A0A093HE74_STRCA Loading...

Semaphorin-5B

AlphaFold DB , UniProt , Accession A0A093HE74, Species STRCA (Struthio camelus australis), Gene n/a, Length 1,092 aa.

						>A0A093HE74_STRCA|A0A093HE74
MVVSRLKAISLSLPSLFLLAFHLSASQNVPEYSEAEHQQCVRKEHPTIAFEDLKPWVSNFTYPGVHDFSQLALDANRNQLIVGARNYLFRLSLHNVSLIQATAWGSDEDTRRSCQSKGKTEEECQNYVRVLIVYGKKVFTCGTNAFSPMCSSRQVGNLSKIIDRINGVARCPYDPRHNSTAVITSRGELYAATVIDFSGRDPAIYRSLGNVPPLRTAQYNSKWLNEPNFIAAYDIGLFTYFFFRENAVEHDCGKTVYSRVARVCKNDIGGRFLLEDTWTTFMKARLNCSRAGEIPFYYNELQSTFYLPEQDLIYGVFTTNVNSIAASAVCAFNLSAITQAFNGPFRYQENPRSAWLPTLNPIPNFQCGTLNDDGPNENLTERILQDAQRLFLMNDVVQPVTVDPYVTQDSIRFSKLVVDIVQGKDTLYHVMYIGTEYGTILKALSTTNRSLRSCYLEEMQILPDGQQEPIKSLQILHSDRSLFVGLNNGVLKIPLERCSMYRTEGECLGARDPYCGWDSKQKRCTTIEDSSNMSLWTQNITECPVKNLTTNGRLGPWSPWQLCEHSDGDSTGSCMCRSRSCDSPRPRCGGRACEGARIEVANCSRNGAWTPWSSWAPCSTSCGIGFQVRQRSCSNPAPRYGGRVCVGQSREERFCNENSPCPLPIFWSSWGPWNKCSVNCGGGIHSRQRSCENGNTCPGCAVEYKTCNPESCPEVRRNTPWTPWMPVNITQNGARQEQRFRYTCRAQLSDPHELQFGRKKTESRFCPNDGSAVCDTDSLVDDLLKTGKTSARIINGGWSFWGAWSSCSRDCELGFRIRKRTCTNPEPKNGGLPCVGSAMEYQDCNPHPCPVKGSWSCWTPWSQCSATCGGGHYQRTRTCTNPAPSSGEDICIGLHTEEALCNTHSCEGGWSEWSEWSLCNEEGIQYRSRYCEVHSPDSSQCIGNSTQYQDCLYNEIPVILPASSIDESTNCGGFSLIHLIATGISCFFGSSLLTFVIYVYCQRCQRQSQESTVIHPTTPNHLHYKGNTTPKNEKYTPMEFKTLNKNNLIPDDRTNFYPLQQTNVYTTTYYPSTLNKYDYRPEASPGRTFTNS
					

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(Predicted Aligned Error values between residue pairs)

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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	31.5	Very low	28	Very low	239 Å²	239	160.5 Å²	160.5	100%	1.177	87%	0.866	S	S	*	*				0	167.7	0	-89.7	-175.7	171.4	0	0	109
2	V	28.2	Very low	28.2	Very low	143 Å²	143	155.8 Å²	155.8	87%	0.867	86%	0.855	S	S	*	*			trans	71.5	137.4	-171.2	-169.5	0	0	0	0	113.3
3	V	28.7	Very low	28.3	Very low	133 Å²	133	156.2 Å²	156.2	81%	0.806	85%	0.854	S	S	*	*			trans	-149	122	-169.3	173.2	0	0	0	0	111
4	S	28.5	Very low	28.8	Very low	105 Å²	105	153.3 Å²	153.3	73%	0.734	85%	0.847	S	S	*	*			trans	-167.6	110.4	158.9	36.3	0	0	0	0	108.6
5	R	30.1	Very low	28.7	Very low	235 Å²	235	151.1 Å²	151.1	89%	0.887	85%	0.846	S	S	*	*				76.8	102.7	75.5	-82.8	-167.6	172.6	-159.8	1.1	114.6
6	L	25.7	Very low	28.8	Very low	169 Å²	169	152.1 Å²	152.1	89%	0.885	85%	0.848	S	S	*	*			trans	-176	89.4	136	-97.6	156.3	0	0	0	107.4
7	K	24.8	Very low	28.9	Very low	196 Å²	196	155.5 Å²	155.5	85%	0.852	85%	0.852	S	S	*	*				57.5	114.2	102.3	-97.4	-164.9	173.8	-170.6	0	114.9
8	A	29.7	Very low	29	Very low	98 Å²	98	156.3 Å²	156.3	81%	0.81	85%	0.854	S	S	*	*			trans	-107.8	148.9	165.6	0	0	0	0	0	110.7
9	I	25	Very low	29	Very low	163 Å²	163	157.6 Å²	157.6	84%	0.836	86%	0.859	S	S	*	*			trans	-140	144.1	160.3	-64.7	-173.7	0	0	0	107.6
10	S	30.9	Very low	29.1	Very low	106 Å²	106	154.5 Å²	154.5	74%	0.741	86%	0.855	S	S	*	*			trans	-82.7	157.3	-178.1	52.1	0	0	0	0	114.5
11	L	25.6	Very low	29.1	Very low	178 Å²	178	156.4 Å²	156.4	93%	0.932	86%	0.855	S	S	*	*			trans	-148.1	165.4	153.3	-107.6	167.5	0	0	0	110.5
12	S	30.2	Very low	28.8	Very low	105 Å²	105	154.2 Å²	154.2	73%	0.734	84%	0.842	S	S	*	*			trans	-123	174.9	-158.9	60	0	0	0	0	115.3
13	L	29.2	Very low	28.8	Very low	161 Å²	161	156 Å²	156	84%	0.843	85%	0.846	S	S	*	*			trans	-51	165.8	161	-64.6	126.5	0	0	0	112.3
14	P	35.7	Very low	28.7	Very low	115 Å²	115	155.4 Å²	155.4	75%	0.747	85%	0.848	S	S	*	*			cis	-135.8	168.8	9.9	42	-26.6	0	0	0	116.5
15	S	27.1	Very low	28.6	Very low	120 Å²	120	155.3 Å²	155.3	84%	0.839	85%	0.853	S	S	*	*			trans	-173.8	66.7	157.5	46.9	0	0	0	0	115.1
16	L	29.3	Very low	28.5	Very low	167 Å²	167	150.1 Å²	150.1	87%	0.874	85%	0.853	S	S	*	*			trans	-150.2	64.6	171.7	-119.5	172.9	0	0	0	113
17	F	31.2	Very low	28.7	Very low	210 Å²	210	150.9 Å²	150.9	92%	0.921	85%	0.852	S	S	*	*			trans	-147.4	58.3	-179.5	-122.9	-72.7	0	0	0	111.7
18	L	31.4	Very low	28.9	Very low	170 Å²	170	149.4 Å²	149.4	89%	0.89	85%	0.853	S	S	*	*	S	Bend	trans	-164	61.1	177.8	-116.9	169.8	0	0	0	112.9
19	L	28.8	Very low	28.8	Very low	182 Å²	182	150.8 Å²	150.8	95%	0.953	85%	0.851	S	S	*	*	S	Bend	trans	-165.9	36.9	165.2	-112.9	163.5	0	0	0	113.4
20	A	30.3	Very low	29.3	Very low	94 Å²	94	148.1 Å²	148.1	78%	0.777	85%	0.845	S	S	*	*			trans	-124.3	27.6	-177	0	0	0	0	0	113.5
21	F	28.4	Very low	29.3	Very low	195 Å²	195	151.9 Å²	151.9	86%	0.855	85%	0.85	S	S	*	*			trans	-147	92.2	173.9	-93.4	-80.4	0	0	0	109.7
22	H	27.1	Very low	30	Very low	193 Å²	193	152 Å²	152	89%	0.894	84%	0.84	S	S	*	*			trans	172.3	81.4	150.6	-95.8	-63.1	0	0	0	110
23	L	27.6	Very low	30.5	Very low	181 Å²	181	149.5 Å²	149.5	95%	0.948	82%	0.822	S	S	*	*			trans	-172.2	70.3	156.3	-108.8	165.3	0	0	0	110.1
24	S	25.4	Very low	31.1	Very low	121 Å²	121	150.1 Å²	150.1	85%	0.846	82%	0.821	S	S	*	*			trans	-146.2	51.6	-179.7	64.7	0	0	0	0	111.7
25	A	28.1	Very low	31.6	Very low	103 Å²	103	147.7 Å²	147.7	85%	0.851	81%	0.81	S	S	*	*			trans	-154.8	83.8	176.9	0	0	0	0	0	111.8
26	S	26.8	Very low	32.5	Very low	126 Å²	126	146.5 Å²	146.5	88%	0.881	79%	0.792	S	S	*	*			trans	-144.9	153.9	151.5	-167	0	0	0	0	108.6
27	Q	30.1	Very low	33.3	Very low	185 Å²	185	144.4 Å²	144.4	86%	0.864	78%	0.777	S	S	*	*			trans	-94.7	154.8	-160.7	-69.4	176.7	-22.9	0	0	113.5	V29	Q27-V29 PolarHBondContact O-N 2.96Å
28	N	29.8	Very low	34.2	Very low	165 Å²	165	141.7 Å²	141.7	88%	0.882	77%	0.768	S	S	*	*			trans	-67.7	126.4	-176.9	-55.2	-86.4	0	0	0	112.2
29	V	27.3	Very low	35.2	Very low	126 Å²	126	138.5 Å²	138.5	76%	0.764	75%	0.748	S	S	*	*			trans	-119.3	126.5	143.1	-179.1	0	0	0	0	106.2	Q27 E31	Q27-V29 PolarHBondContact O-N 2.96Å; V29-E31 VanDerWaalsContact C-N 3.35Å; V29-E31 PolarHBondContact O-N 3.38Å
30	P	35.9	Very low	36.2	Very low	108 Å²	108	132 Å²	132	70%	0.701	72%	0.717	S	S	*	*			trans	-80.2	83.4	-179.6	32.5	-33.9	0	0	0	110.4	Y32	P30-Y32 PolarHBondContact O-N 2.82Å
31	E	30.9	Very low	37.1	Very low	184 Å²	184	133.1 Å²	133.1	86%	0.86	71%	0.714	S	S	*	*			trans	-61.6	104.9	154.8	-76.2	-170.9	134	0	0	108.1	V29 S33	V29-E31 VanDerWaalsContact C-N 3.35Å; V29-E31 PolarHBondContact O-N 3.38Å; E31-S33 PolarHBondContact O-N 2.92Å
