1 3.68Å; L1110-F1114 HydrophobicContact CG-CD1 4.37Å; S1111-F1114 WeakPolarHBondContact O-CB 3.46Å; S1111-F1114 PolarHBondContact O-N 3.29Å; S1111-F1114 PolarHBondContact OG-N 3.01Å; F1114-E1118 HydrophobicContact CD2-CB 3.85Å; F1114-E1118 HydrophobicContact CD2-CG 3.96Å; F1114-E1118 HydrophobicContact CE2-CB 3.92Å; F1114-E1118 HydrophobicContact CE2-CG 4.29Å; F1114-E1118 HydrophobicContact CG-CB 4.19Å; F1114-E1118 HydrophobicContact CZ-CB 4.3Å; F1114-E1118 WeakPolarHBondContact O-CA 3.34Å; F1114-E1118 WeakPolarHBondContact O-CB 3.38Å; F1114-E1118 PolarHBondContact O-N 3.39Å; F1114-W1119 HydrophobicContact CD1-CB 4.43Å; F1114-W1119 HydrophobicContact CE1-CB 4.39Å; F1114-W1119 HydrophobicContact CE1-CE3 4.13Å; F1114-W1119 PolarHBondContact O-N 2.88Å; F1114-F1128 HydrophobicContact CE1-CZ 4.4Å; F1114-F1128 HydrophobicContact CZ-CE2 4.05Å; F1114-F1128 AromaticContact CZ-CZ 3.88Å; F1114-F1128 HydrophobicContact CZ-CZ 3.88Å
1115	I	86.3	Confident	85	Confident	30 Å²	30	38.7 Å²	38.7	15%	0.154	19%	0.188	C	C	.	.	I	π-helix	trans	-69.9	-38	-178.5	-64.6	166.5	0	0	0	112	L1110 S1111 D1112 S1113 Q1120 L1147 M1151 L1155	L1110-I1115 HydrophobicContact CD2-CD1 4.3Å; L1110-I1115 HydrophobicContact CG-CD1 4.4Å; L1110-I1115 HydrophobicContact CG-CG1 4.42Å; S1111-I1115 WeakPolarHBondContact O-CG1 3.48Å; S1111-I1115 PolarHBondContact O-N 3.04Å; S1111-I1115 VanDerWaalsContact O-N 3.1Å; D1112-I1115 PolarHBondContact O-N 3.19Å; S1113-I1115 VanDerWaalsContact C-N 3.29Å; S1113-I1115 PolarHBondContact O-N 2.79Å; I1115-Q1120 PolarHBondContact O-NE2 2.82Å; I1115-L1147 HydrophobicContact CD1-CD2 3.41Å; I1115-L1147 VanDerWaalsContact CD1-CD2 3.41Å; I1115-M1151 HydrophobicContact CD1-CE 3.84Å; I1115-M1151 HydrophobicContact CD1-SD 3.98Å; I1115-L1155 HydrophobicContact CD1-CD2 4.25Å; I1115-L1155 HydrophobicContact CG1-CD2 3.98Å
1116	R	81.7	Confident	84.5	Confident	157 Å²	157	40.9 Å²	40.9	59%	0.592	20%	0.202	S	C	*	.	I	π-helix	trans	-72.9	-35.1	178.3	-74	-168.3	-55.5	-117.2	0.7	113.7	D1112 S1113 Q1120	D1112-R1116 WeakPolarHBondContact O-CB 3.38Å; D1112-R1116 WeakPolarHBondContact O-CG 3.17Å; D1112-R1116 PolarHBondContact O-N 3.03Å; S1113-R1116 PolarHBondContact O-N 3.09Å; R1116-Q1120 WeakPolarHBondContact O-CG 3.31Å
1117	N	83.9	Confident	83.9	Confident	68 Å²	68	40.9 Å²	40.9	36%	0.364	20%	0.202	S	C	.	.	I	π-helix	trans	-111.1	-56.8	-167.6	-62.8	-27.7	0	0	0	112.6	E1057 S1113	E1057-N1117 PolarHBondContact OE1-ND2 3.31Å; S1113-N1117 VanDerWaalsContact O-CB 3.32Å; S1113-N1117 WeakPolarHBondContact O-CB 2.85Å; S1113-N1117 PolarHBondContact O-N 3.42Å; S1113-N1117 PolarHBondContact OG-ND2 3.11Å; S1113-N1117 VanDerWaalsContact OG-ND2 3.14Å
1118	E	84.6	Confident	83.3	Confident	9 Å²	9	40.7 Å²	40.7	4%	0.042	20%	0.201	C	C	.	.	I	π-helix	trans	-77.8	-47.7	-174.3	-58.8	-63.7	176.6	0	0	111.2	Y1053 W1056 Y1083 F1114 Q1120 Q1121 I1124	Y1053-E1118 PolarHBondContact OH-OE2 3.12Å; W1056-E1118 PolarHBondContact N-OE1 3.38Å; Y1083-E1118 VanDerWaalsContact OH-CD 3.27Å; Y1083-E1118 PolarHBondContact OH-OE1 3.13Å; Y1083-E1118 PolarHBondContact OH-OE2 2.98Å; F1114-E1118 HydrophobicContact CD2-CB 3.85Å; F1114-E1118 HydrophobicContact CD2-CG 3.96Å; F1114-E1118 HydrophobicContact CE2-CB 3.92Å; F1114-E1118 HydrophobicContact CE2-CG 4.29Å; F1114-E1118 HydrophobicContact CG-CB 4.19Å; F1114-E1118 HydrophobicContact CZ-CB 4.3Å; F1114-E1118 WeakPolarHBondContact O-CA 3.34Å; F1114-E1118 WeakPolarHBondContact O-CB 3.38Å; F1114-E1118 PolarHBondContact O-N 3.39Å; E1118-Q1120 PolarHBondContact O-N 3.32Å; E1118-Q1121 WeakPolarHBondContact O-CB 3.48Å; E1118-Q1121 PolarHBondContact O-N 2.99Å; E1118-Q1121 PolarHBondContact OE2-NE2 2.95Å; E1118-I1124 HydrophobicContact CB-CD1 3.89Å; E1118-I1124 WeakPolarHBondContact O-CD1 3.26Å; E1118-I1124 WeakPolarHBondContact OE2-CD1 3.49Å
1119	W	85.4	Confident	82.5	Confident	4 Å²	4	44 Å²	44	2%	0.015	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-22.5	-178.2	-170.6	-106.2	0	0	0	113.7	F1114 Q1121 R1125 F1128 D1152 I1154 L1155	F1114-W1119 HydrophobicContact CD1-CB 4.43Å; F1114-W1119 HydrophobicContact CE1-CB 4.39Å; F1114-W1119 HydrophobicContact CE1-CE3 4.13Å; F1114-W1119 PolarHBondContact O-N 2.88Å; W1119-Q1121 PolarHBondContact O-N 3.33Å; W1119-R1125 HydrophobicContact CD2-CG 4.32Å; W1119-R1125 HydrophobicContact CZ2-CG 4.37Å; W1119-R1125 VanDerWaalsContact O-CD 3.23Å; W1119-R1125 WeakPolarHBondContact O-CD 3.26Å; W1119-R1125 WeakPolarHBondContact O-CG 3.34Å; W1119-F1128 HydrophobicContact CH2-CB 4.05Å; W1119-F1128 HydrophobicContact CH2-CD1 4.49Å; W1119-F1128 HydrophobicContact CH2-CG 4.32Å; W1119-F1128 HydrophobicContact CZ3-CB 3.8Å; W1119-F1128 AromaticContact CZ3-CD1 3.86Å; W1119-F1128 HydrophobicContact CZ3-CD1 3.86Å; W1119-F1128 HydrophobicContact CZ3-CD2 4.04Å; W1119-F1128 HydrophobicContact CZ3-CE1 4.4Å; W1119-F1128 AromaticContact CZ3-CG 3.64Å; W1119-F1128 HydrophobicContact CZ3-CG 3.64Å; W1119-D1152 HydrophobicContact CZ2-CB 4.5Å; W1119-I1154 HydrophobicContact CH2-CB 4.38Å; W1119-I1154 HydrophobicContact CH2-CG2 3.96Å; W1119-I1154 HydrophobicContact CZ2-CB 4.08Å; W1119-I1154 HydrophobicContact CZ2-CG2 4.18Å; W1119-L1155 HydrophobicContact CD2-CD2 4.14Å; W1119-L1155 HydrophobicContact CG-CD2 4.34Å; W1119-L1155 HydrophobicContact CH2-CB 4.1Å; W1119-L1155 HydrophobicContact CH2-CD1 4.43Å; W1119-L1155 HydrophobicContact CZ2-CB 3.6Å; W1119-L1155 HydrophobicContact CZ2-CG 4.5Å; W1119-L1155 HydrophobicContact CZ3-CD1 4.43Å
1120	Q	81.5	Confident	81.5	Confident	119 Å²	119	47.5 Å²	47.5	56%	0.556	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-16.9	175.8	-59.2	-55.3	-41.4	0	0	112.6	I1115 R1116 E1118 T1122	I1115-Q1120 PolarHBondContact O-NE2 2.82Å; R1116-Q1120 WeakPolarHBondContact O-CG 3.31Å; E1118-Q1120 PolarHBondContact O-N 3.32Å; Q1120-T1122 PolarHBondContact O-N 3.47Å
1121	Q	81.9	Confident	80.3	Confident	80 Å²	80	48.5 Å²	48.5	37%	0.374	24%	0.241	S	C	.	.	S	Bend	trans	-77.2	121.6	177.9	-57.4	178.3	39.8	0	0	110.5	E1118 W1119 A1123 I1124 R1125	E1118-Q1121 WeakPolarHBondContact O-CB 3.48Å; E1118-Q1121 PolarHBondContact O-N 2.99Å; E1118-Q1121 PolarHBondContact OE2-NE2 2.95Å; W1119-Q1121 PolarHBondContact O-N 3.33Å; Q1121-A1123 PolarHBondContact O-N 2.03Å; Q1121-A1123 VanDerWaalsContact O-N 3.13Å; Q1121-I1124 HydrophobicContact CB-CB 4.42Å; Q1121-I1124 HydrophobicContact CB-CD1 4Å; Q1121-I1124 HydrophobicContact CB-CG1 4.29Å; Q1121-I1124 HydrophobicContact CG-CD1 4.24Å; Q1121-I1124 PolarHBondContact O-N 3.13Å; Q1121-R1125 PolarHBondContact O-N 3.34Å
1122	T	76.1	Confident	78.9	Confident	103 Å²	103	51 Å²	51	63%	0.632	25%	0.253	S	S	*	.	H	α-helix	trans	-53.8	-36.5	176.8	-50	0	0	0	0	112.2	Q1120 I1124 R1125 I1126	Q1120-T1122 PolarHBondContact O-N 3.47Å; T1122-I1124 PolarHBondContact O-N 2.85Å; T1122-R1125 PolarHBondContact O-N 2.92Å; T1122-I1126 HydrophobicContact CG2-CD1 4.11Å; T1122-I1126 VanDerWaalsContact O-CG1 3.26Å; T1122-I1126 WeakPolarHBondContact O-CG1 3.49Å; T1122-I1126 PolarHBondContact O-N 2.8Å
1123	A	74.7	Confident	77.4	Confident	35 Å²	35	56 Å²	56	29%	0.289	27%	0.267	S	S	.	.	H	α-helix	trans	-56	-46.4	176.1	0	0	0	0	0	112.9	A1093 Q1121 I1126 A1127	A1093-A1123 HydrophobicContact CB-CB 3.83Å; Q1121-A1123 PolarHBondContact O-N 2.03Å; Q1121-A1123 VanDerWaalsContact O-N 3.13Å; A1123-I1126 PolarHBondContact O-N 2.8Å; A1123-A1127 PolarHBondContact O-N 3.24Å; A1123-A1127 VanDerWaalsContact O-N 3.12Å
1124	I	80.3	Confident	75.8	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-71.7	-38.3	-179.9	-68.9	165.5	0	0	0	110.5	Y1053 E1118 Q1121 T1122 I1126 A1127 F1128	Y1053-I1124 HydrophobicContact CE1-CG2 4.26Å; Y1053-I1124 WeakPolarHBondContact OH-CD1 3.48Å; E1118-I1124 HydrophobicContact CB-CD1 3.89Å; E1118-I1124 WeakPolarHBondContact O-CD1 3.26Å; E1118-I1124 WeakPolarHBondContact OE2-CD1 3.49Å; Q1121-I1124 HydrophobicContact CB-CB 4.42Å; Q1121-I1124 HydrophobicContact CB-CD1 4Å; Q1121-I1124 HydrophobicContact CB-CG1 4.29Å; Q1121-I1124 HydrophobicContact CG-CD1 4.24Å; Q1121-I1124 PolarHBondContact O-N 3.13Å; T1122-I1124 PolarHBondContact O-N 2.85Å; I1124-I1126 VanDerWaalsContact C-N 3.28Å; I1124-I1126 PolarHBondContact O-N 2.84Å; I1124-A1127 PolarHBondContact O-N 3Å; I1124-A1127 VanDerWaalsContact O-N 3.16Å; I1124-F1128 HydrophobicContact CG2-CD2 3.92Å; I1124-F1128 HydrophobicContact CG2-CE2 3.93Å; I1124-F1128 WeakPolarHBondContact O-CD2 3.32Å; I1124-F1128 PolarHBondContact O-N 2.79Å
1125	R	82.6	Confident	73.6	Confident	74 Å²	74	67 Å²	67	28%	0.279	31%	0.313	S	S	.	.	H	α-helix	trans	-63.1	-35.5	174.8	-61	179.1	75	174.7	1.5	112.1	W1119 Q1121 T1122 N1129 D1152	W1119-R1125 HydrophobicContact CD2-CG 4.32Å; W1119-R1125 HydrophobicContact CZ2-CG 4.37Å; W1119-R1125 VanDerWaalsContact O-CD 3.23Å; W1119-R1125 WeakPolarHBondContact O-CD 3.26Å; W1119-R1125 WeakPolarHBondContact O-CG 3.34Å; Q1121-R1125 PolarHBondContact O-N 3.34Å; T1122-R1125 PolarHBondContact O-N 2.92Å; R1125-N1129 WeakPolarHBondContact O-CB 3.47Å; R1125-N1129 PolarHBondContact O-N 3.12Å; R1125-D1152 IonicContact CZ-OD1 3.25Å; R1125-D1152 IonicContact CZ-OD2 3.99Å; R1125-D1152 IonicContact NH2-OD1 2.76Å; R1125-D1152 PolarHBondContact NH2-OD1 2.99Å; R1125-D1152 IonicContact NH2-OD2 3.26Å; R1125-D1152 PolarHBondContact NH2-OD2 3.1Å
1126	I	75.7	Confident	71.8	Confident	99 Å²	99	68 Å²	68	51%	0.508	32%	0.317	S	S	.	.	H	α-helix	trans	-64.3	-46.1	172.5	-69.1	163.8	0	0	0	110.5	T1122 A1123 I1124 F1128 N1129 H1130	T1122-I1126 HydrophobicContact CG2-CD1 4.11Å; T1122-I1126 VanDerWaalsContact O-CG1 3.26Å; T1122-I1126 WeakPolarHBondContact O-CG1 3.49Å; T1122-I1126 PolarHBondContact O-N 2.8Å; A1123-I1126 PolarHBondContact O-N 2.8Å; I1124-I1126 VanDerWaalsContact C-N 3.28Å; I1124-I1126 PolarHBondContact O-N 2.84Å; I1126-F1128 PolarHBondContact O-N 3.37Å; I1126-N1129 WeakPolarHBondContact O-CB 3.21Å; I1126-N1129 PolarHBondContact O-N 3.25Å; I1126-H1130 PolarHBondContact O-N 2.7Å
1127	A	75.8	Confident	70.5	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-61.4	-42.7	178	0	0	0	0	0	112.8	L1096 I1097 M1100 A1123 I1124 H1130 L1131	L1096-A1127 HydrophobicContact CD2-CB 3.96Å; L1096-A1127 HydrophobicContact CG-CB 4.31Å; I1097-A1127 HydrophobicContact CD1-CB 4.24Å; I1097-A1127 HydrophobicContact CG1-CB 3.7Å; M1100-A1127 HydrophobicContact SD-CB 4.46Å; A1123-A1127 PolarHBondContact O-N 3.24Å; A1123-A1127 VanDerWaalsContact O-N 3.12Å; I1124-A1127 PolarHBondContact O-N 3Å; I1124-A1127 VanDerWaalsContact O-N 3.16Å; A1127-H1130 WeakPolarHBondContact O-CB 3.17Å; A1127-H1130 PolarHBondContact O-N 3.06Å; A1127-H1130 VanDerWaalsContact O-N 3.17Å; A1127-L1131 PolarHBondContact O-N 3.38Å
1128	F	78.4	Confident	69.8	Low	0 Å²	0	67.7 Å²	67.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-69.2	-36.6	175	-86.7	-108.1	0	0	0	112.9	Y1053 V1108 F1114 W1119 I1124 I1126 H1130 L1131 L1132 L1139 H1158	Y1053-F1128 HydrophobicContact CD1-CE2 4.14Å; Y1053-F1128 HydrophobicContact CD1-CZ 4.36Å; Y1053-F1128 HydrophobicContact CE1-CE2 4.07Å; V1108-F1128 HydrophobicContact CB-CZ 4.27Å; V1108-F1128 HydrophobicContact CG1-CE1 4.32Å; V1108-F1128 HydrophobicContact CG1-CZ 3.82Å; V1108-F1128 HydrophobicContact CG2-CE1 4.02Å; V1108-F1128 HydrophobicContact CG2-CZ 3.6Å; F1114-F1128 HydrophobicContact CE1-CZ 4.4Å; F1114-F1128 HydrophobicContact CZ-CE2 4.05Å; F1114-F1128 AromaticContact CZ-CZ 3.88Å; F1114-F1128 HydrophobicContact CZ-CZ 3.88Å; W1119-F1128 HydrophobicContact CH2-CB 4.05Å; W1119-F1128 HydrophobicContact CH2-CD1 4.49Å; W1119-F1128 HydrophobicContact CH2-CG 4.32Å; W1119-F1128 HydrophobicContact CZ3-CB 3.8Å; W1119-F1128 AromaticContact CZ3-CD1 3.86Å; W1119-F1128 HydrophobicContact CZ3-CD1 3.86Å; W1119-F1128 HydrophobicContact CZ3-CD2 4.04Å; W1119-F1128 HydrophobicContact CZ3-CE1 4.4Å; W1119-F1128 AromaticContact CZ3-CG 3.64Å; W1119-F1128 HydrophobicContact CZ3-CG 3.64Å; I1124-F1128 HydrophobicContact CG2-CD2 3.92Å; I1124-F1128 HydrophobicContact CG2-CE2 3.93Å; I1124-F1128 WeakPolarHBondContact O-CD2 3.32Å; I1124-F1128 PolarHBondContact O-N 2.79Å; I1126-F1128 PolarHBondContact O-N 3.37Å; F1128-H1130 PolarHBondContact O-N 3.23Å; F1128-L1131 WeakPolarHBondContact O-CB 3.32Å; F1128-L1131 PolarHBondContact O-N 3.11Å; F1128-L1131 VanDerWaalsContact O-N 3.12Å; F1128-L1132 PolarHBondContact O-N 3.16Å; F1128-L1139 HydrophobicContact CD1-CD2 4.49Å; F1128-L1139 HydrophobicContact CE1-CD2 4.34Å; F1128-H1158 AromaticContact CD1-NE2 3.98Å; F1128-H1158 PolarHBondContact O-CE1 3.3Å; F1128-H1158 PolarHBondContact O-NE2 3.48Å
1129	N	74.5	Confident	69.8	Low	69 Å²	69	67.4 Å²	67.4	37%	0.369	31%	0.312	S	S	.	.	H	α-helix	trans	-61.1	-31.7	170.4	-99.2	-18.9	0	0	0	112.2	R1125 I1126 L1132	R1125-N1129 WeakPolarHBondContact O-CB 3.47Å; R1125-N1129 PolarHBondContact O-N 3.12Å; I1126-N1129 WeakPolarHBondContact O-CB 3.21Å; I1126-N1129 PolarHBondContact O-N 3.25Å; N1129-L1132 PolarHBondContact O-N 2.95Å
1130	H	69.1	Low	69.9	Low	74 Å²	74	67.3 Å²	67.3	34%	0.343	31%	0.311	S	S	.	.	H	α-helix	trans	-62.7	-44.1	172.8	-160.2	-93	0	0	0	111.2	E1101 I1126 A1127 F1128 L1132 R1133	E1101-H1130 IonicContact OE1-CE1 3.11Å; E1101-H1130 PolarHBondContact OE1-CE1 3.16Å; E1101-H1130 IonicContact OE1-ND1 2.8Å; E1101-H1130 IonicContact OE1-NE2 3.68Å; I1126-H1130 PolarHBondContact O-N 2.7Å; A1127-H1130 WeakPolarHBondContact O-CB 3.17Å; A1127-H1130 PolarHBondContact O-N 3.06Å; A1127-H1130 VanDerWaalsContact O-N 3.17Å; F1128-H1130 PolarHBondContact O-N 3.23Å; H1130-L1132 VanDerWaalsContact C-N 3.26Å; H1130-L1132 PolarHBondContact O-N 3.43Å; H1130-R1133 WeakPolarHBondContact O-CB 3.5Å; H1130-R1133 PolarHBondContact O-N 3.29Å
1131	L	65.6	Low	70.4	Confident	21 Å²	21	61.6 Å²	61.6	11%	0.11	29%	0.285	C	S	.	.	H	α-helix	trans	-60.5	-29.6	173.9	-79	-177.8	0	0	0	114	M1100 A1127 F1128 R1133 D1134 L1139	M1100-L1131 HydrophobicContact CE-CD1 3.04Å; M1100-L1131 HydrophobicContact CE-CD2 3.82Å; M1100-L1131 HydrophobicContact CE-CG 3.27Å; M1100-L1131 HydrophobicContact SD-CG 4.47Å; A1127-L1131 PolarHBondContact O-N 3.38Å; F1128-L1131 WeakPolarHBondContact O-CB 3.32Å; F1128-L1131 PolarHBondContact O-N 3.11Å; F1128-L1131 VanDerWaalsContact O-N 3.12Å; L1131-R1133 PolarHBondContact O-N 3.5Å; L1131-D1134 PolarHBondContact O-N 3.03Å; L1131-D1134 VanDerWaalsContact O-O 3.09Å; L1131-L1139 HydrophobicContact CD1-CB 4.29Å; L1131-L1139 HydrophobicContact CD1-CD1 3.92Å; L1131-L1139 HydrophobicContact CD1-CD2 4.02Å; L1131-L1139 HydrophobicContact CD1-CG 4.3Å