32	Y	38.7	Very low	38.3	Very low	180 Å²	180	132.4 Å²	132.4	71%	0.706	71%	0.706	S	S	*	*			trans	-63.1	103.9	163.6	-95.1	-83.8	0	0	0	107.5	P30 E34	P30-Y32 PolarHBondContact O-N 2.82Å; Y32-E34 PolarHBondContact O-N 2.87Å
33	S	42	Very low	39.6	Very low	53 Å²	53	131.6 Å²	131.6	37%	0.371	70%	0.7	S	S	.	*			trans	-57.8	134.1	177.5	70.8	0	0	0	0	110.2	E31 A35 E36 H37	E31-S33 PolarHBondContact O-N 2.92Å; S33-A35 PolarHBondContact O-N 3.05Å; S33-A35 VanDerWaalsContact O-N 3.12Å; S33-E36 PolarHBondContact O-N 3.44Å; S33-E36 PolarHBondContact OG-N 2.91Å; S33-H37 PolarHBondContact O-N 2.99Å
34	E	42.1	Very low	41.4	Very low	174 Å²	174	125.7 Å²	125.7	81%	0.813	67%	0.667	S	S	*	*	H	α-helix	trans	-56	-31.6	175.6	-67	-175.3	109.5	0	0	110.9	Y32 E36 H37 Q38	Y32-E34 PolarHBondContact O-N 2.87Å; E34-E36 PolarHBondContact O-N 2.8Å; E34-H37 PolarHBondContact O-N 3.02Å; E34-Q38 VanDerWaalsContact O-CB 3.32Å; E34-Q38 WeakPolarHBondContact O-CB 3.24Å; E34-Q38 PolarHBondContact O-N 2.88Å
35	A	45.2	Very low	43.8	Very low	64 Å²	64	121.4 Å²	121.4	53%	0.529	63%	0.634	S	S	.	*	H	α-helix	trans	-56.4	-45.4	174.2	0	0	0	0	0	113.8	S33 Q38 Q39	S33-A35 PolarHBondContact O-N 3.05Å; S33-A35 VanDerWaalsContact O-N 3.12Å; A35-Q38 PolarHBondContact O-N 3.26Å; A35-Q39 WeakPolarHBondContact O-CB 3.38Å; A35-Q39 PolarHBondContact O-N 3.22Å
36	E	45.3	Very low	46.5	Very low	96 Å²	96	118.6 Å²	118.6	45%	0.449	61%	0.607	S	S	.	*	H	α-helix	trans	-68.5	-38.3	176.8	-79.6	-168	135.5	0	0	111.8	S33 E34 Q38 Q39 C40	S33-E36 PolarHBondContact O-N 3.44Å; S33-E36 PolarHBondContact OG-N 2.91Å; E34-E36 PolarHBondContact O-N 2.8Å; E36-Q38 VanDerWaalsContact C-N 3.34Å; E36-Q38 PolarHBondContact O-N 3.34Å; E36-Q39 PolarHBondContact O-N 2.88Å; E36-C40 PolarHBondContact O-N 3.08Å; E36-C40 VanDerWaalsContact O-N 3.09Å; E36-C40 PolarHBondContact O-SG 2.04Å
37	H	47.7	Very low	49.4	Very low	122 Å²	122	115.3 Å²	115.3	57%	0.565	58%	0.582	S	S	*	*	H	α-helix	trans	-61.9	-43.5	174.3	-116.9	80.8	0	0	0	111.4	S33 E34 C40 V41	S33-H37 PolarHBondContact O-N 2.99Å; E34-H37 PolarHBondContact O-N 3.02Å; H37-C40 PolarHBondContact O-N 2.87Å; H37-V41 WeakPolarHBondContact O-CG2 3.49Å; H37-V41 PolarHBondContact O-N 2.67Å
38	Q	49.2	Very low	52.1	Low	154 Å²	154	107.3 Å²	107.3	72%	0.72	55%	0.545	S	S	*	.	H	α-helix	trans	-69.4	-34.2	179.6	-151.7	167.8	36.1	0	0	112.1	E34 A35 E36 V41	E34-Q38 VanDerWaalsContact O-CB 3.32Å; E34-Q38 WeakPolarHBondContact O-CB 3.24Å; E34-Q38 PolarHBondContact O-N 2.88Å; A35-Q38 PolarHBondContact O-N 3.26Å; E36-Q38 VanDerWaalsContact C-N 3.34Å; E36-Q38 PolarHBondContact O-N 3.34Å; Q38-V41 PolarHBondContact O-N 3.22Å
39	Q	51.5	Low	54.9	Low	102 Å²	102	101.1 Å²	101.1	48%	0.477	52%	0.516	S	S	.	.	H	α-helix	trans	-66.1	-37.5	174	-166.8	167.6	32.1	0	0	111.9	A35 E36 V41 R42 L548	A35-Q39 WeakPolarHBondContact O-CB 3.38Å; A35-Q39 PolarHBondContact O-N 3.22Å; E36-Q39 PolarHBondContact O-N 2.88Å; Q39-V41 VanDerWaalsContact C-N 3.32Å; Q39-V41 PolarHBondContact O-N 2.91Å; Q39-R42 WeakPolarHBondContact O-CB 3.45Å; Q39-R42 PolarHBondContact O-N 2.74Å; Q39-L548 WeakPolarHBondContact O-CD1 3.31Å
40	C	51	Low	57.8	Low	46 Å²	46	97.5 Å²	97.5	31%	0.311	49%	0.49	S	S	.	.	H	α-helix	trans	-75.4	-13.3	179.1	-69.3	0	0	0	0	115.4	E36 H37 C588	E36-C40 PolarHBondContact O-N 3.08Å; E36-C40 VanDerWaalsContact O-N 3.09Å; E36-C40 PolarHBondContact O-SG 2.04Å; H37-C40 PolarHBondContact O-N 2.87Å; C40-C588 WeakPolarHBondContact CA-SG 3.31Å; C40-C588 HydrophobicContact CB-CB 3.6Å; C40-C588 WeakPolarHBondContact CB-SG 3.41Å; C40-C588 WeakPolarHBondContact SG-CA 3.44Å; C40-C588 WeakPolarHBondContact SG-CB 3.44Å; C40-C588 PolarHBondContact SG-N 2.86Å; C40-C588 CovalentContact SG-SG 2.03Å; C40-C588 PolarHBondContact SG-SG 2.93Å
41	V	48.9	Very low	60.2	Low	118 Å²	118	97.9 Å²	97.9	72%	0.715	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-9	174.1	174.8	0	0	0	0	111.8	H37 Q38 Q39 K43	H37-V41 WeakPolarHBondContact O-CG2 3.49Å; H37-V41 PolarHBondContact O-N 2.67Å; Q38-V41 PolarHBondContact O-N 3.22Å; Q39-V41 VanDerWaalsContact C-N 3.32Å; Q39-V41 PolarHBondContact O-N 2.91Å; V41-K43 PolarHBondContact O-N 2.69Å
42	R	52.7	Low	62.9	Low	179 Å²	179	93.8 Å²	93.8	68%	0.675	47%	0.467	S	S	*	.			trans	-74.7	119.4	-176.6	-149.1	175.5	-166.1	-171.3	2.6	110.9	Q39 E44	Q39-R42 WeakPolarHBondContact O-CB 3.45Å; Q39-R42 PolarHBondContact O-N 2.74Å; R42-E44 VanDerWaalsContact C-N 3.33Å; R42-E44 PolarHBondContact O-N 2.88Å
43	K	56.1	Low	65.3	Low	176 Å²	176	85.3 Å²	85.3	77%	0.765	43%	0.434	S	S	*	.			trans	-71.2	85	173.4	-67.4	-173.9	179.7	-174.8	0	110.5	V41	V41-K43 PolarHBondContact O-N 2.69Å
44	E	64.8	Low	67.5	Low	58 Å²	58	87.6 Å²	87.6	27%	0.271	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-76.2	137	170.3	-70.8	-169.6	-176	0	0	111.4	R42 K546	R42-E44 VanDerWaalsContact C-N 3.33Å; R42-E44 PolarHBondContact O-N 2.88Å; E44-K546 HydrophobicContact CB-CB 4.09Å; E44-K546 HydrophobicContact CB-CD 3.87Å; E44-K546 WeakPolarHBondContact O-CB 2.99Å; E44-K546 PolarHBondContact O-N 3.34Å; E44-K546 WeakPolarHBondContact OE2-CD 3.39Å; E44-K546 IonicContact OE2-NZ 2.75Å; E44-K546 PolarHBondContact OE2-NZ 2.82Å
45	H	76.4	Confident	69.8	Low	30 Å²	30	84.3 Å²	84.3	14%	0.139	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-70.2	153.9	166.7	55.6	20.3	0	0	0	111.4	Y455 E458	H45-Y455 VanDerWaalsContact CD2-CB 3.47Å; H45-Y455 WeakPolarHBondContact CD2-CB 3.33Å; H45-Y455 AromaticContact CD2-CD2 3.97Å; H45-Y455 AromaticContact CD2-CG 3.7Å; H45-E458 IonicContact CE1-OE2 2.66Å; H45-E458 PolarHBondContact CE1-OE2 3.43Å; H45-E458 IonicContact NE2-OE2 3.11Å
46	P	83.6	Confident	71.9	Confident	45 Å²	45	85.6 Å²	85.6	29%	0.292	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-67.2	141.6	172.1	30.2	-34.5	0	0	0	110.9	L456 E457 E458 P544	P46-L456 WeakPolarHBondContact CD-O 3.41Å; P46-L456 WeakPolarHBondContact CG-O 3.36Å; P46-E457 CarbonylContact O-C 3.55Å; P46-E457 WeakPolarHBondContact O-CA 3.38Å; P46-E458 PolarHBondContact O-N 2.82Å; P46-P544 HydrophobicContact CG-CB 4.35Å; P46-P544 HydrophobicContact CG-CG 4.42Å