1132	L	60.3	Low	70.9	Confident	54 Å²	54	57.9 Å²	57.9	28%	0.283	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-20.3	175.3	-69.7	178.9	0	0	0	113.2	F1128 N1129 H1130 I1154 H1157 H1158	F1128-L1132 PolarHBondContact O-N 3.16Å; N1129-L1132 PolarHBondContact O-N 2.95Å; H1130-L1132 VanDerWaalsContact C-N 3.26Å; H1130-L1132 PolarHBondContact O-N 3.43Å; L1132-I1154 HydrophobicContact CD1-CG2 3.94Å; L1132-H1157 WeakPolarHBondContact CD2-CD2 3.31Å; L1132-H1158 WeakPolarHBondContact CD2-CE1 3.49Å; L1132-H1158 WeakPolarHBondContact CD2-ND1 3.09Å; L1132-H1158 WeakPolarHBondContact CD2-NE2 3.18Å; L1132-H1158 WeakPolarHBondContact CG-CE1 3.36Å; L1132-H1158 VanDerWaalsContact CG-NE2 3.29Å; L1132-H1158 WeakPolarHBondContact CG-NE2 3.49Å
1133	R	53.2	Low	71.6	Confident	173 Å²	173	53 Å²	53	65%	0.653	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-30.5	175.2	-60.3	-177.6	177.4	-174.8	-0.9	111.6	H1130 L1131 R1135	H1130-R1133 WeakPolarHBondContact O-CB 3.5Å; H1130-R1133 PolarHBondContact O-N 3.29Å; L1131-R1133 PolarHBondContact O-N 3.5Å; R1133-R1135 PolarHBondContact O-N 3.28Å
1134	D	50.8	Low	72	Confident	75 Å²	75	52.9 Å²	52.9	40%	0.401	23%	0.233	S	C	.	.			trans	-80.7	109.4	177.1	-168.9	0.6	0	0	0	110.6	L1131 Q1136	L1131-D1134 PolarHBondContact O-N 3.03Å; L1131-D1134 VanDerWaalsContact O-O 3.09Å; D1134-Q1136 VanDerWaalsContact C-N 3.32Å; D1134-Q1136 PolarHBondContact O-N 3.1Å; D1134-Q1136 PolarHBondContact OD1-N 2.88Å
1135	R	44.3	Very low	72	Confident	162 Å²	162	55.1 Å²	55.1	61%	0.611	25%	0.249	S	C	*	.			trans	-82.7	-4.3	-174.8	-68.8	-111.4	-162.1	135.3	8.7	113.2	D1035 N1036 R1133 R1137	D1035-R1135 IonicContact OD1-NH2 2.6Å; D1035-R1135 PolarHBondContact OD1-NH2 2.94Å; N1036-R1135 VanDerWaalsContact CG-CZ 3.47Å; N1036-R1135 VanDerWaalsContact ND2-CZ 3.28Å; N1036-R1135 PolarHBondContact ND2-NH1 3.41Å; N1036-R1135 PolarHBondContact ND2-NH2 2.99Å; N1036-R1135 WeakPolarHBondContact OD1-CD 3.45Å; N1036-R1135 VanDerWaalsContact OD1-CG 3.27Å; N1036-R1135 WeakPolarHBondContact OD1-CG 3.29Å; N1036-R1135 PolarHBondContact OD1-NE 3.2Å; N1036-R1135 PolarHBondContact OD1-NH1 3.11Å; R1133-R1135 PolarHBondContact O-N 3.28Å; R1135-R1137 PolarHBondContact O-N 3.13Å
1136	Q	47.8	Very low	71.6	Confident	51 Å²	51	59.7 Å²	59.7	24%	0.238	27%	0.274	C	S	.	.	S	Bend	trans	-70.1	131.9	165.1	-70.4	-151.4	-12.4	0	0	108.8	N1038 D1134 N1138	N1038-Q1136 VanDerWaalsContact OD1-CG 3.3Å; N1038-Q1136 WeakPolarHBondContact OD1-CG 3.33Å; N1038-Q1136 PolarHBondContact OD1-NE2 3.13Å; D1134-Q1136 VanDerWaalsContact C-N 3.32Å; D1134-Q1136 PolarHBondContact O-N 3.1Å; D1134-Q1136 PolarHBondContact OD1-N 2.88Å; Q1136-N1138 VanDerWaalsContact CB-OD1 3.31Å; Q1136-N1138 WeakPolarHBondContact CB-OD1 3.02Å; Q1136-N1138 PolarHBondContact O-N 3.03Å
1137	R	54.3	Low	71.6	Confident	196 Å²	196	56.7 Å²	56.7	74%	0.74	26%	0.259	S	S	*	.			trans	-69.8	56	-178.9	-65.8	-177.7	178.4	-173.9	-1	110.8	R1105 R1135 L1139	R1105-R1137 PolarHBondContact NH1-O 3.42Å; R1135-R1137 PolarHBondContact O-N 3.13Å; R1137-L1139 PolarHBondContact O-N 3.17Å
1138	N	68.4	Low	71.4	Confident	23 Å²	23	59.6 Å²	59.6	12%	0.123	28%	0.282	C	S	.	.			trans	-79.2	-13	-171.8	-66.6	-9.7	0	0	0	111.4	Q1104 R1105 V1106 Q1136	Q1104-N1138 PolarHBondContact O-OD1 2.99Å; R1105-N1138 CarbonylContact C-O 3.48Å; R1105-N1138 WeakPolarHBondContact CA-O 3.06Å; R1105-N1138 WeakPolarHBondContact CD-O 3.48Å; R1105-N1138 VanDerWaalsContact CG-O 3.3Å; R1105-N1138 WeakPolarHBondContact CG-O 3.32Å; V1106-N1138 PolarHBondContact N-O 3.25Å; Q1136-N1138 VanDerWaalsContact CB-OD1 3.31Å; Q1136-N1138 WeakPolarHBondContact CB-OD1 3.02Å; Q1136-N1138 PolarHBondContact O-N 3.03Å
1139	L	84.7	Confident	70.6	Confident	4 Å²	4	66 Å²	66	2%	0.021	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	126.4	-178.7	-174.1	65.2	0	0	0	112.5	V1106 V1108 F1128 L1131 R1137 L1141 H1158 N1162	V1106-L1139 HydrophobicContact CB-CD1 4.29Å; V1106-L1139 HydrophobicContact CG1-CD1 4.12Å; V1106-L1139 CarbonylContact O-C 3.43Å; V1106-L1139 VanDerWaalsContact O-CA 3.29Å; V1106-L1139 WeakPolarHBondContact O-CA 3.43Å; V1108-L1139 HydrophobicContact CB-CD1 4.2Å; V1108-L1139 HydrophobicContact CG2-CD1 3.48Å; V1108-L1139 VanDerWaalsContact CG2-CD1 3.48Å; F1128-L1139 HydrophobicContact CD1-CD2 4.49Å; F1128-L1139 HydrophobicContact CE1-CD2 4.34Å; L1131-L1139 HydrophobicContact CD1-CB 4.29Å; L1131-L1139 HydrophobicContact CD1-CD1 3.92Å; L1131-L1139 HydrophobicContact CD1-CD2 4.02Å; L1131-L1139 HydrophobicContact CD1-CG 4.3Å; R1137-L1139 PolarHBondContact O-N 3.17Å; L1139-L1141 HydrophobicContact CD1-CD2 4.07Å; L1139-L1141 HydrophobicContact CD2-CD2 3.89Å; L1139-L1141 HydrophobicContact CD2-CG 4.35Å; L1139-L1141 HydrophobicContact CG-CD2 3.9Å; L1139-L1141 HydrophobicContact CG-CG 4.3Å; L1139-H1158 HydrophobicContact CD2-CB 4.3Å; L1139-H1158 WeakPolarHBondContact CD2-ND1 3.49Å; L1139-N1162 HydrophobicContact CB-CB 4.33Å; L1139-N1162 HydrophobicContact CD2-CB 4.46Å; L1139-N1162 HydrophobicContact CG-CB 4.47Å; L1139-N1162 WeakPolarHBondContact O-CB 2.92Å
1140	V	88.6	Confident	70.3	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.006	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	125.9	168.9	-177.9	0	0	0	0	108	R1105 V1106 I1107 V1108 R1163 L1165 L1176	R1105-V1140 HydrophobicContact CG-CG2 3.98Å; V1106-V1140 PolarHBondContact O-N 2.99Å; I1107-V1140 CarbonylContact C-O 3.05Å; I1107-V1140 WeakPolarHBondContact CA-O 3.36Å; I1107-V1140 HydrophobicContact CG1-CB 4.16Å; V1108-V1140 PolarHBondContact N-O 3.12Å; V1140-R1163 WeakPolarHBondContact CA-O 3.26Å; V1140-L1165 HydrophobicContact CG1-CD1 3.95Å; V1140-L1165 HydrophobicContact CG1-CG 4.33Å; V1140-L1176 HydrophobicContact CG1-CD1 4.41Å
1141	L	90.6	Very high	70.5	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	120.3	179.4	-61.5	179.4	0	0	0	109.8	V1108 L1139 H1158 L1159 R1163 C1164 L1165	V1108-L1141 HydrophobicContact CB-CD2 3.83Å; V1108-L1141 HydrophobicContact CG1-CD2 4.3Å; V1108-L1141 WeakPolarHBondContact O-CA 3.5Å; L1139-L1141 HydrophobicContact CD1-CD2 4.07Å; L1139-L1141 HydrophobicContact CD2-CD2 3.89Å; L1139-L1141 HydrophobicContact CD2-CG 4.35Å; L1139-L1141 HydrophobicContact CG-CD2 3.9Å; L1139-L1141 HydrophobicContact CG-CG 4.3Å; L1141-H1158 HydrophobicContact CD1-CB 4.16Å; L1141-L1159 HydrophobicContact CD1-CD2 3.73Å; L1141-L1159 HydrophobicContact CD1-CG 4.11Å; L1141-R1163 PolarHBondContact N-O 3.09Å; L1141-C1164 CarbonylContact O-C 3.52Å; L1141-C1164 VanDerWaalsContact O-CA 3.31Å; L1141-C1164 WeakPolarHBondContact O-CA 3.49Å; L1141-L1165 PolarHBondContact O-N 2.74Å
1142	I	92.6	Very high	71.3	Confident	1 Å²	1	69.8 Å²	69.8	1%	0.005	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	126.1	173.1	-63.4	170.4	0	0	0	108.7	L1066 I1107 V1108 V1109 L1110 L1165 W1167 F1172 L1176	L1066-I1142 HydrophobicContact CD1-CD1 4.14Å; L1066-I1142 HydrophobicContact CD2-CD1 3.58Å; I1107-I1142 HydrophobicContact CG2-CD1 3.42Å; I1107-I1142 VanDerWaalsContact CG2-CD1 3.42Å; I1107-I1142 HydrophobicContact CG2-CG1 4.01Å; V1108-I1142 PolarHBondContact O-N 3.44Å; V1109-I1142 CarbonylContact C-O 3.5Å; V1109-I1142 HydrophobicContact CG2-CB 4.41Å; L1110-I1142 PolarHBondContact N-O 3.44Å; I1142-L1165 CarbonylContact C-O 3.5Å; I1142-L1165 WeakPolarHBondContact CA-O 3.48Å; I1142-W1167 HydrophobicContact CG2-CE3 4.18Å; I1142-F1172 HydrophobicContact CD1-CZ 4.05Å; I1142-F1172 HydrophobicContact CG1-CE2 4.25Å; I1142-F1172 HydrophobicContact CG1-CZ 4.29Å; I1142-F1172 HydrophobicContact CG2-CE2 3.95Å; I1142-F1172 HydrophobicContact CG2-CZ 4.04Å; I1142-L1176 HydrophobicContact CD1-CD1 3.99Å