47	T	87.1	Confident	74.2	Confident	57 Å²	57	82.5 Å²	82.5	35%	0.35	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	115.3	-174.9	50	0	0	0	0	108.8	E458	T47-E458 CarbonylContact C-O 3.59Å; T47-E458 HydrophobicContact CG2-CB 4.13Å
48	I	87.6	Confident	76.4	Confident	16 Å²	16	78.6 Å²	78.6	8%	0.082	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	121	178.1	-61	-179	0	0	0	108.9	D52 L53 E457 E458 Q460 M500	I48-D52 HydrophobicContact CG2-CB 4.04Å; I48-L53 HydrophobicContact CG2-CB 4.04Å; I48-L53 HydrophobicContact CG2-CD1 4.33Å; I48-E457 WeakPolarHBondContact CD1-OE2 3.26Å; I48-E458 PolarHBondContact N-O 2.8Å; I48-Q460 WeakPolarHBondContact O-CB 3.43Å; I48-Q460 PolarHBondContact O-N 2.97Å; I48-M500 HydrophobicContact CD1-CE 4.19Å; I48-M500 HydrophobicContact CD1-SD 4.05Å; I48-M500 HydrophobicContact CG1-CE 4.35Å; I48-M500 HydrophobicContact CG2-CE 4.24Å
49	A	88.1	Confident	78.6	Confident	35 Å²	35	76.5 Å²	76.5	29%	0.289	39%	0.39	S	S	.	.			trans	-73.5	155.4	177.7	0	0	0	0	0	112	E51 D52 L53	A49-E51 VanDerWaalsContact C-N 3.32Å; A49-E51 PolarHBondContact O-N 2.91Å; A49-D52 PolarHBondContact O-N 2.93Å; A49-D52 VanDerWaalsContact O-N 3.12Å; A49-L53 PolarHBondContact O-N 2.9Å; A49-L53 VanDerWaalsContact O-N 3.12Å
50	F	88.1	Confident	80.7	Confident	50 Å²	50	72.6 Å²	72.6	22%	0.219	37%	0.371	C	S	.	.	H	α-helix	trans	-53.8	-45	-177.9	176.5	-103.1	0	0	0	113.4	D52 L53 K54 Q460 L462 P463	F50-D52 VanDerWaalsContact C-N 3.33Å; F50-D52 PolarHBondContact O-N 2.91Å; F50-L53 PolarHBondContact O-N 3.21Å; F50-K54 HydrophobicContact CE1-CD 4.16Å; F50-K54 VanDerWaalsContact O-CB 3.24Å; F50-K54 WeakPolarHBondContact O-CB 3.4Å; F50-K54 PolarHBondContact O-N 2.9Å; F50-Q460 WeakPolarHBondContact CA-O 3.27Å; F50-L462 WeakPolarHBondContact CB-O 3.42Å; F50-P463 HydrophobicContact CD1-CB 4.4Å; F50-P463 HydrophobicContact CD1-CG 4.27Å; F50-P463 HydrophobicContact CE1-CG 3.95Å; F50-P463 HydrophobicContact CE2-CG 4.46Å; F50-P463 HydrophobicContact CZ-CG 4.06Å
51	E	87.6	Confident	82.8	Confident	116 Å²	116	74.6 Å²	74.6	54%	0.542	38%	0.382	S	S	.	.	H	α-helix	trans	-68.7	-27.1	-178.6	-67.7	-65.4	133.7	0	0	113.6	A49 K54 P55	A49-E51 VanDerWaalsContact C-N 3.32Å; A49-E51 PolarHBondContact O-N 2.91Å; E51-K54 IonicContact OE1-NZ 2.89Å; E51-K54 PolarHBondContact OE1-NZ 3.4Å; E51-K54 VanDerWaalsContact OE2-CD 3.3Å; E51-K54 WeakPolarHBondContact OE2-CD 3.08Å; E51-K54 IonicContact OE2-NZ 2.69Å; E51-K54 PolarHBondContact OE2-NZ 2.85Å; E51-P55 WeakPolarHBondContact O-CD 3.42Å
52	D	86.3	Confident	85	Confident	99 Å²	99	72.4 Å²	72.4	53%	0.529	36%	0.362	S	S	.	.	H	α-helix	trans	-77.2	-31.4	173.3	-67.5	-48.4	0	0	0	112	I48 A49 F50 P55 M500	I48-D52 HydrophobicContact CG2-CB 4.04Å; A49-D52 PolarHBondContact O-N 2.93Å; A49-D52 VanDerWaalsContact O-N 3.12Å; F50-D52 VanDerWaalsContact C-N 3.33Å; F50-D52 PolarHBondContact O-N 2.91Å; D52-P55 WeakPolarHBondContact O-CD 3.32Å; D52-M500 HydrophobicContact CB-CE 4.21Å
53	L	89.6	Confident	87	Confident	2 Å²	2	69.4 Å²	69.4	1%	0.01	37%	0.366	C	S	.	.	H	α-helix	trans	-78.4	-37.6	178.5	-166.9	66.6	0	0	0	111.8	I48 A49 F50 P55 W56 V57 M459 I461 I493	I48-L53 HydrophobicContact CG2-CB 4.04Å; I48-L53 HydrophobicContact CG2-CD1 4.33Å; A49-L53 PolarHBondContact O-N 2.9Å; A49-L53 VanDerWaalsContact O-N 3.12Å; F50-L53 PolarHBondContact O-N 3.21Å; L53-P55 WeakPolarHBondContact O-CD 3.06Å; L53-P55 VanDerWaalsContact O-N 3.14Å; L53-W56 WeakPolarHBondContact O-CB 3.41Å; L53-W56 PolarHBondContact O-N 2.7Å; L53-V57 HydrophobicContact CD2-CG2 4.25Å; L53-V57 HydrophobicContact CG-CG2 3.82Å; L53-M459 HydrophobicContact CD1-CG 4.25Å; L53-M459 HydrophobicContact CD1-SD 4.29Å; L53-M459 HydrophobicContact CD2-CB 4.05Å; L53-M459 HydrophobicContact CD2-CG 4.4Å; L53-I461 HydrophobicContact CD2-CG2 3.77Å; L53-I493 HydrophobicContact CD1-CG2 4.29Å
54	K	89.1	Confident	88.6	Confident	100 Å²	100	64.2 Å²	64.2	44%	0.435	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-44.4	-39.1	-176	179.6	179.5	-176.8	179.2	0	116.4	F50 E51 W56 V57	F50-K54 HydrophobicContact CE1-CD 4.16Å; F50-K54 VanDerWaalsContact O-CB 3.24Å; F50-K54 WeakPolarHBondContact O-CB 3.4Å; F50-K54 PolarHBondContact O-N 2.9Å; E51-K54 IonicContact OE1-NZ 2.89Å; E51-K54 PolarHBondContact OE1-NZ 3.4Å; E51-K54 VanDerWaalsContact OE2-CD 3.3Å; E51-K54 WeakPolarHBondContact OE2-CD 3.08Å; E51-K54 IonicContact OE2-NZ 2.69Å; E51-K54 PolarHBondContact OE2-NZ 2.85Å; K54-W56 PolarHBondContact O-N 2.81Å; K54-V57 PolarHBondContact O-N 2.89Å
55	P	90.5	Very high	90	Very high	105 Å²	105	61.6 Å²	61.6	68%	0.682	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-64.5	-21.2	175.4	-22.1	35	0	0	0	114.5	E51 D52 L53	E51-P55 WeakPolarHBondContact O-CD 3.42Å; D52-P55 WeakPolarHBondContact O-CD 3.32Å; L53-P55 WeakPolarHBondContact O-CD 3.06Å; L53-P55 VanDerWaalsContact O-N 3.14Å
56	W	88.4	Confident	90.8	Very high	92 Å²	92	63.3 Å²	63.3	35%	0.348	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-96	-11.5	-179.2	-55.5	94.8	0	0	0	113.2	L53 K54 P494 R497 S499	L53-W56 WeakPolarHBondContact O-CB 3.41Å; L53-W56 PolarHBondContact O-N 2.7Å; K54-W56 PolarHBondContact O-N 2.81Å; W56-P494 HydrophobicContact CB-CG 4.05Å; W56-P494 HydrophobicContact CE3-CG 4.32Å; W56-P494 WeakPolarHBondContact O-CD 3.44Å; W56-R497 HydrophobicContact CD2-CG 4.24Å; W56-R497 HydrophobicContact CE3-CG 4.39Å; W56-R497 HydrophobicContact CG-CG 4.35Å; W56-S499 WeakPolarHBondContact CH2-OG 3.38Å