1143	L	90.9	Very high	72.1	Confident	2 Å²	2	72 Å²	72	1%	0.01	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	107.3	-178.3	-64.5	133	0	0	0	109.4	L1110 S1145 L1147 L1159 C1164 L1165 Y1166 W1167	L1110-L1143 HydrophobicContact CD2-CD2 4.26Å; L1143-S1145 VanDerWaalsContact C-N 3.3Å; L1143-S1145 PolarHBondContact O-N 3.49Å; L1143-L1147 HydrophobicContact CD2-CD1 3.33Å; L1143-L1147 HydrophobicContact CD2-CD2 4.14Å; L1143-L1147 HydrophobicContact CD2-CG 3.52Å; L1143-L1159 HydrophobicContact CD1-CD2 4.38Å; L1143-L1159 HydrophobicContact CD2-CD2 4.03Å; L1143-C1164 HydrophobicContact CD1-CB 3.77Å; L1143-L1165 PolarHBondContact N-O 3.05Å; L1143-Y1166 HydrophobicContact CB-CD1 3.66Å; L1143-Y1166 HydrophobicContact CB-CE1 3.9Å; L1143-Y1166 HydrophobicContact CB-CG 4.36Å; L1143-Y1166 HydrophobicContact CD1-CD1 4.21Å; L1143-Y1166 HydrophobicContact CD1-CE1 3.93Å; L1143-Y1166 HydrophobicContact CD1-CE2 4.32Å; L1143-Y1166 HydrophobicContact CG-CE1 4.36Å; L1143-Y1166 WeakPolarHBondContact O-CA 3.21Å; L1143-W1167 PolarHBondContact O-N 2.93Å
1144	P	84.2	Confident	73.4	Confident	31 Å²	31	65.6 Å²	65.6	20%	0.201	34%	0.342	C	S	.	.	S	Bend	trans	-65.5	-33.5	176.7	-21.2	33.4	0	0	0	113	V1109	V1109-P1144 HydrophobicContact CG1-CG 3.82Å
1145	S	78.7	Confident	75	Confident	47 Å²	47	62 Å²	62	33%	0.329	32%	0.323	S	S	.	.	S	Bend	trans	-137.5	167.6	-177.9	54.3	0	0	0	0	110.8	L1143 L1147	L1143-S1145 VanDerWaalsContact C-N 3.3Å; L1143-S1145 PolarHBondContact O-N 3.49Å; S1145-L1147 PolarHBondContact O-N 3.38Å
1146	Q	76	Confident	76.8	Confident	170 Å²	170	55.7 Å²	55.7	79%	0.794	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-69.9	128.9	169.7	-74.1	-175.2	-1.9	0	0	109.8
1147	L	74.5	Confident	78.4	Confident	37 Å²	37	56.7 Å²	56.7	19%	0.194	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-73.8	148.6	179.1	-62.2	173.1	0	0	0	112.1	L1110 I1115 L1143 S1145 M1151 L1159	L1110-L1147 HydrophobicContact CD2-CD1 3.7Å; L1110-L1147 HydrophobicContact CD2-CD2 4.33Å; I1115-L1147 HydrophobicContact CD1-CD2 3.41Å; I1115-L1147 VanDerWaalsContact CD1-CD2 3.41Å; L1143-L1147 HydrophobicContact CD2-CD1 3.33Å; L1143-L1147 HydrophobicContact CD2-CD2 4.14Å; L1143-L1147 HydrophobicContact CD2-CG 3.52Å; S1145-L1147 PolarHBondContact O-N 3.38Å; L1147-M1151 HydrophobicContact CB-SD 4.47Å; L1147-M1151 HydrophobicContact CD1-CE 3.72Å; L1147-L1159 HydrophobicContact CD1-CD1 3.6Å; L1147-L1159 HydrophobicContact CD1-CD2 4.12Å
1148	A	71.8	Confident	79.7	Confident	60 Å²	60	47.4 Å²	47.4	50%	0.496	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-61.6	149.2	170	0	0	0	0	0	111.5	D1150 M1151	A1148-D1150 VanDerWaalsContact C-N 3.29Å; A1148-D1150 PolarHBondContact O-N 3.47Å; A1148-M1151 WeakPolarHBondContact O-CG 3.35Å
1149	P	61.8	Low	80.4	Confident	136 Å²	136	48.3 Å²	48.3	88%	0.883	28%	0.279	S	S	*	.	S	Bend	trans	-71.3	-17.5	-175.4	25.5	-33.2	0	0	0	114.8	M1151	P1149-M1151 PolarHBondContact O-N 3.21Å
1150	D	68.4	Low	80.1	Confident	157 Å²	157	57 Å²	57	84%	0.84	31%	0.312	S	S	*	.			trans	-91.9	88.6	-177.3	-155.8	10	0	0	0	110.3	A1148	A1148-D1150 VanDerWaalsContact C-N 3.29Å; A1148-D1150 PolarHBondContact O-N 3.47Å
1151	M	73.4	Confident	79.6	Confident	43 Å²	43	60 Å²	60	21%	0.212	33%	0.33	C	S	.	.			trans	-121.8	146.4	-169.3	-70	-74.7	-71.3	0	0	112.1	I1115 L1147 A1148 P1149 L1155 L1159	I1115-M1151 HydrophobicContact CD1-CE 3.84Å; I1115-M1151 HydrophobicContact CD1-SD 3.98Å; L1147-M1151 HydrophobicContact CB-SD 4.47Å; L1147-M1151 HydrophobicContact CD1-CE 3.72Å; A1148-M1151 WeakPolarHBondContact O-CG 3.35Å; P1149-M1151 PolarHBondContact O-N 3.21Å; M1151-L1155 HydrophobicContact CE-CB 4.34Å; M1151-L1155 HydrophobicContact CE-CD2 3.28Å; M1151-L1155 HydrophobicContact CE-CG 3.58Å; M1151-L1159 HydrophobicContact CE-CD1 3.84Å
1152	D	81.1	Confident	79.2	Confident	42 Å²	42	61.4 Å²	61.4	23%	0.225	34%	0.338	C	S	.	.			trans	-58.3	137.2	175	-171.7	-104.8	0	0	0	111.9	W1119 R1125 I1154 L1155 A1156	W1119-D1152 HydrophobicContact CZ2-CB 4.5Å; R1125-D1152 IonicContact CZ-OD1 3.25Å; R1125-D1152 IonicContact CZ-OD2 3.99Å; R1125-D1152 IonicContact NH2-OD1 2.76Å; R1125-D1152 PolarHBondContact NH2-OD1 2.99Å; R1125-D1152 IonicContact NH2-OD2 3.26Å; R1125-D1152 PolarHBondContact NH2-OD2 3.1Å; D1152-I1154 VanDerWaalsContact C-N 3.26Å; D1152-I1154 PolarHBondContact O-N 3.38Å; D1152-I1154 VanDerWaalsContact O-N 3.17Å; D1152-I1154 WeakPolarHBondContact OD1-CB 3.26Å; D1152-I1154 PolarHBondContact OD1-N 3.34Å; D1152-L1155 HydrophobicContact CB-CB 4.36Å; D1152-L1155 PolarHBondContact O-N 3.41Å; D1152-L1155 VanDerWaalsContact O-N 3.15Å; D1152-A1156 WeakPolarHBondContact O-CB 3.02Å; D1152-A1156 PolarHBondContact O-N 3.42Å
1153	P	77.4	Confident	78.9	Confident	101 Å²	101	67.7 Å²	67.7	66%	0.656	36%	0.362	S	S	*	.	H	α-helix	trans	-58.1	-32.4	-176.1	-26.2	34.1	0	0	0	115	H1157	P1153-H1157 WeakPolarHBondContact O-CB 3.25Å; P1153-H1157 PolarHBondContact O-N 3.23Å
1154	I	80.7	Confident	78.7	Confident	38 Å²	38	69.3 Å²	69.3	20%	0.195	37%	0.372	C	S	.	.	H	α-helix	trans	-70.6	-46.5	179.6	-60.2	169.5	0	0	0	109.3	W1119 L1132 D1152 H1157 H1158	W1119-I1154 HydrophobicContact CH2-CB 4.38Å; W1119-I1154 HydrophobicContact CH2-CG2 3.96Å; W1119-I1154 HydrophobicContact CZ2-CB 4.08Å; W1119-I1154 HydrophobicContact CZ2-CG2 4.18Å; L1132-I1154 HydrophobicContact CD1-CG2 3.94Å; D1152-I1154 VanDerWaalsContact C-N 3.26Å; D1152-I1154 PolarHBondContact O-N 3.38Å; D1152-I1154 VanDerWaalsContact O-N 3.17Å; D1152-I1154 WeakPolarHBondContact OD1-CB 3.26Å; D1152-I1154 PolarHBondContact OD1-N 3.34Å; I1154-H1157 WeakPolarHBondContact O-CB 3.1Å; I1154-H1157 PolarHBondContact O-N 2.9Å; I1154-H1157 VanDerWaalsContact O-N 3.1Å; I1154-H1158 PolarHBondContact O-CD2 3.42Å; I1154-H1158 PolarHBondContact O-N 2.94Å; I1154-H1158 VanDerWaalsContact O-N 3.11Å
1155	L	84.4	Confident	79.1	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.005	36%	0.363	C	S	.	.	H	α-helix	trans	-65.6	-41.6	177.7	-171.8	50.1	0	0	0	111.7	L1110 I1115 W1119 M1151 D1152 H1157 H1158 L1159	L1110-L1155 HydrophobicContact CD1-CD1 3.61Å; L1110-L1155 HydrophobicContact CD1-CD2 4.22Å; L1110-L1155 HydrophobicContact CD2-CD1 3.9Å; L1110-L1155 HydrophobicContact CD2-CD2 4.17Å; L1110-L1155 HydrophobicContact CD2-CG 4.27Å; L1110-L1155 HydrophobicContact CG-CD1 4.4Å; I1115-L1155 HydrophobicContact CD1-CD2 4.25Å; I1115-L1155 HydrophobicContact CG1-CD2 3.98Å; W1119-L1155 HydrophobicContact CD2-CD2 4.14Å; W1119-L1155 HydrophobicContact CG-CD2 4.34Å; W1119-L1155 HydrophobicContact CH2-CB 4.1Å; W1119-L1155 HydrophobicContact CH2-CD1 4.43Å; W1119-L1155 HydrophobicContact CZ2-CB 3.6Å; W1119-L1155 HydrophobicContact CZ2-CG 4.5Å; W1119-L1155 HydrophobicContact CZ3-CD1 4.43Å; M1151-L1155 HydrophobicContact CE-CB 4.34Å; M1151-L1155 HydrophobicContact CE-CD2 3.28Å; M1151-L1155 HydrophobicContact CE-CG 3.58Å; D1152-L1155 HydrophobicContact CB-CB 4.36Å; D1152-L1155 PolarHBondContact O-N 3.41Å; D1152-L1155 VanDerWaalsContact O-N 3.15Å; L1155-H1157 PolarHBondContact O-N 2.03Å; L1155-H1158 PolarHBondContact O-N 2.8Å; L1155-L1159 HydrophobicContact CG-CD1 4.37Å; L1155-L1159 WeakPolarHBondContact O-CG 3.5Å; L1155-L1159 PolarHBondContact O-N 3.26Å