57	V	93.1	Very high	91.4	Very high	30 Å²	30	61.6 Å²	61.6	18%	0.182	35%	0.346	C	S	.	.			trans	-97.8	120.8	-172.4	-178.3	0	0	0	0	110.7	L53 K54 L491 K492 I493	L53-V57 HydrophobicContact CD2-CG2 4.25Å; L53-V57 HydrophobicContact CG-CG2 3.82Å; K54-V57 PolarHBondContact O-N 2.89Å; V57-L491 HydrophobicContact CG1-CB 3.97Å; V57-L491 HydrophobicContact CG1-CD1 4.29Å; V57-L491 HydrophobicContact CG1-CD2 3.92Å; V57-L491 HydrophobicContact CG1-CG 4.28Å; V57-K492 WeakPolarHBondContact CA-O 3.48Å; V57-I493 HydrophobicContact CG1-CG1 4.5Å; V57-I493 HydrophobicContact CG2-CG1 4.2Å; V57-I493 HydrophobicContact CG2-CG2 4.5Å
58	S	94.6	Very high	91.8	Very high	41 Å²	41	58.9 Å²	58.9	29%	0.287	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	122.9	163.6	-62.3	0	0	0	0	109.1	L491 K492	S58-L491 CarbonylContact O-C 3.56Å; S58-K492 PolarHBondContact N-O 3.26Å; S58-K492 VanDerWaalsContact N-O 3.09Å; S58-K492 PolarHBondContact O-N 3.05Å
59	N	94.9	Very high	92.1	Very high	110 Å²	110	58.6 Å²	58.6	59%	0.588	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.9	150	179.7	66	-10.5	0	0	0	112.6	L491	N59-L491 HydrophobicContact CB-CD2 3.53Å
60	F	96.3	Very high	92.4	Very high	19 Å²	19	59.4 Å²	59.4	8%	0.083	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	125.3	168.9	173	-103.8	0	0	0	109.7	Y62 F68 F89 L91 V96 L98 G489 V490	F60-Y62 HydrophobicContact CZ-CD2 4.15Å; F60-F68 HydrophobicContact CD1-CE1 4.4Å; F60-F68 HydrophobicContact CE1-CE1 4.08Å; F60-F89 HydrophobicContact CE1-CB 4.47Å; F60-F89 HydrophobicContact CE1-CD1 4.06Å; F60-F89 HydrophobicContact CE1-CD2 4.12Å; F60-F89 HydrophobicContact CE1-CE1 4.3Å; F60-F89 HydrophobicContact CE1-CE2 4.34Å; F60-F89 AromaticContact CE1-CG 3.97Å; F60-F89 HydrophobicContact CE1-CG 3.97Å; F60-F89 HydrophobicContact CE1-CZ 4.43Å; F60-F89 AromaticContact CZ-CD1 3.82Å; F60-F89 HydrophobicContact CZ-CD1 3.82Å; F60-F89 AromaticContact CZ-CE1 3.98Å; F60-F89 HydrophobicContact CZ-CE1 3.98Å; F60-F89 HydrophobicContact CZ-CG 4.19Å; F60-F89 HydrophobicContact CZ-CZ 4.47Å; F60-L91 HydrophobicContact CB-CD1 4.32Å; F60-L91 HydrophobicContact CD1-CD1 3.52Å; F60-L91 HydrophobicContact CD1-CD2 3.87Å; F60-L91 HydrophobicContact CD1-CG 4.38Å; F60-L91 HydrophobicContact CD2-CD2 3.99Å; F60-L91 HydrophobicContact CE1-CD1 4.02Å; F60-L91 HydrophobicContact CE1-CD2 3.8Å; F60-L91 HydrophobicContact CE2-CD2 3.94Å; F60-L91 HydrophobicContact CG-CD1 3.94Å; F60-L91 HydrophobicContact CG-CD2 3.96Å; F60-L91 HydrophobicContact CZ-CD2 3.85Å; F60-V96 HydrophobicContact CB-CB 4.2Å; F60-V96 HydrophobicContact CB-CG1 3.58Å; F60-L98 HydrophobicContact CE2-CB 3.97Å; F60-L98 HydrophobicContact CE2-CD1 4.13Å; F60-L98 HydrophobicContact CE2-CD2 4.38Å; F60-L98 HydrophobicContact CE2-CG 4.39Å; F60-L98 HydrophobicContact CZ-CD1 4.03Å; F60-G489 CarbonylContact O-C 3.57Å; F60-G489 WeakPolarHBondContact O-CA 3.11Å; F60-V490 PolarHBondContact N-O 3.36Å; F60-V490 PolarHBondContact O-N 2.94Å
61	T	95.5	Very high	92.8	Very high	88 Å²	88	57.4 Å²	57.4	54%	0.54	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	157.1	173.9	59	0	0	0	0	108.5	N488	T61-N488 WeakPolarHBondContact CG2-O 3.22Å
62	Y	95.4	Very high	93.2	Very high	72 Å²	72	52.4 Å²	52.4	28%	0.282	30%	0.297	S	S	.	.			trans	-139.3	128	177.5	-165.6	-83.5	0	0	0	110.3	F60 G64 V65 Y87 F89 L98 A101	F60-Y62 HydrophobicContact CZ-CD2 4.15Å; Y62-G64 PolarHBondContact O-N 3.4Å; Y62-V65 HydrophobicContact CD1-CB 4.17Å; Y62-V65 HydrophobicContact CD1-CG2 3.56Å; Y62-V65 HydrophobicContact CE1-CG2 4.19Å; Y62-V65 HydrophobicContact CG-CG2 4.47Å; Y62-V65 PolarHBondContact O-N 2.85Å; Y62-Y87 HydrophobicContact CE1-CE1 4.27Å; Y62-F89 HydrophobicContact CD1-CE1 4.38Å; Y62-F89 HydrophobicContact CD1-CZ 4.19Å; Y62-F89 AromaticContact CD2-CE1 3.64Å; Y62-F89 HydrophobicContact CD2-CE1 3.64Å; Y62-F89 HydrophobicContact CD2-CZ 4.14Å; Y62-F89 HydrophobicContact CE2-CE1 4.06Å; Y62-F89 AromaticContact CG-CE1 3.8Å; Y62-F89 HydrophobicContact CG-CE1 3.8Å; Y62-F89 AromaticContact CG-CZ 3.79Å; Y62-F89 HydrophobicContact CG-CZ 3.79Å; Y62-L98 HydrophobicContact CE2-CD2 4.47Å; Y62-A101 HydrophobicContact CE2-CB 4.28Å
63	P	93.8	Very high	93.6	Very high	117 Å²	117	49.9 Å²	49.9	76%	0.76	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	130.6	-174.4	-27.1	35.4	0	0	0	113.5	V65	P63-V65 VanDerWaalsContact C-N 3.26Å; P63-V65 PolarHBondContact O-N 2.88Å
64	G	89.6	Confident	93.8	Very high	66 Å²	66	50.1 Å²	50.1	68%	0.68	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	13.2	177.2	0	0	0	0	0	115.6	Y62	Y62-G64 PolarHBondContact O-N 3.4Å
65	V	94.7	Very high	93.8	Very high	4 Å²	4	48 Å²	48	2%	0.024	29%	0.285	C	S	.	.			trans	-116.5	137.8	178.4	176.2	0	0	0	0	110.1	Y62 P63 F68 A84 Y87 F89	Y62-V65 HydrophobicContact CD1-CB 4.17Å; Y62-V65 HydrophobicContact CD1-CG2 3.56Å; Y62-V65 HydrophobicContact CE1-CG2 4.19Å; Y62-V65 HydrophobicContact CG-CG2 4.47Å; Y62-V65 PolarHBondContact O-N 2.85Å; P63-V65 VanDerWaalsContact C-N 3.26Å; P63-V65 PolarHBondContact O-N 2.88Å; V65-F68 HydrophobicContact CB-CZ 4.26Å; V65-F68 HydrophobicContact CG1-CE1 4.33Å; V65-F68 HydrophobicContact CG1-CE2 4.22Å; V65-F68 HydrophobicContact CG1-CZ 3.78Å; V65-F68 WeakPolarHBondContact O-CE2 3.46Å; V65-A84 HydrophobicContact CG1-CB 3.68Å; V65-Y87 HydrophobicContact CB-CD2 4.48Å; V65-Y87 HydrophobicContact CG1-CD2 4.32Å; V65-Y87 HydrophobicContact CG2-CD2 3.31Å; V65-Y87 HydrophobicContact CG2-CE2 3.51Å; V65-Y87 HydrophobicContact CG2-CG 4.03Å; V65-F89 HydrophobicContact CG1-CE2 4.02Å; V65-F89 HydrophobicContact CG1-CZ 4.09Å
66	H	94.1	Very high	93.7	Very high	65 Å²	65	50.5 Å²	50.5	30%	0.301	29%	0.293	S	S	.	.			trans	-137.3	173.3	-175	-59.8	-76.5	0	0	0	112.4	R85 N487 N488	H66-R85 WeakPolarHBondContact O-CB 3.16Å; H66-R85 PolarHBondContact O-N 2.98Å; H66-N487 CarbonylContact C-O 3.57Å; H66-N487 WeakPolarHBondContact CA-O 3.04Å; H66-N488 PolarHBondContact CE1-OD1 2.9Å; H66-N488 PolarHBondContact ND1-OD1 3.49Å
67	D	94.4	Very high	93.8	Very high	9 Å²	9	50.9 Å²	50.9	5%	0.048	29%	0.294	C	S	.	.			trans	59.2	59.4	176.4	-164.7	58.4	0	0	0	114.4	S69 A84 Y127 R129 K471 N487	D67-S69 PolarHBondContact O-N 2.9Å; D67-S69 PolarHBondContact O-OG 3.11Å; D67-S69 PolarHBondContact OD2-OG 3.28Å; D67-S69 VanDerWaalsContact OD2-OG 3.12Å; D67-A84 WeakPolarHBondContact O-CA 3.4Å; D67-Y127 HydrophobicContact CB-CD1 3.96Å; D67-Y127 HydrophobicContact CB-CE1 3.9Å; D67-Y127 WeakPolarHBondContact OD2-CD1 3.4Å; D67-R129 IonicContact OD2-CZ 2.76Å; D67-R129 VanDerWaalsContact OD2-CZ 3.25Å; D67-R129 IonicContact OD2-NH1 3.68Å; D67-R129 PolarHBondContact OD2-NH1 2.96Å; D67-R129 IonicContact OD2-NH2 3.76Å; D67-R129 PolarHBondContact OD2-NH2 3.43Å; D67-K471 IonicContact OD1-NZ 3.62Å; D67-K471 PolarHBondContact OD1-NZ 3.34Å; D67-N487 PolarHBondContact N-O 3.41Å
68	F	96.4	Very high	93.8	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.303	C	S	.	.			trans	-73.6	63.8	176.5	-61.7	-103.2	0	0	0	110.8	F60 V65 V82 A84 F89 G485 L486 N488 G489 V490	F60-F68 HydrophobicContact CD1-CE1 4.4Å; F60-F68 HydrophobicContact CE1-CE1 4.08Å; V65-F68 HydrophobicContact CB-CZ 4.26Å; V65-F68 HydrophobicContact CG1-CE1 4.33Å; V65-F68 HydrophobicContact CG1-CE2 4.22Å; V65-F68 HydrophobicContact CG1-CZ 3.78Å; V65-F68 WeakPolarHBondContact O-CE2 3.46Å; F68-V82 HydrophobicContact CB-CG1 4.34Å; F68-V82 HydrophobicContact CD1-CG1 3.89Å; F68-A84 HydrophobicContact CD1-CB 3.87Å; F68-A84 HydrophobicContact CE1-CB 4.07Å; F68-A84 HydrophobicContact CG-CB 4.12Å; F68-A84 HydrophobicContact CZ-CB 4.48Å; F68-F89 HydrophobicContact CD1-CE2 4.41Å; F68-F89 HydrophobicContact CE1-CD2 4.1Å; F68-F89 AromaticContact CE1-CE2 3.64Å; F68-F89 HydrophobicContact CE1-CE2 3.64Å; F68-F89 HydrophobicContact CE1-CZ 4.43Å; F68-F89 HydrophobicContact CZ-CE2 4.34Å; F68-G485 VanDerWaalsContact O-CA 3.26Å; F68-G485 WeakPolarHBondContact O-CA 3.31Å; F68-L486 WeakPolarHBondContact CB-O 3.13Å; F68-L486 PolarHBondContact N-O 2.85Å; F68-L486 VanDerWaalsContact N-O 3.12Å; F68-N488 VanDerWaalsContact CE2-C 3.4Å; F68-G489 VanDerWaalsContact CD2-N 3.28Å; F68-V490 HydrophobicContact CB-CG2 3.89Å; F68-V490 HydrophobicContact CD1-CG2 3.92Å; F68-V490 HydrophobicContact CG-CG2 4.2Å
69	S	93.4	Very high	93.8	Very high	11 Å²	11	50.9 Å²	50.9	8%	0.077	29%	0.29	C	S	.	.			trans	-93	-21.9	-165.1	51.5	0	0	0	0	114.2	D67 G83 R129 S472	D67-S69 PolarHBondContact O-N 2.9Å; D67-S69 PolarHBondContact O-OG 3.11Å; D67-S69 PolarHBondContact OD2-OG 3.28Å; D67-S69 VanDerWaalsContact OD2-OG 3.12Å; S69-G83 PolarHBondContact N-O 2.71Å; S69-R129 PolarHBondContact OG-NH1 2.91Å; S69-S472 VanDerWaalsContact O-CB 3.26Å; S69-S472 WeakPolarHBondContact O-CB 3.14Å; S69-S472 PolarHBondContact O-OG 2.71Å
70	Q	95.4	Very high	93.9	Very high	51 Å²	51	45.6 Å²	45.6	24%	0.238	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	115.7	-177.9	-64.5	-62.9	-47.8	0	0	110.4	V82 G83 V128 R129 L131	Q70-V82 CarbonylContact O-C 3.53Å; Q70-V82 WeakPolarHBondContact O-CA 3.08Å; Q70-G83 PolarHBondContact N-O 2.92Å; Q70-G83 PolarHBondContact O-N 2.04Å; Q70-V128 HydrophobicContact CB-CG1 4.3Å; Q70-V128 HydrophobicContact CG-CG1 4.22Å; Q70-V128 WeakPolarHBondContact CG-O 3.5Å; Q70-R129 PolarHBondContact NE2-O 3.42Å; Q70-L131 HydrophobicContact CB-CB 3.92Å; Q70-L131 HydrophobicContact CB-CD2 4.15Å
71	L	96.7	Very high	93.9	Very high	8 Å²	8	44.7 Å²	44.7	4%	0.042	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	126.9	178.5	-60.6	-178.1	0	0	0	109.5	L80 V82 Q474 F483 V490	L71-L80 HydrophobicContact CB-CD1 4.15Å; L71-L80 HydrophobicContact CD2-CD1 4.28Å; L71-L80 HydrophobicContact CD2-CD2 4.44Å; L71-V82 HydrophobicContact CD2-CB 4.25Å; L71-V82 HydrophobicContact CD2-CG1 3.8Å; L71-V82 HydrophobicContact CD2-CG2 3.71Å; L71-Q474 HydrophobicContact CB-CG 3.84Å; L71-Q474 HydrophobicContact CD1-CG 4.43Å; L71-F483 HydrophobicContact CD1-CB 4.28Å; L71-V490 HydrophobicContact CD2-CG1 4.28Å; L71-V490 HydrophobicContact CD2-CG2 3.91Å
72	A	95.6	Very high	94	Very high	12 Å²	12	40.5 Å²	40.5	10%	0.099	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	116.5	176	0	0	0	0	0	110.8	I81 L131 V133	A72-I81 PolarHBondContact N-O 2.03Å; A72-I81 PolarHBondContact O-N 2.9Å; A72-L131 HydrophobicContact CB-CD2 3.98Å; A72-L131 HydrophobicContact CB-CG 3.93Å; A72-V133 HydrophobicContact CB-CG2 4.02Å
73	L	94.4	Very high	94.1	Very high	46 Å²	46	37.1 Å²	37.1	24%	0.241	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	133.1	-179.3	-61.2	170	0	0	0	110.7	L80 L93 Q474 I475 L476 F483	L73-L80 HydrophobicContact CD2-CD1 3.86Å; L73-L93 HydrophobicContact CD2-CD2 3.52Å; L73-Q474 HydrophobicContact CD1-CB 4.09Å; L73-Q474 HydrophobicContact CG-CB 4.49Å; L73-I475 WeakPolarHBondContact CD1-O 3.41Å; L73-L476 HydrophobicContact CD1-CB 4.21Å; L73-F483 HydrophobicContact CD2-CD2 3.74Å; L73-F483 HydrophobicContact CD2-CE2 3.92Å; L73-F483 HydrophobicContact CD2-CG 4.19Å
74	D	92.8	Very high	94.2	Very high	7 Å²	7	31.5 Å²	31.5	4%	0.037	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	72.4	174.3	-178.7	19	0	0	0	109.3	N76 R77 N78 Q79 V133 V155	D74-N76 PolarHBondContact O-N 3.23Å; D74-R77 VanDerWaalsContact CG-NH1 3.26Å; D74-R77 CarbonylContact O-C 3.53Å; D74-R77 PolarHBondContact O-N 2.9Å; D74-R77 IonicContact OD1-NH1 3.68Å; D74-R77 PolarHBondContact OD1-NH1 2.89Å; D74-R77 WeakPolarHBondContact OD2-CB 3.31Å; D74-R77 VanDerWaalsContact OD2-CD 3.26Å; D74-R77 WeakPolarHBondContact OD2-CD 3.21Å; D74-R77 WeakPolarHBondContact OD2-CG 3.43Å; D74-R77 IonicContact OD2-CZ 3.98Å; D74-R77 IonicContact OD2-NE 3.73Å; D74-R77 IonicContact OD2-NH1 2.84Å; D74-R77 PolarHBondContact OD2-NH1 3.3Å; D74-N78 PolarHBondContact O-N 2.97Å; D74-N78 VanDerWaalsContact O-N 3.15Å; D74-Q79 WeakPolarHBondContact CA-O 3.06Å; D74-Q79 HydrophobicContact CB-CG 3.87Å; D74-Q79 PolarHBondContact N-O 3.41Å; D74-Q79 PolarHBondContact O-N 2.99Å; D74-Q79 PolarHBondContact OD2-NE2 2.76Å; D74-V133 HydrophobicContact CB-CG1 4.44Å; D74-V155 WeakPolarHBondContact OD2-CG1 3.39Å
75	A	89.1	Confident	94.5	Very high	55 Å²	55	29.7 Å²	29.7	46%	0.455	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-54.6	-38.1	-178.1	0	0	0	0	0	112.4	R77 N78 L476	A75-R77 PolarHBondContact O-N 2.03Å; A75-N78 PolarHBondContact O-N 3.25Å; A75-L476 HydrophobicContact CB-CD1 4.07Å