1156	A	82	Confident	79.6	Confident	28 Å²	28	70.8 Å²	70.8	23%	0.231	37%	0.367	C	S	.	.	H	α-helix	trans	-62.2	-25.5	173.6	0	0	0	0	0	112.9	D1152 R1160	D1152-A1156 WeakPolarHBondContact O-CB 3.02Å; D1152-A1156 PolarHBondContact O-N 3.42Å; A1156-R1160 WeakPolarHBondContact O-CG 3.44Å; A1156-R1160 PolarHBondContact O-NE 3.47Å
1157	H	82	Confident	80.1	Confident	73 Å²	73	65 Å²	65	34%	0.338	34%	0.339	S	S	.	.	H	α-helix	trans	-74	-48.3	171.9	-177.6	61.3	0	0	0	111.1	L1132 P1153 I1154 L1155 L1159 R1160 T1161	L1132-H1157 WeakPolarHBondContact CD2-CD2 3.31Å; P1153-H1157 WeakPolarHBondContact O-CB 3.25Å; P1153-H1157 PolarHBondContact O-N 3.23Å; I1154-H1157 WeakPolarHBondContact O-CB 3.1Å; I1154-H1157 PolarHBondContact O-N 2.9Å; I1154-H1157 VanDerWaalsContact O-N 3.1Å; L1155-H1157 PolarHBondContact O-N 2.03Å; H1157-L1159 VanDerWaalsContact C-N 3.33Å; H1157-L1159 PolarHBondContact O-N 2.74Å; H1157-R1160 PolarHBondContact O-N 2.71Å; H1157-T1161 WeakPolarHBondContact CE1-CG2 3.48Å; H1157-T1161 PolarHBondContact O-N 2.94Å; H1157-T1161 PolarHBondContact O-OG1 3.44Å
1158	H	82.6	Confident	80.4	Confident	1 Å²	1	69.8 Å²	69.8	1%	0.005	36%	0.364	C	S	.	.	H	α-helix	trans	-58.8	-40.9	176.6	-75.6	-78.7	0	0	0	113.2	F1128 L1132 L1139 L1141 I1154 L1155 R1160 T1161 N1162	F1128-H1158 AromaticContact CD1-NE2 3.98Å; F1128-H1158 PolarHBondContact O-CE1 3.3Å; F1128-H1158 PolarHBondContact O-NE2 3.48Å; L1132-H1158 WeakPolarHBondContact CD2-CE1 3.49Å; L1132-H1158 WeakPolarHBondContact CD2-ND1 3.09Å; L1132-H1158 WeakPolarHBondContact CD2-NE2 3.18Å; L1132-H1158 WeakPolarHBondContact CG-CE1 3.36Å; L1132-H1158 VanDerWaalsContact CG-NE2 3.29Å; L1132-H1158 WeakPolarHBondContact CG-NE2 3.49Å; L1139-H1158 HydrophobicContact CD2-CB 4.3Å; L1139-H1158 WeakPolarHBondContact CD2-ND1 3.49Å; L1141-H1158 HydrophobicContact CD1-CB 4.16Å; I1154-H1158 PolarHBondContact O-CD2 3.42Å; I1154-H1158 PolarHBondContact O-N 2.94Å; I1154-H1158 VanDerWaalsContact O-N 3.11Å; L1155-H1158 PolarHBondContact O-N 2.8Å; H1158-R1160 PolarHBondContact O-N 2.72Å; H1158-T1161 PolarHBondContact O-N 3.01Å; H1158-N1162 WeakPolarHBondContact CA-ND2 3Å; H1158-N1162 PolarHBondContact ND1-ND2 3.11Å; H1158-N1162 VanDerWaalsContact O-CB 3.28Å; H1158-N1162 WeakPolarHBondContact O-CB 3.04Å; H1158-N1162 PolarHBondContact O-N 3.3Å; H1158-N1162 PolarHBondContact O-ND2 2.91Å; H1158-N1162 VanDerWaalsContact O-ND2 3.13Å
1159	L	82.7	Confident	81	Confident	42 Å²	42	68.7 Å²	68.7	22%	0.22	35%	0.349	C	S	.	.	H	α-helix	trans	-61.7	-27.8	175.7	-73.9	166.4	0	0	0	113.2	L1110 L1141 L1143 L1147 M1151 L1155 H1157 C1164	L1110-L1159 HydrophobicContact CD2-CD1 4.41Å; L1110-L1159 HydrophobicContact CD2-CD2 4.04Å; L1110-L1159 HydrophobicContact CD2-CG 4.49Å; L1141-L1159 HydrophobicContact CD1-CD2 3.73Å; L1141-L1159 HydrophobicContact CD1-CG 4.11Å; L1143-L1159 HydrophobicContact CD1-CD2 4.38Å; L1143-L1159 HydrophobicContact CD2-CD2 4.03Å; L1147-L1159 HydrophobicContact CD1-CD1 3.6Å; L1147-L1159 HydrophobicContact CD1-CD2 4.12Å; M1151-L1159 HydrophobicContact CE-CD1 3.84Å; L1155-L1159 HydrophobicContact CG-CD1 4.37Å; L1155-L1159 WeakPolarHBondContact O-CG 3.5Å; L1155-L1159 PolarHBondContact O-N 3.26Å; H1157-L1159 VanDerWaalsContact C-N 3.33Å; H1157-L1159 PolarHBondContact O-N 2.74Å; L1159-C1164 PolarHBondContact O-SG 3.5Å
1160	R	78.3	Confident	81.8	Confident	185 Å²	185	67.3 Å²	67.3	70%	0.698	34%	0.34	S	S	*	.	H	α-helix	trans	-86.9	-32	177.2	-77.6	179.4	-72.7	142.1	-4.3	113.4	A1156 H1157 H1158	A1156-R1160 WeakPolarHBondContact O-CG 3.44Å; A1156-R1160 PolarHBondContact O-NE 3.47Å; H1157-R1160 PolarHBondContact O-N 2.71Å; H1158-R1160 PolarHBondContact O-N 2.72Å
1161	T	76.9	Confident	82.5	Confident	65 Å²	65	65 Å²	65	40%	0.399	33%	0.327	S	S	.	.	H	α-helix	trans	-96.7	-23.5	-172.3	53.2	0	0	0	0	114	H1157 H1158	H1157-T1161 WeakPolarHBondContact CE1-CG2 3.48Å; H1157-T1161 PolarHBondContact O-N 2.94Å; H1157-T1161 PolarHBondContact O-OG1 3.44Å; H1158-T1161 PolarHBondContact O-N 3.01Å
1162	N	82.6	Confident	83.3	Confident	30 Å²	30	63.2 Å²	63.2	16%	0.16	32%	0.318	C	S	.	.	S	Bend	trans	-108.1	162.3	-175.2	-63	-72.5	0	0	0	112.4	L1139 H1158 C1164	L1139-N1162 HydrophobicContact CB-CB 4.33Å; L1139-N1162 HydrophobicContact CD2-CB 4.46Å; L1139-N1162 HydrophobicContact CG-CB 4.47Å; L1139-N1162 WeakPolarHBondContact O-CB 2.92Å; H1158-N1162 WeakPolarHBondContact CA-ND2 3Å; H1158-N1162 PolarHBondContact ND1-ND2 3.11Å; H1158-N1162 VanDerWaalsContact O-CB 3.28Å; H1158-N1162 WeakPolarHBondContact O-CB 3.04Å; H1158-N1162 PolarHBondContact O-N 3.3Å; H1158-N1162 PolarHBondContact O-ND2 2.91Å; H1158-N1162 VanDerWaalsContact O-ND2 3.13Å; N1162-C1164 PolarHBondContact O-N 2.86Å
1163	R	85.8	Confident	83.6	Confident	133 Å²	133	63.9 Å²	63.9	50%	0.502	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	116.9	179.9	-172.6	69.4	166.4	-170	-4.8	109.1	V1140 L1141 L1165	V1140-R1163 WeakPolarHBondContact CA-O 3.26Å; L1141-R1163 PolarHBondContact N-O 3.09Å; R1163-L1165 HydrophobicContact CG-CD2 4.32Å
1164	C	88.1	Confident	83.7	Confident	35 Å²	35	64.1 Å²	64.1	24%	0.236	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	129.3	177	-64.8	0	0	0	0	110.2	L1141 L1143 L1159 N1162	L1141-C1164 CarbonylContact O-C 3.52Å; L1141-C1164 VanDerWaalsContact O-CA 3.31Å; L1141-C1164 WeakPolarHBondContact O-CA 3.49Å; L1143-C1164 HydrophobicContact CD1-CB 3.77Å; L1159-C1164 PolarHBondContact O-SG 3.5Å; N1162-C1164 PolarHBondContact O-N 2.86Å
1165	L	91.3	Very high	84	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.005	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	129.1	178.8	-58.1	179	0	0	0	109.2	V1140 L1141 I1142 L1143 R1163 E1169 F1172 K1175 L1176	V1140-L1165 HydrophobicContact CG1-CD1 3.95Å; V1140-L1165 HydrophobicContact CG1-CG 4.33Å; L1141-L1165 PolarHBondContact O-N 2.74Å; I1142-L1165 CarbonylContact C-O 3.5Å; I1142-L1165 WeakPolarHBondContact CA-O 3.48Å; L1143-L1165 PolarHBondContact N-O 3.05Å; R1163-L1165 HydrophobicContact CG-CD2 4.32Å; L1165-E1169 VanDerWaalsContact CA-OE1 3.25Å; L1165-E1169 WeakPolarHBondContact CA-OE1 3.43Å; L1165-E1169 WeakPolarHBondContact CD2-OE1 2.98Å; L1165-F1172 HydrophobicContact CB-CD2 4Å; L1165-F1172 HydrophobicContact CB-CE2 3.8Å; L1165-F1172 HydrophobicContact CD1-CE2 4.46Å; L1165-K1175 HydrophobicContact CD1-CB 4.38Å; L1165-K1175 HydrophobicContact CD2-CB 3.52Å; L1165-K1175 HydrophobicContact CD2-CD 3.96Å; L1165-K1175 HydrophobicContact CD2-CG 4.39Å; L1165-L1176 HydrophobicContact CD1-CB 3.85Å; L1165-L1176 HydrophobicContact CD1-CD1 3.87Å; L1165-L1176 HydrophobicContact CD1-CG 4.5Å
1166	Y	89.8	Confident	84.2	Confident	108 Å²	108	65.2 Å²	65.2	42%	0.424	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	130.1	175.1	-70.2	-87.3	0	0	0	109.3	L1143 N1168 E1169 F1172	L1143-Y1166 HydrophobicContact CB-CD1 3.66Å; L1143-Y1166 HydrophobicContact CB-CE1 3.9Å; L1143-Y1166 HydrophobicContact CB-CG 4.36Å; L1143-Y1166 HydrophobicContact CD1-CD1 4.21Å; L1143-Y1166 HydrophobicContact CD1-CE1 3.93Å; L1143-Y1166 HydrophobicContact CD1-CE2 4.32Å; L1143-Y1166 HydrophobicContact CG-CE1 4.36Å; L1143-Y1166 WeakPolarHBondContact O-CA 3.21Å; Y1166-N1168 PolarHBondContact O-N 3.39Å; Y1166-N1168 VanDerWaalsContact O-N 3.08Å; Y1166-E1169 PolarHBondContact N-OE1 2.9Å; Y1166-E1169 VanDerWaalsContact N-OE1 3.09Å; Y1166-E1169 WeakPolarHBondContact O-CB 3.41Å; Y1166-E1169 WeakPolarHBondContact O-CG 3.33Å; Y1166-E1169 PolarHBondContact O-N 3.13Å; Y1166-F1172 VanDerWaalsContact O-CD2 3.3Å; Y1166-F1172 WeakPolarHBondContact O-CD2 3.3Å
1167	W	85.7	Confident	84.2	Confident	49 Å²	49	69.6 Å²	69.6	19%	0.186	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-36.6	-175.3	-176.2	-100.7	0	0	0	113.6	W1061 Q1065 L1066 I1142 L1143 F1172 W1173	W1061-W1167 AromaticContact CH2-CD2 3.61Å; W1061-W1167 HydrophobicContact CH2-CD2 3.61Å; W1061-W1167 AromaticContact CH2-CE2 3.63Å; W1061-W1167 AromaticContact CH2-CE3 3.8Å; W1061-W1167 HydrophobicContact CH2-CE3 3.8Å; W1061-W1167 HydrophobicContact CH2-CG 4.16Å; W1061-W1167 HydrophobicContact CH2-CH2 4.03Å; W1061-W1167 AromaticContact CH2-CZ2 3.86Å; W1061-W1167 HydrophobicContact CH2-CZ2 3.86Å; W1061-W1167 AromaticContact CH2-CZ3 3.99Å; W1061-W1167 HydrophobicContact CH2-CZ3 3.99Å; W1061-W1167 AromaticContact CZ2-CD2 3.95Å; W1061-W1167 HydrophobicContact CZ2-CD2 3.95Å; W1061-W1167 AromaticContact CZ2-CE2 3.48Å; W1061-W1167 VanDerWaalsContact CZ2-CE2 3.48Å; W1061-W1167 HydrophobicContact CZ2-CE3 4.49Å; W1061-W1167 HydrophobicContact CZ2-CG 4.41Å; W1061-W1167 HydrophobicContact CZ2-CH2 4.22Å; W1061-W1167 AromaticContact CZ2-CZ2 3.65Å; W1061-W1167 HydrophobicContact CZ2-CZ2 3.65Å; W1061-W1167 AromaticContact CZ2-NE1 3.69Å; Q1065-W1167 HydrophobicContact CB-CH2 3.98Å; Q1065-W1167 HydrophobicContact CB-CZ2 4.01Å; L1066-W1167 HydrophobicContact CB-CH2 4.45Å; L1066-W1167 HydrophobicContact CB-CZ3 4.34Å; L1066-W1167 HydrophobicContact CD1-CZ3 4.19Å; I1142-W1167 HydrophobicContact CG2-CE3 4.18Å; L1143-W1167 PolarHBondContact O-N 2.93Å; W1167-F1172 HydrophobicContact CD2-CE1 4.36Å; W1167-F1172 HydrophobicContact CD2-CZ 4.45Å; W1167-F1172 HydrophobicContact CE3-CD1 4.26Å; W1167-F1172 AromaticContact CE3-CE1 3.48Å; W1167-F1172 HydrophobicContact CE3-CE1 3.48Å; W1167-F1172 VanDerWaalsContact CE3-CE1 3.48Å; W1167-F1172 HydrophobicContact CE3-CE2 4.12Å; W1167-F1172 AromaticContact CE3-CZ 3.39Å; W1167-F1172 HydrophobicContact CE3-CZ 3.39Å; W1167-F1172 HydrophobicContact CH2-CE1 4.28Å; W1167-F1172 HydrophobicContact CZ3-CD1 4.42Å; W1167-F1172 AromaticContact CZ3-CE1 3.44Å; W1167-F1172 HydrophobicContact CZ3-CE1 3.44Å; W1167-F1172 VanDerWaalsContact CZ3-CE1 3.44Å; W1167-F1172 AromaticContact CZ3-CZ 3.63Å; W1167-F1172 HydrophobicContact CZ3-CZ 3.63Å; W1167-W1173 AromaticContact CH2-CH2 3.9Å; W1167-W1173 HydrophobicContact CH2-CH2 3.9Å; W1167-W1173 AromaticContact CH2-CZ2 3.61Å; W1167-W1173 HydrophobicContact CH2-CZ2 3.61Å; W1167-W1173 HydrophobicContact CZ2-CZ2 4.22Å; W1167-W1173 HydrophobicContact CZ3-CH2 4.28Å; W1167-W1173 HydrophobicContact CZ3-CZ2 4.18Å
1168	N	82.7	Confident	83.9	Confident	138 Å²	138	71.7 Å²	71.7	74%	0.738	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	9.6	-179	-64.7	-28.2	0	0	0	114.1	Y1166	Y1166-N1168 PolarHBondContact O-N 3.39Å; Y1166-N1168 VanDerWaalsContact O-N 3.08Å
1169	E	82.9	Confident	84	Confident	37 Å²	37	72 Å²	72	17%	0.173	34%	0.34	C	S	.	.	S	Bend	trans	-76	149.7	178.5	79.2	-171.1	146.9	0	0	112.6	L1165 Y1166 L1171 F1172 K1175	L1165-E1169 VanDerWaalsContact CA-OE1 3.25Å; L1165-E1169 WeakPolarHBondContact CA-OE1 3.43Å; L1165-E1169 WeakPolarHBondContact CD2-OE1 2.98Å; Y1166-E1169 PolarHBondContact N-OE1 2.9Å; Y1166-E1169 VanDerWaalsContact N-OE1 3.09Å; Y1166-E1169 WeakPolarHBondContact O-CB 3.41Å; Y1166-E1169 WeakPolarHBondContact O-CG 3.33Å; Y1166-E1169 PolarHBondContact O-N 3.13Å; E1169-L1171 PolarHBondContact O-N 3.5Å; E1169-F1172 HydrophobicContact CG-CB 4.11Å; E1169-F1172 PolarHBondContact O-N 3.1Å; E1169-K1175 VanDerWaalsContact CD-NZ 3.28Å; E1169-K1175 HydrophobicContact CG-CD 4.43Å; E1169-K1175 IonicContact OE1-NZ 2.7Å; E1169-K1175 IonicContact OE2-NZ 3.28Å; E1169-K1175 PolarHBondContact OE2-NZ 3.42Å
1170	P	79.7	Confident	83.9	Confident	107 Å²	107	70.9 Å²	70.9	70%	0.695	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	134.1	170.9	-20.8	31.4	0	0	0	110.6	F1172	P1170-F1172 VanDerWaalsContact C-N 3.27Å; P1170-F1172 PolarHBondContact O-N 3.36Å
1171	L	83.5	Confident	83.6	Confident	107 Å²	107	63.1 Å²	63.1	56%	0.56	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	24	178.3	-44.9	174	0	0	0	114.4	E1169 W1173 E1174 K1175	E1169-L1171 PolarHBondContact O-N 3.5Å; L1171-W1173 VanDerWaalsContact C-N 3.27Å; L1171-W1173 PolarHBondContact O-N 3.1Å; L1171-E1174 HydrophobicContact CB-CB 4.26Å; L1171-E1174 HydrophobicContact CB-CG 4.46Å; L1171-E1174 WeakPolarHBondContact CD2-OE2 3.38Å; L1171-E1174 PolarHBondContact O-N 2.94Å; L1171-K1175 PolarHBondContact O-N 3.18Å
1172	F	89.8	Confident	82.7	Confident	6 Å²	6	66.4 Å²	66.4	3%	0.026	32%	0.319	C	S	.	.	H	α-helix	trans	-42.7	-50.9	176.1	169.6	-99.8	0	0	0	113.2	I1142 L1165 Y1166 W1167 E1169 P1170 E1174 K1175 L1176	I1142-F1172 HydrophobicContact CD1-CZ 4.05Å; I1142-F1172 HydrophobicContact CG1-CE2 4.25Å; I1142-F1172 HydrophobicContact CG1-CZ 4.29Å; I1142-F1172 HydrophobicContact CG2-CE2 3.95Å; I1142-F1172 HydrophobicContact CG2-CZ 4.04Å; L1165-F1172 HydrophobicContact CB-CD2 4Å; L1165-F1172 HydrophobicContact CB-CE2 3.8Å; L1165-F1172 HydrophobicContact CD1-CE2 4.46Å; Y1166-F1172 VanDerWaalsContact O-CD2 3.3Å; Y1166-F1172 WeakPolarHBondContact O-CD2 3.3Å; W1167-F1172 HydrophobicContact CD2-CE1 4.36Å; W1167-F1172 HydrophobicContact CD2-CZ 4.45Å; W1167-F1172 HydrophobicContact CE3-CD1 4.26Å; W1167-F1172 AromaticContact CE3-CE1 3.48Å; W1167-F1172 HydrophobicContact CE3-CE1 3.48Å; W1167-F1172 VanDerWaalsContact CE3-CE1 3.48Å; W1167-F1172 HydrophobicContact CE3-CE2 4.12Å; W1167-F1172 AromaticContact CE3-CZ 3.39Å; W1167-F1172 HydrophobicContact CE3-CZ 3.39Å; W1167-F1172 HydrophobicContact CH2-CE1 4.28Å; W1167-F1172 HydrophobicContact CZ3-CD1 4.42Å; W1167-F1172 AromaticContact CZ3-CE1 3.44Å; W1167-F1172 HydrophobicContact CZ3-CE1 3.44Å; W1167-F1172 VanDerWaalsContact CZ3-CE1 3.44Å; W1167-F1172 AromaticContact CZ3-CZ 3.63Å; W1167-F1172 HydrophobicContact CZ3-CZ 3.63Å; E1169-F1172 HydrophobicContact CG-CB 4.11Å; E1169-F1172 PolarHBondContact O-N 3.1Å; P1170-F1172 VanDerWaalsContact C-N 3.27Å; P1170-F1172 PolarHBondContact O-N 3.36Å; F1172-E1174 PolarHBondContact O-N 3.31Å; F1172-K1175 PolarHBondContact O-N 3.46Å; F1172-L1176 HydrophobicContact CE1-CD2 4.16Å; F1172-L1176 HydrophobicContact CZ-CD2 4.15Å; F1172-L1176 WeakPolarHBondContact O-CB 3.3Å; F1172-L1176 PolarHBondContact O-N 3.18Å
1173	W	86.1	Confident	81.1	Confident	56 Å²	56	71.1 Å²	71.1	21%	0.212	34%	0.34	C	S	.	.	H	α-helix	trans	-64.7	-36.6	-177.6	-69.2	103.2	0	0	0	113.7	Q1065 L1066 R1069 W1167 L1171 L1176 R1177	Q1065-W1173 VanDerWaalsContact O-CH2 3.27Å; Q1065-W1173 WeakPolarHBondContact O-CH2 3.47Å; L1066-W1173 HydrophobicContact CD1-CH2 3.97Å; L1066-W1173 HydrophobicContact CD1-CZ3 3.92Å; R1069-W1173 HydrophobicContact CB-CH2 4.01Å; R1069-W1173 HydrophobicContact CB-CZ3 4.12Å; R1069-W1173 HydrophobicContact CG-CE3 4.38Å; R1069-W1173 HydrophobicContact CG-CH2 4.16Å; R1069-W1173 HydrophobicContact CG-CZ3 4.02Å; R1069-W1173 VanDerWaalsContact NH1-CE2 3.34Å; W1167-W1173 AromaticContact CH2-CH2 3.9Å; W1167-W1173 HydrophobicContact CH2-CH2 3.9Å; W1167-W1173 AromaticContact CH2-CZ2 3.61Å; W1167-W1173 HydrophobicContact CH2-CZ2 3.61Å; W1167-W1173 HydrophobicContact CZ2-CZ2 4.22Å; W1167-W1173 HydrophobicContact CZ3-CH2 4.28Å; W1167-W1173 HydrophobicContact CZ3-CZ2 4.18Å; L1171-W1173 VanDerWaalsContact C-N 3.27Å; L1171-W1173 PolarHBondContact O-N 3.1Å; W1173-L1176 HydrophobicContact CE3-CD2 4.1Å; W1173-L1176 HydrophobicContact CZ3-CD2 3.98Å; W1173-L1176 PolarHBondContact O-N 3.24Å; W1173-R1177 WeakPolarHBondContact O-CB 3.26Å; W1173-R1177 PolarHBondContact O-N 3.37Å