76	N	89.3	Confident	94.6	Very high	157 Å²	157	30.8 Å²	30.8	84%	0.84	16%	0.161	S	C	*	.	G	3₁₀ helix	trans	-57.6	-16.6	175.8	-67.7	-51.3	0	0	0	114.3	D74	D74-N76 PolarHBondContact O-N 3.23Å
77	R	90.3	Very high	94.7	Very high	100 Å²	100	30.8 Å²	30.8	38%	0.377	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-129.2	16.2	177.9	-54.5	-173.3	-171.7	82.3	6.1	112.8	D74 A75 Q79 G135	D74-R77 VanDerWaalsContact CG-NH1 3.26Å; D74-R77 CarbonylContact O-C 3.53Å; D74-R77 PolarHBondContact O-N 2.9Å; D74-R77 IonicContact OD1-NH1 3.68Å; D74-R77 PolarHBondContact OD1-NH1 2.89Å; D74-R77 WeakPolarHBondContact OD2-CB 3.31Å; D74-R77 VanDerWaalsContact OD2-CD 3.26Å; D74-R77 WeakPolarHBondContact OD2-CD 3.21Å; D74-R77 WeakPolarHBondContact OD2-CG 3.43Å; D74-R77 IonicContact OD2-CZ 3.98Å; D74-R77 IonicContact OD2-NE 3.73Å; D74-R77 IonicContact OD2-NH1 2.84Å; D74-R77 PolarHBondContact OD2-NH1 3.3Å; A75-R77 PolarHBondContact O-N 2.03Å; R77-Q79 HydrophobicContact CB-CG 4.04Å; R77-Q79 PolarHBondContact O-N 3.15Å; R77-Q79 VanDerWaalsContact O-N 3.16Å; R77-G135 PolarHBondContact NH2-O 3.02Å
78	N	92.8	Very high	94.8	Very high	67 Å²	67	30.4 Å²	30.4	36%	0.358	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	33.3	177.3	-160.5	16.3	0	0	0	114.5	D74 A75 L93 H94	D74-N78 PolarHBondContact O-N 2.97Å; D74-N78 VanDerWaalsContact O-N 3.15Å; A75-N78 PolarHBondContact O-N 3.25Å; N78-L93 PolarHBondContact O-N 3.01Å; N78-L93 VanDerWaalsContact O-N 3.11Å; N78-H94 PolarHBondContact ND2-CD2 2.93Å; N78-H94 PolarHBondContact ND2-NE2 2.95Å
79	Q	94.8	Very high	94.9	Very high	4 Å²	4	30.4 Å²	30.4	2%	0.019	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	145.5	-172.8	68	-176.4	-8.5	0	0	113.2	D74 R77 R90 L91 L93 I99	D74-Q79 WeakPolarHBondContact CA-O 3.06Å; D74-Q79 HydrophobicContact CB-CG 3.87Å; D74-Q79 PolarHBondContact N-O 3.41Å; D74-Q79 PolarHBondContact O-N 2.99Å; D74-Q79 PolarHBondContact OD2-NE2 2.76Å; R77-Q79 HydrophobicContact CB-CG 4.04Å; R77-Q79 PolarHBondContact O-N 3.15Å; R77-Q79 VanDerWaalsContact O-N 3.16Å; Q79-R90 VanDerWaalsContact OE1-CZ 3.27Å; Q79-L91 CarbonylContact C-O 3.57Å; Q79-L91 WeakPolarHBondContact CA-O 3.5Å; Q79-L93 VanDerWaalsContact C-CG 3.5Å; Q79-I99 HydrophobicContact CB-CD1 4.38Å
80	L	96.4	Very high	95	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	131.2	167.2	168	65.3	0	0	0	108.2	L71 L73 V82 R90 L91 L93 F483 V490	L71-L80 HydrophobicContact CB-CD1 4.15Å; L71-L80 HydrophobicContact CD2-CD1 4.28Å; L71-L80 HydrophobicContact CD2-CD2 4.44Å; L73-L80 HydrophobicContact CD2-CD1 3.86Å; L80-V82 HydrophobicContact CD1-CG2 4.24Å; L80-V82 HydrophobicContact CD2-CG2 3.8Å; L80-V82 HydrophobicContact CG-CG2 3.66Å; L80-R90 WeakPolarHBondContact O-CA 3.45Å; L80-L91 HydrophobicContact CB-CB 4.39Å; L80-L91 HydrophobicContact CD2-CD1 4.33Å; L80-L91 PolarHBondContact N-O 2.88Å; L80-L91 PolarHBondContact O-N 3.17Å; L80-L93 HydrophobicContact CB-CD2 3.75Å; L80-F483 HydrophobicContact CD2-CD1 3.82Å; L80-F483 HydrophobicContact CD2-CE1 4.28Å; L80-V490 HydrophobicContact CD2-CG1 4.04Å
81	I	97.1	Very high	95.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	131.6	171	-47.7	-167.1	0	0	0	108.1	A72 F89 R90 L131 V133 V138 L158	A72-I81 PolarHBondContact N-O 2.03Å; A72-I81 PolarHBondContact O-N 2.9Å; I81-F89 WeakPolarHBondContact CA-O 3.06Å; I81-R90 HydrophobicContact CG1-CG 4.35Å; I81-L131 HydrophobicContact CB-CD2 4.45Å; I81-L131 HydrophobicContact CG2-CD1 4.05Å; I81-L131 HydrophobicContact CG2-CD2 4.18Å; I81-L131 WeakPolarHBondContact O-CD2 3.48Å; I81-V133 HydrophobicContact CD1-CG2 3.85Å; I81-V133 HydrophobicContact CG1-CG2 4.45Å; I81-V138 HydrophobicContact CD1-CG2 3.56Å; I81-L158 HydrophobicContact CG2-CD1 4.03Å
82	V	97.7	Very high	95	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	132.7	-175.4	-174.7	0	0	0	0	110.9	F68 Q70 L71 L80 L88 F89 L91 V490	F68-V82 HydrophobicContact CB-CG1 4.34Å; F68-V82 HydrophobicContact CD1-CG1 3.89Å; Q70-V82 CarbonylContact O-C 3.53Å; Q70-V82 WeakPolarHBondContact O-CA 3.08Å; L71-V82 HydrophobicContact CD2-CB 4.25Å; L71-V82 HydrophobicContact CD2-CG1 3.8Å; L71-V82 HydrophobicContact CD2-CG2 3.71Å; L80-V82 HydrophobicContact CD1-CG2 4.24Å; L80-V82 HydrophobicContact CD2-CG2 3.8Å; L80-V82 HydrophobicContact CG-CG2 3.66Å; V82-L88 CarbonylContact O-C 3.52Å; V82-L88 WeakPolarHBondContact O-CA 3.41Å; V82-F89 HydrophobicContact CB-CB 4.31Å; V82-F89 HydrophobicContact CB-CD2 4.49Å; V82-F89 PolarHBondContact N-O 2.77Å; V82-F89 PolarHBondContact O-N 3.11Å; V82-L91 HydrophobicContact CB-CD1 4.48Å; V82-L91 HydrophobicContact CG2-CD1 3.56Å; V82-L91 HydrophobicContact CG2-CG 4.27Å; V82-V490 HydrophobicContact CG1-CG2 4Å; V82-V490 HydrophobicContact CG2-CG2 4.25Å
83	G	96.9	Very high	95	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	125.9	168.7	0	0	0	0	0	110.8	S69 Q70	S69-G83 PolarHBondContact N-O 2.71Å; Q70-G83 PolarHBondContact N-O 2.92Å; Q70-G83 PolarHBondContact O-N 2.04Å
84	A	96.8	Very high	94.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	179	176.5	0	0	0	0	0	110.3	V65 D67 F68 N86 Y87 F89 V128	V65-A84 HydrophobicContact CG1-CB 3.68Å; D67-A84 WeakPolarHBondContact O-CA 3.4Å; F68-A84 HydrophobicContact CD1-CB 3.87Å; F68-A84 HydrophobicContact CE1-CB 4.07Å; F68-A84 HydrophobicContact CG-CB 4.12Å; F68-A84 HydrophobicContact CZ-CB 4.48Å; A84-N86 PolarHBondContact O-N 2.98Å; A84-Y87 PolarHBondContact N-O 3.47Å; A84-Y87 PolarHBondContact O-N 3.14Å; A84-F89 HydrophobicContact CB-CE2 4.06Å; A84-V128 WeakPolarHBondContact O-CG2 3.38Å