1174	E	80.5	Confident	79.1	Confident	107 Å²	107	70.8 Å²	70.8	50%	0.5	34%	0.343	S	S	.	.	H	α-helix	trans	-67.9	-45.4	176.3	-62.2	175.8	-174.6	0	0	110.1	L1171 F1172 L1176 R1177 D1178	L1171-E1174 HydrophobicContact CB-CB 4.26Å; L1171-E1174 HydrophobicContact CB-CG 4.46Å; L1171-E1174 WeakPolarHBondContact CD2-OE2 3.38Å; L1171-E1174 PolarHBondContact O-N 2.94Å; F1172-E1174 PolarHBondContact O-N 3.31Å; E1174-L1176 VanDerWaalsContact C-N 3.3Å; E1174-L1176 PolarHBondContact O-N 3.45Å; E1174-R1177 PolarHBondContact O-N 3.16Å; E1174-D1178 PolarHBondContact O-N 3Å
1175	K	86.4	Confident	76.4	Confident	62 Å²	62	73.5 Å²	73.5	27%	0.27	37%	0.367	S	S	.	.	H	α-helix	trans	-64.7	-34.6	176.8	-62.6	-179.3	-171.7	-175.4	0	112.7	L1165 E1169 L1171 F1172 S1179	L1165-K1175 HydrophobicContact CD1-CB 4.38Å; L1165-K1175 HydrophobicContact CD2-CB 3.52Å; L1165-K1175 HydrophobicContact CD2-CD 3.96Å; L1165-K1175 HydrophobicContact CD2-CG 4.39Å; E1169-K1175 VanDerWaalsContact CD-NZ 3.28Å; E1169-K1175 HydrophobicContact CG-CD 4.43Å; E1169-K1175 IonicContact OE1-NZ 2.7Å; E1169-K1175 IonicContact OE2-NZ 3.28Å; E1169-K1175 PolarHBondContact OE2-NZ 3.42Å; L1171-K1175 PolarHBondContact O-N 3.18Å; F1172-K1175 PolarHBondContact O-N 3.46Å; K1175-S1179 PolarHBondContact O-N 3.34Å; K1175-S1179 PolarHBondContact O-OG 2.04Å
1176	L	88.5	Confident	73.5	Confident	0 Å²	0	76.4 Å²	76.4	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-67.5	-43.1	174.5	-178.2	65.4	0	0	0	110.6	L1066 L1070 I1107 V1140 I1142 L1165 F1172 W1173 E1174 S1179 V1180	L1066-L1176 HydrophobicContact CD1-CD2 3.43Å; L1066-L1176 VanDerWaalsContact CD1-CD2 3.43Å; L1070-L1176 HydrophobicContact CD1-CD2 4.43Å; L1070-L1176 HydrophobicContact CD2-CD2 4.08Å; I1107-L1176 HydrophobicContact CD1-CD1 4.04Å; V1140-L1176 HydrophobicContact CG1-CD1 4.41Å; I1142-L1176 HydrophobicContact CD1-CD1 3.99Å; L1165-L1176 HydrophobicContact CD1-CB 3.85Å; L1165-L1176 HydrophobicContact CD1-CD1 3.87Å; L1165-L1176 HydrophobicContact CD1-CG 4.5Å; F1172-L1176 HydrophobicContact CE1-CD2 4.16Å; F1172-L1176 HydrophobicContact CZ-CD2 4.15Å; F1172-L1176 WeakPolarHBondContact O-CB 3.3Å; F1172-L1176 PolarHBondContact O-N 3.18Å; W1173-L1176 HydrophobicContact CE3-CD2 4.1Å; W1173-L1176 HydrophobicContact CZ3-CD2 3.98Å; W1173-L1176 PolarHBondContact O-N 3.24Å; E1174-L1176 VanDerWaalsContact C-N 3.3Å; E1174-L1176 PolarHBondContact O-N 3.45Å; L1176-S1179 CarbonylContact O-C 3.58Å; L1176-S1179 WeakPolarHBondContact O-CA 3.38Å; L1176-S1179 VanDerWaalsContact O-CB 3.26Å; L1176-S1179 WeakPolarHBondContact O-CB 3.13Å; L1176-S1179 PolarHBondContact O-N 2.7Å; L1176-V1180 PolarHBondContact O-N 2.04Å
1177	R	81.3	Confident	70.6	Confident	119 Å²	119	78.1 Å²	78.1	45%	0.449	40%	0.397	S	S	.	.	H	α-helix	trans	-62.3	-43	176.5	-170	-176.4	-74.1	-163.4	-4.4	112.2	E1073 W1173 E1174 S1179 V1180	E1073-R1177 IonicContact OE2-CZ 2.74Å; E1073-R1177 IonicContact OE2-NE 3.19Å; E1073-R1177 IonicContact OE2-NH2 2.75Å; E1073-R1177 PolarHBondContact OE2-NH2 3.27Å; W1173-R1177 WeakPolarHBondContact O-CB 3.26Å; W1173-R1177 PolarHBondContact O-N 3.37Å; E1174-R1177 PolarHBondContact O-N 3.16Å; R1177-S1179 PolarHBondContact O-N 3.08Å; R1177-S1179 VanDerWaalsContact O-N 3.07Å; R1177-V1180 WeakPolarHBondContact O-CB 3.1Å; R1177-V1180 PolarHBondContact O-N 3.21Å
1178	D	77.4	Confident	67.8	Low	118 Å²	118	81.9 Å²	81.9	63%	0.631	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-22.4	171.2	-73.1	-7.3	0	0	0	112.8	E1174	E1174-D1178 PolarHBondContact O-N 3Å
1179	S	83.1	Confident	64.9	Low	8 Å²	8	79.1 Å²	79.1	6%	0.056	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-6.6	179.7	-50.9	0	0	0	0	112.7	R1105 K1175 L1176 R1177	R1105-S1179 PolarHBondContact NE-O 3.01Å; R1105-S1179 PolarHBondContact NH2-O 3.46Å; K1175-S1179 PolarHBondContact O-N 3.34Å; K1175-S1179 PolarHBondContact O-OG 2.04Å; L1176-S1179 CarbonylContact O-C 3.58Å; L1176-S1179 WeakPolarHBondContact O-CA 3.38Å; L1176-S1179 VanDerWaalsContact O-CB 3.26Å; L1176-S1179 WeakPolarHBondContact O-CB 3.13Å; L1176-S1179 PolarHBondContact O-N 2.7Å; R1177-S1179 PolarHBondContact O-N 3.08Å; R1177-S1179 VanDerWaalsContact O-N 3.07Å
1180	V	82.2	Confident	62.1	Low	17 Å²	17	80.3 Å²	80.3	10%	0.103	42%	0.419	C	S	.	.	S	Bend	trans	-83.1	142.6	175.3	177.2	0	0	0	0	110.1	L1050 L1074 L1176 R1177	L1050-V1180 HydrophobicContact CD1-CG1 3.95Å; L1050-V1180 HydrophobicContact CD1-CG2 4.06Å; L1050-V1180 HydrophobicContact CD2-CG1 4.28Å; L1050-V1180 HydrophobicContact CD2-CG2 4.13Å; L1050-V1180 HydrophobicContact CG-CG1 4.29Å; L1074-V1180 HydrophobicContact CD1-CB 4.46Å; L1074-V1180 HydrophobicContact CD1-CG1 4.01Å; L1074-V1180 HydrophobicContact CD1-CG2 3.99Å; L1176-V1180 PolarHBondContact O-N 2.04Å; R1177-V1180 WeakPolarHBondContact O-CB 3.1Å; R1177-V1180 PolarHBondContact O-N 3.21Å
1181	P	71.4	Confident	59.5	Low	22 Å²	22	78 Å²	78	14%	0.143	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-70	154.6	179.4	26.8	-34.1	0	0	0	114.4	D1049 H1077 Q1104 R1105	D1049-P1181 HydrophobicContact CB-CG 4.43Å; H1077-P1181 PolarHBondContact NE2-O 3.18Å; Q1104-P1181 HydrophobicContact CB-CB 4.13Å; Q1104-P1181 HydrophobicContact CB-CG 3.76Å; Q1104-P1181 VanDerWaalsContact OE1-CG 3.29Å; R1105-P1181 HydrophobicContact CB-CG 4.33Å
1182	E	58.8	Low	56.7	Low	134 Å²	134	78.7 Å²	78.7	63%	0.626	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-69.3	141.8	177.3	-73.3	-173.2	159.2	0	0	111.7	R630 F1184	R630-E1182 IonicContact CZ-OE1 2.8Å; R630-E1182 IonicContact NH1-OE1 3.36Å; R630-E1182 PolarHBondContact NH1-OE1 3.23Å; R630-E1182 VanDerWaalsContact NH1-OE1 3.13Å; R630-E1182 IonicContact NH2-OE1 2.71Å; E1182-F1184 PolarHBondContact O-N 2.89Å
1183	Q	49	Very low	53.7	Low	129 Å²	129	81.9 Å²	81.9	60%	0.603	43%	0.429	S	S	*	.			trans	-69	111.1	-178.6	-175.6	-177	10.1	0	0	110.9
1184	F	42	Very low	50.9	Low	127 Å²	127	81 Å²	81	56%	0.557	43%	0.432	S	S	*	.			trans	-77.7	134.6	160.7	-73.7	-80.5	0	0	0	108.9	A1043 E1182 H1186	A1043-F1184 HydrophobicContact CB-CB 4.45Å; A1043-F1184 HydrophobicContact CB-CG 4.43Å; E1182-F1184 PolarHBondContact O-N 2.89Å; F1184-H1186 VanDerWaalsContact C-N 3.31Å; F1184-H1186 PolarHBondContact O-N 2.93Å
1185	A	31.6	Very low	48.2	Very low	91 Å²	91	78.9 Å²	78.9	75%	0.752	42%	0.424	S	S	*	.			trans	-59.2	99	167.9	0	0	0	0	0	107.8	D1187	A1185-D1187 PolarHBondContact O-N 2.79Å
1186	H	32.2	Very low	45.4	Very low	62 Å²	62	82.1 Å²	82.1	29%	0.287	44%	0.435	S	S	.	.			trans	-64.9	90.7	167.2	-69.9	-70.4	0	0	0	106.6	D1049 F1184 L1188	D1049-H1186 IonicContact OD1-NE2 2.97Å; F1184-H1186 VanDerWaalsContact C-N 3.31Å; F1184-H1186 PolarHBondContact O-N 2.93Å; H1186-L1188 PolarHBondContact O-N 3.39Å
1187	D	27	Very low	42.4	Very low	144 Å²	144	84.6 Å²	84.6	77%	0.77	46%	0.455	S	S	*	.			trans	-48.3	119.9	153.7	-83.2	-28.1	0	0	0	105.6	A1185 V1189	A1185-D1187 PolarHBondContact O-N 2.79Å; D1187-V1189 VanDerWaalsContact C-N 3.3Å; D1187-V1189 PolarHBondContact O-N 3.18Å
1188	L	27.7	Very low	39.7	Very low	128 Å²	128	85.9 Å²	85.9	67%	0.67	47%	0.471	S	S	*	.			trans	-51.2	92.2	-170.7	-65.8	151.8	0	0	0	109.1	H1186 P1190	H1186-L1188 PolarHBondContact O-N 3.39Å; L1188-P1190 WeakPolarHBondContact O-CD 3.17Å
1189	V	22.8	Very low	37.2	Very low	80 Å²	80	87.7 Å²	87.7	49%	0.485	48%	0.478	S	S	.	.			trans	-81.7	99.6	162.5	-176.1	0	0	0	0	103.6	D1187 S1191 N1195	D1187-V1189 VanDerWaalsContact C-N 3.3Å; D1187-V1189 PolarHBondContact O-N 3.18Å; V1189-S1191 PolarHBondContact O-N 3.35Å; V1189-N1195 WeakPolarHBondContact CG1-ND2 3.17Å
1190	P	23.4	Very low	34.5	Very low	62 Å²	62	95 Å²	95	40%	0.403	51%	0.505	S	S	.	.			trans	-64.2	140.8	176.4	37	-38.5	0	0	0	105.7	L1188 S1194 N1195	L1188-P1190 WeakPolarHBondContact O-CD 3.17Å; P1190-S1194 WeakPolarHBondContact CB-OG 3.24Å; P1190-S1194 PolarHBondContact O-OG 3.11Å; P1190-N1195 WeakPolarHBondContact CD-OD1 3.42Å; P1190-N1195 WeakPolarHBondContact CG-OD1 3.42Å
1191	S	24.2	Very low	31.7	Very low	60 Å²	60	96.3 Å²	96.3	42%	0.42	52%	0.523	S	S	.	.			trans	-31.7	149	-172.4	68.1	0	0	0	0	113.9	V1189 S1193 S1194 N1195	V1189-S1191 PolarHBondContact O-N 3.35Å; S1191-S1193 CarbonylContact O-C 3.56Å; S1191-S1193 PolarHBondContact O-N 3.22Å; S1191-S1193 PolarHBondContact OG-OG 3.01Å; S1191-S1194 PolarHBondContact N-OG 3.3Å; S1191-S1194 VanDerWaalsContact N-OG 3.16Å; S1191-S1194 PolarHBondContact O-N 3.25Å; S1191-S1194 PolarHBondContact O-OG 3.08Å; S1191-S1194 PolarHBondContact OG-OG 3.28Å; S1191-N1195 PolarHBondContact O-N 3.09Å
1192	E	24.6	Very low	29.5	Very low	121 Å²	121	98.8 Å²	98.8	57%	0.565	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	-15	175.5	-70.9	177.4	159.5	0	0	113.9	Y1196	E1192-Y1196 VanDerWaalsContact O-CD2 3.28Å; E1192-Y1196 WeakPolarHBondContact O-CD2 3.05Å
1193	S	28.4	Very low	27.8	Very low	72 Å²	72	98.9 Å²	98.9	50%	0.503	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-33.2	169.6	74.2	0	0	0	0	115	S1191	S1191-S1193 CarbonylContact O-C 3.56Å; S1191-S1193 PolarHBondContact O-N 3.22Å; S1191-S1193 PolarHBondContact OG-OG 3.01Å
1194	S	26.1	Very low	26.7	Very low	39 Å²	39	96.2 Å²	96.2	27%	0.273	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-29.8	-178.2	42.2	0	0	0	0	114.1	P1190 S1191 Y1196 A1197	P1190-S1194 WeakPolarHBondContact CB-OG 3.24Å; P1190-S1194 PolarHBondContact O-OG 3.11Å; S1191-S1194 PolarHBondContact N-OG 3.3Å; S1191-S1194 VanDerWaalsContact N-OG 3.16Å; S1191-S1194 PolarHBondContact O-N 3.25Å; S1191-S1194 PolarHBondContact O-OG 3.08Å; S1191-S1194 PolarHBondContact OG-OG 3.28Å; S1194-Y1196 PolarHBondContact O-N 3.36Å; S1194-A1197 PolarHBondContact O-N 2.99Å
1195	N	23.6	Very low	25.8	Very low	62 Å²	62	93.1 Å²	93.1	33%	0.332	53%	0.526	S	S	.	.	H	α-helix	trans	-63.9	-24.5	175.8	-86	-15.2	0	0	0	112.6	V1189 P1190 S1191 M1199	V1189-N1195 WeakPolarHBondContact CG1-ND2 3.17Å; P1190-N1195 WeakPolarHBondContact CD-OD1 3.42Å; P1190-N1195 WeakPolarHBondContact CG-OD1 3.42Å; S1191-N1195 PolarHBondContact O-N 3.09Å; N1195-M1199 WeakPolarHBondContact O-CB 3.48Å; N1195-M1199 PolarHBondContact O-N 3.34Å
1196	Y	28.1	Very low	25.4	Very low	129 Å²	129	93.3 Å²	93.3	51%	0.506	52%	0.522	S	S	.	.	H	α-helix	trans	-78.1	-25.1	178	-87.6	-88.1	0	0	0	114.1	E1192 S1194 D1198 Y1200	E1192-Y1196 VanDerWaalsContact O-CD2 3.28Å; E1192-Y1196 WeakPolarHBondContact O-CD2 3.05Å; S1194-Y1196 PolarHBondContact O-N 3.36Å; Y1196-D1198 VanDerWaalsContact C-N 3.29Å; Y1196-D1198 PolarHBondContact O-N 3.25Å; Y1196-Y1200 HydrophobicContact CD1-CD2 4.04Å; Y1196-Y1200 HydrophobicContact CE1-CD2 4.28Å; Y1196-Y1200 HydrophobicContact CE1-CE2 4.31Å; Y1196-Y1200 PolarHBondContact O-N 2.77Å
1197	A	25.6	Very low	25.2	Very low	52 Å²	52	98.4 Å²	98.4	43%	0.43	55%	0.545	S	S	.	.	H	α-helix	trans	-67.4	-32.9	176.5	0	0	0	0	0	111.9	S1194	S1194-A1197 PolarHBondContact O-N 2.99Å
1198	D	25.5	Very low	25.1	Very low	146 Å²	146	99 Å²	99	78%	0.781	54%	0.541	S	S	*	.	H	α-helix	trans	-95.3	-34.4	-180	-73.8	-22.4	0	0	0	113.3	Y1196	Y1196-D1198 VanDerWaalsContact C-N 3.29Å; Y1196-D1198 PolarHBondContact O-N 3.25Å
1199	M	23.8	Very low	25	Very low	156 Å²	156	99.7 Å²	99.7	77%	0.768	55%	0.551	S	S	*	*	H	α-helix	trans	-76.5	-27.7	-177.6	-153.1	178.2	-139	0	0	112.9	N1195	N1195-M1199 WeakPolarHBondContact O-CB 3.48Å; N1195-M1199 PolarHBondContact O-N 3.34Å
1200	Y	26.5	Very low	25.1	Very low	161 Å²	161	100.7 Å²	100.7	63%	0.631	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.3	77.7	165.5	-70.2	-82.9	0	0	0	107.8	Y1196 T1202	Y1196-Y1200 HydrophobicContact CD1-CD2 4.04Å; Y1196-Y1200 HydrophobicContact CE1-CD2 4.28Å; Y1196-Y1200 HydrophobicContact CE1-CE2 4.31Å; Y1196-Y1200 PolarHBondContact O-N 2.77Å; Y1200-T1202 PolarHBondContact O-N 2.65Å
1201	G	23.5	Very low	25.2	Very low	46 Å²	46	102.7 Å²	102.7	47%	0.474	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-40.1	109	177.5	0	0	0	0	0	110.6	I1203	G1201-I1203 PolarHBondContact O-N 3.33Å
1202	T	25.3	Very low	25.2	Very low	74 Å²	74	105.1 Å²	105.1	45%	0.454	57%	0.57	S	S	.	*			trans	-70.3	56.7	156.4	30.1	0	0	0	0	107.6	Y1200 V1204	Y1200-T1202 PolarHBondContact O-N 2.65Å; T1202-V1204 PolarHBondContact O-N 3.05Å
1203	I	23.6	Very low	25.3	Very low	136 Å²	136	104.2 Å²	104.2	70%	0.697	57%	0.57	S	S	*	*			trans	-66.7	88	152.2	-58.6	171.5	0	0	0	102.8	G1201 P1205	G1201-I1203 PolarHBondContact O-N 3.33Å; I1203-P1205 VanDerWaalsContact C-N 3.28Å; I1203-P1205 HydrophobicContact CG2-CB 4.39Å; I1203-P1205 HydrophobicContact CG2-CG 4.33Å; I1203-P1205 WeakPolarHBondContact O-CD 3.17Å; I1203-P1205 VanDerWaalsContact O-N 3.12Å
1204	V	24.6	Very low	25.1	Very low	73 Å²	73	106.2 Å²	106.2	44%	0.442	57%	0.574	S	S	.	*			trans	-60.9	106.5	146.2	179.9	0	0	0	0	102.9	T1202 S1206	T1202-V1204 PolarHBondContact O-N 3.05Å; V1204-S1206 PolarHBondContact O-N 3.19Å
1205	P	23.5	Very low	25	Very low	62 Å²	62	110.7 Å²	110.7	40%	0.403	59%	0.594	S	S	.	*			trans	-58.6	130.4	-176.1	-19.2	33.3	0	0	0	107.1	I1203 H1207 F1208	I1203-P1205 VanDerWaalsContact C-N 3.28Å; I1203-P1205 HydrophobicContact CG2-CB 4.39Å; I1203-P1205 HydrophobicContact CG2-CG 4.33Å; I1203-P1205 WeakPolarHBondContact O-CD 3.17Å; I1203-P1205 VanDerWaalsContact O-N 3.12Å; P1205-H1207 PolarHBondContact O-N 2.96Å; P1205-F1208 PolarHBondContact O-N 3.33Å
1206	S	24	Very low	25.1	Very low	94 Å²	94	114.1 Å²	114.1	66%	0.657	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-56.1	-13.5	-176.1	44.1	0	0	0	0	113.9	V1204 F1208	V1204-S1206 PolarHBondContact O-N 3.19Å; S1206-F1208 VanDerWaalsContact C-N 3.31Å; S1206-F1208 PolarHBondContact O-N 2.64Å
1207	H	27.2	Very low	24.9	Very low	170 Å²	170	113 Å²	113	79%	0.787	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-79	-2.9	173.7	-58.5	-63.9	0	0	0	115.1	P1205	P1205-H1207 PolarHBondContact O-N 2.96Å
1208	F	26.1	Very low	24.8	Very low	155 Å²	155	118.1 Å²	118.1	68%	0.68	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-111.4	7	174.4	-81.7	-75.2	0	0	0	114.3	P1205 S1206	P1205-F1208 PolarHBondContact O-N 3.33Å; S1206-F1208 VanDerWaalsContact C-N 3.31Å; S1206-F1208 PolarHBondContact O-N 2.64Å
1209	V	24.3	Very low	24.8	Very low	144 Å²	144	115.5 Å²	115.5	87%	0.873	62%	0.624	S	S	*	*			trans	-94.2	0	158.8	-178.6	0	0	0	0	107.2

Retrieved 1,209 of 1,209 residues in 1336.7 ms (Link to these results)

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