85	R	95.9	Very high	94.7	Very high	28 Å²	28	35.5 Å²	35.5	11%	0.106	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-54.5	122.7	170	174.3	-175.5	165.7	175.9	7.4	110.4	H66 Y87 E122 Q125 Y127	H66-R85 WeakPolarHBondContact O-CB 3.16Å; H66-R85 PolarHBondContact O-N 2.98Å; R85-Y87 PolarHBondContact O-N 3.23Å; R85-E122 IonicContact CZ-OE1 2.95Å; R85-E122 IonicContact CZ-OE2 3.34Å; R85-E122 VanDerWaalsContact NH1-CD 3.28Å; R85-E122 IonicContact NH1-OE1 3.94Å; R85-E122 PolarHBondContact NH1-OE1 2.84Å; R85-E122 VanDerWaalsContact NH1-OE1 3.14Å; R85-E122 IonicContact NH1-OE2 3.14Å; R85-E122 PolarHBondContact NH1-OE2 2.92Å; R85-E122 IonicContact NH2-OE1 3.05Å; R85-E122 PolarHBondContact NH2-OE1 3.36Å; R85-E122 IonicContact NH2-OE2 2.7Å; R85-Q125 HydrophobicContact CG-CB 4.12Å; R85-Y127 HydrophobicContact CB-CD1 4.18Å; R85-Y127 HydrophobicContact CB-CE1 4.01Å; R85-Y127 HydrophobicContact CG-CE1 4.25Å
86	N	95.9	Very high	95	Very high	27 Å²	27	33 Å²	33	14%	0.144	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	8.5	176.8	-59.6	-25.1	0	0	0	116.2	A84 W104 G105 Q125 N126	A84-N86 PolarHBondContact O-N 2.98Å; N86-W104 CarbonylContact O-C 3.5Å; N86-W104 VanDerWaalsContact O-C 3.3Å; N86-W104 PolarHBondContact O-N 2.76Å; N86-G105 PolarHBondContact O-N 2.72Å; N86-G105 WeakPolarHBondContact OD1-CA 3.49Å; N86-Q125 PolarHBondContact ND2-OE1 2.92Å; N86-N126 PolarHBondContact N-O 2.98Å; N86-N126 PolarHBondContact OD1-N 3.16Å
87	Y	96.8	Very high	95.3	Very high	64 Å²	64	28 Å²	28	25%	0.251	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	145.6	-173	-80.2	-93.2	0	0	0	113.1	Y62 V65 A84 R85 F89 A103	Y62-Y87 HydrophobicContact CE1-CE1 4.27Å; V65-Y87 HydrophobicContact CB-CD2 4.48Å; V65-Y87 HydrophobicContact CG1-CD2 4.32Å; V65-Y87 HydrophobicContact CG2-CD2 3.31Å; V65-Y87 HydrophobicContact CG2-CE2 3.51Å; V65-Y87 HydrophobicContact CG2-CG 4.03Å; A84-Y87 PolarHBondContact N-O 3.47Å; A84-Y87 PolarHBondContact O-N 3.14Å; R85-Y87 PolarHBondContact O-N 3.23Å; Y87-F89 HydrophobicContact CD1-CE1 4.23Å; Y87-F89 HydrophobicContact CD1-CZ 4.15Å; Y87-F89 AromaticContact CG-CZ 3.99Å; Y87-F89 HydrophobicContact CG-CZ 3.99Å; Y87-A103 HydrophobicContact CD1-CB 4.35Å; Y87-A103 HydrophobicContact CE1-CB 3.89Å
88	L	97.1	Very high	95.6	Very high	1 Å²	1	27 Å²	27	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	135.3	163.6	-60	168.7	0	0	0	108.7	V82 T102 W104 V128 L131 T140 L158	V82-L88 CarbonylContact O-C 3.52Å; V82-L88 WeakPolarHBondContact O-CA 3.41Å; L88-T102 PolarHBondContact N-O 3.25Å; L88-T102 PolarHBondContact O-N 2.93Å; L88-W104 HydrophobicContact CD1-CE3 3.8Å; L88-W104 HydrophobicContact CD1-CZ3 4.31Å; L88-W104 HydrophobicContact CD2-CE3 4.16Å; L88-W104 HydrophobicContact CD2-CZ3 4.38Å; L88-W104 HydrophobicContact CG-CE3 3.97Å; L88-V128 HydrophobicContact CD2-CG1 4.28Å; L88-V128 HydrophobicContact CD2-CG2 3.84Å; L88-L131 HydrophobicContact CD2-CD1 4.41Å; L88-T140 HydrophobicContact CD1-CG2 4Å; L88-T140 HydrophobicContact CD2-CG2 4.44Å; L88-L158 HydrophobicContact CB-CD1 3.64Å; L88-L158 HydrophobicContact CD1-CD1 4.47Å
89	F	97.1	Very high	95.7	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	150	176.2	-54.7	-81.2	0	0	0	111.3	F60 Y62 V65 F68 I81 V82 A84 Y87 L91 L98 Q100 A101	F60-F89 HydrophobicContact CE1-CB 4.47Å; F60-F89 HydrophobicContact CE1-CD1 4.06Å; F60-F89 HydrophobicContact CE1-CD2 4.12Å; F60-F89 HydrophobicContact CE1-CE1 4.3Å; F60-F89 HydrophobicContact CE1-CE2 4.34Å; F60-F89 AromaticContact CE1-CG 3.97Å; F60-F89 HydrophobicContact CE1-CG 3.97Å; F60-F89 HydrophobicContact CE1-CZ 4.43Å; F60-F89 AromaticContact CZ-CD1 3.82Å; F60-F89 HydrophobicContact CZ-CD1 3.82Å; F60-F89 AromaticContact CZ-CE1 3.98Å; F60-F89 HydrophobicContact CZ-CE1 3.98Å; F60-F89 HydrophobicContact CZ-CG 4.19Å; F60-F89 HydrophobicContact CZ-CZ 4.47Å; Y62-F89 HydrophobicContact CD1-CE1 4.38Å; Y62-F89 HydrophobicContact CD1-CZ 4.19Å; Y62-F89 AromaticContact CD2-CE1 3.64Å; Y62-F89 HydrophobicContact CD2-CE1 3.64Å; Y62-F89 HydrophobicContact CD2-CZ 4.14Å; Y62-F89 HydrophobicContact CE2-CE1 4.06Å; Y62-F89 AromaticContact CG-CE1 3.8Å; Y62-F89 HydrophobicContact CG-CE1 3.8Å; Y62-F89 AromaticContact CG-CZ 3.79Å; Y62-F89 HydrophobicContact CG-CZ 3.79Å; V65-F89 HydrophobicContact CG1-CE2 4.02Å; V65-F89 HydrophobicContact CG1-CZ 4.09Å; F68-F89 HydrophobicContact CD1-CE2 4.41Å; F68-F89 HydrophobicContact CE1-CD2 4.1Å; F68-F89 AromaticContact CE1-CE2 3.64Å; F68-F89 HydrophobicContact CE1-CE2 3.64Å; F68-F89 HydrophobicContact CE1-CZ 4.43Å; F68-F89 HydrophobicContact CZ-CE2 4.34Å; I81-F89 WeakPolarHBondContact CA-O 3.06Å; V82-F89 HydrophobicContact CB-CB 4.31Å; V82-F89 HydrophobicContact CB-CD2 4.49Å; V82-F89 PolarHBondContact N-O 2.77Å; V82-F89 PolarHBondContact O-N 3.11Å; A84-F89 HydrophobicContact CB-CE2 4.06Å; Y87-F89 HydrophobicContact CD1-CE1 4.23Å; Y87-F89 HydrophobicContact CD1-CZ 4.15Å; Y87-F89 AromaticContact CG-CZ 3.99Å; Y87-F89 HydrophobicContact CG-CZ 3.99Å; F89-L91 HydrophobicContact CB-CD2 4Å; F89-L91 HydrophobicContact CB-CG 4.17Å; F89-L98 HydrophobicContact CD1-CD1 3.93Å; F89-Q100 CarbonylContact C-O 3.59Å; F89-Q100 WeakPolarHBondContact CA-O 3.28Å; F89-A101 HydrophobicContact CD1-CB 3.83Å; F89-A101 HydrophobicContact CE1-CB 3.87Å
90	R	96.4	Very high	95.7	Very high	31 Å²	31	29.3 Å²	29.3	12%	0.117	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	126.3	159.9	-69.7	168.4	55.9	-145	5.4	108.1	Q79 L80 I81 I99 Q100 V155 G156 L158	Q79-R90 VanDerWaalsContact OE1-CZ 3.27Å; L80-R90 WeakPolarHBondContact O-CA 3.45Å; I81-R90 HydrophobicContact CG1-CG 4.35Å; R90-I99 HydrophobicContact CB-CB 4.28Å; R90-I99 WeakPolarHBondContact O-CA 3.06Å; R90-I99 WeakPolarHBondContact O-CB 3.46Å; R90-I99 PolarHBondContact O-N 3.39Å; R90-Q100 HydrophobicContact CB-CB 4.21Å; R90-Q100 PolarHBondContact N-O 2.03Å; R90-Q100 PolarHBondContact O-N 2.79Å; R90-Q100 VanDerWaalsContact O-N 3.12Å; R90-V155 PolarHBondContact NE-O 3.1Å; R90-G156 VanDerWaalsContact NH1-C 3.31Å; R90-G156 PolarHBondContact NH1-O 2.95Å; R90-L158 HydrophobicContact CG-CD1 3.8Å; R90-L158 HydrophobicContact CG-CD2 4.4Å; R90-L158 HydrophobicContact CG-CG 3.9Å
91	L	96.8	Very high	95.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	149.5	-174	-50.8	176.4	0	0	0	108.8	F60 Q79 L80 V82 F89 V96 S97 L98	F60-L91 HydrophobicContact CB-CD1 4.32Å; F60-L91 HydrophobicContact CD1-CD1 3.52Å; F60-L91 HydrophobicContact CD1-CD2 3.87Å; F60-L91 HydrophobicContact CD1-CG 4.38Å; F60-L91 HydrophobicContact CD2-CD2 3.99Å; F60-L91 HydrophobicContact CE1-CD1 4.02Å; F60-L91 HydrophobicContact CE1-CD2 3.8Å; F60-L91 HydrophobicContact CE2-CD2 3.94Å; F60-L91 HydrophobicContact CG-CD1 3.94Å; F60-L91 HydrophobicContact CG-CD2 3.96Å; F60-L91 HydrophobicContact CZ-CD2 3.85Å; Q79-L91 CarbonylContact C-O 3.57Å; Q79-L91 WeakPolarHBondContact CA-O 3.5Å; L80-L91 HydrophobicContact CB-CB 4.39Å; L80-L91 HydrophobicContact CD2-CD1 4.33Å; L80-L91 PolarHBondContact N-O 2.88Å; L80-L91 PolarHBondContact O-N 3.17Å; V82-L91 HydrophobicContact CB-CD1 4.48Å; V82-L91 HydrophobicContact CG2-CD1 3.56Å; V82-L91 HydrophobicContact CG2-CG 4.27Å; F89-L91 HydrophobicContact CB-CD2 4Å; F89-L91 HydrophobicContact CB-CG 4.17Å; L91-V96 HydrophobicContact CB-CG1 4.23Å; L91-V96 HydrophobicContact CD1-CG1 3.72Å; L91-S97 CarbonylContact C-O 3.58Å; L91-S97 VanDerWaalsContact CA-O 3.25Å; L91-S97 WeakPolarHBondContact CA-O 3.05Å; L91-L98 HydrophobicContact CD2-CB 4.38Å; L91-L98 HydrophobicContact CD2-CD1 3.74Å
92	S	95.5	Very high	95.7	Very high	17 Å²	17	31.6 Å²	31.6	12%	0.119	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	135.4	174.4	176.7	0	0	0	0	111.1	H94 V96 S97	S92-H94 PolarHBondContact O-N 3.47Å; S92-H94 PolarHBondContact OG-N 2.89Å; S92-V96 WeakPolarHBondContact O-CA 3.45Å; S92-V96 PolarHBondContact O-N 2.87Å; S92-S97 WeakPolarHBondContact CB-OG 3.4Å; S92-S97 PolarHBondContact N-O 3.23Å
93	L	94.3	Very high	95.6	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.01	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-24.7	174.2	-73.2	171.7	0	0	0	112.7	L73 N78 Q79 L80 L476 F483 K492	L73-L93 HydrophobicContact CD2-CD2 3.52Å; N78-L93 PolarHBondContact O-N 3.01Å; N78-L93 VanDerWaalsContact O-N 3.11Å; Q79-L93 VanDerWaalsContact C-CG 3.5Å; L80-L93 HydrophobicContact CB-CD2 3.75Å; L93-L476 HydrophobicContact CB-CD2 4.44Å; L93-L476 HydrophobicContact CD1-CD2 3.89Å; L93-L476 HydrophobicContact CD2-CD2 4.15Å; L93-L476 HydrophobicContact CG-CD2 4.38Å; L93-F483 HydrophobicContact CB-CZ 4.42Å; L93-F483 HydrophobicContact CD2-CE1 4.04Å; L93-F483 HydrophobicContact CD2-CE2 3.98Å; L93-F483 HydrophobicContact CD2-CZ 3.53Å; L93-K492 WeakPolarHBondContact O-CD 3.47Å; L93-K492 WeakPolarHBondContact O-CE 3.4Å; L93-K492 PolarHBondContact O-NZ 3.12Å
94	H	90.3	Very high	95.5	Very high	114 Å²	114	35.7 Å²	35.7	53%	0.528	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-48.1	-179.2	-67.8	-44.6	0	0	0	113	N78 S92 K492	N78-H94 PolarHBondContact ND2-CD2 2.93Å; N78-H94 PolarHBondContact ND2-NE2 2.95Å; S92-H94 PolarHBondContact O-N 3.47Å; S92-H94 PolarHBondContact OG-N 2.89Å; H94-K492 WeakPolarHBondContact O-CD 3.48Å; H94-K492 PolarHBondContact O-NZ 3Å
95	N	91.6	Very high	95.3	Very high	79 Å²	79	37.3 Å²	37.3	42%	0.422	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-142	15.8	-169.3	69.8	-15.6	0	0	0	114.3	S97	N95-S97 PolarHBondContact O-N 2.9Å; N95-S97 VanDerWaalsContact OD1-CB 3.25Å; N95-S97 WeakPolarHBondContact OD1-CB 3.36Å; N95-S97 PolarHBondContact OD1-N 3.21Å; N95-S97 PolarHBondContact OD1-OG 2.83Å
96	V	94.9	Very high	95.3	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.006	21%	0.211	C	C	.	.			trans	60.1	12.7	179.4	-150.1	0	0	0	0	114.1	F60 L91 S92 F483 V490 K492	F60-V96 HydrophobicContact CB-CB 4.2Å; F60-V96 HydrophobicContact CB-CG1 3.58Å; L91-V96 HydrophobicContact CB-CG1 4.23Å; L91-V96 HydrophobicContact CD1-CG1 3.72Å; S92-V96 WeakPolarHBondContact O-CA 3.45Å; S92-V96 PolarHBondContact O-N 2.87Å; V96-F483 HydrophobicContact CG2-CE1 4.44Å; V96-V490 HydrophobicContact CG1-CB 4.37Å; V96-V490 HydrophobicContact CG1-CG1 4.17Å; V96-K492 HydrophobicContact CG2-CB 3.33Å; V96-K492 HydrophobicContact CG2-CD 4.44Å; V96-K492 HydrophobicContact CG2-CG 4.48Å
97	S	95.4	Very high	95.2	Very high	53 Å²	53	40.3 Å²	40.3	37%	0.371	23%	0.231	S	C	.	.			trans	-65.4	146	179.9	58.6	0	0	0	0	112.7	L91 S92 N95 I99	L91-S97 CarbonylContact C-O 3.58Å; L91-S97 VanDerWaalsContact CA-O 3.25Å; L91-S97 WeakPolarHBondContact CA-O 3.05Å; S92-S97 WeakPolarHBondContact CB-OG 3.4Å; S92-S97 PolarHBondContact N-O 3.23Å; N95-S97 PolarHBondContact O-N 2.9Å; N95-S97 VanDerWaalsContact OD1-CB 3.25Å; N95-S97 WeakPolarHBondContact OD1-CB 3.36Å; N95-S97 PolarHBondContact OD1-N 3.21Å; N95-S97 PolarHBondContact OD1-OG 2.83Å; S97-I99 PolarHBondContact O-N 3.38Å
98	L	96.6	Very high	95.1	Very high	80 Å²	80	42.2 Å²	42.2	42%	0.419	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	117.8	-174	-176.9	61.5	0	0	0	112.3	F60 Y62 F89 L91 A101	F60-L98 HydrophobicContact CE2-CB 3.97Å; F60-L98 HydrophobicContact CE2-CD1 4.13Å; F60-L98 HydrophobicContact CE2-CD2 4.38Å; F60-L98 HydrophobicContact CE2-CG 4.39Å; F60-L98 HydrophobicContact CZ-CD1 4.03Å; Y62-L98 HydrophobicContact CE2-CD2 4.47Å; F89-L98 HydrophobicContact CD1-CD1 3.93Å; L91-L98 HydrophobicContact CD2-CB 4.38Å; L91-L98 HydrophobicContact CD2-CD1 3.74Å; L98-A101 HydrophobicContact CD1-CB 4.3Å; L98-A101 HydrophobicContact CD2-CB 4.37Å
99	I	95.4	Very high	94.9	Very high	88 Å²	88	47.3 Å²	47.3	45%	0.451	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-43.2	171.8	-57.8	170.7	0	0	0	110.3	Q79 R90 S97	Q79-I99 HydrophobicContact CB-CD1 4.38Å; R90-I99 HydrophobicContact CB-CB 4.28Å; R90-I99 WeakPolarHBondContact O-CA 3.06Å; R90-I99 WeakPolarHBondContact O-CB 3.46Å; R90-I99 PolarHBondContact O-N 3.39Å; S97-I99 PolarHBondContact O-N 3.38Å
100	Q	95.6	Very high	94.8	Very high	30 Å²	30	49 Å²	49	14%	0.14	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	128.2	179.9	178.5	174.9	14.6	0	0	110.5	F89 R90 T102 N157 S159	F89-Q100 CarbonylContact C-O 3.59Å; F89-Q100 WeakPolarHBondContact CA-O 3.28Å; R90-Q100 HydrophobicContact CB-CB 4.21Å; R90-Q100 PolarHBondContact N-O 2.03Å; R90-Q100 PolarHBondContact O-N 2.79Å; R90-Q100 VanDerWaalsContact O-N 3.12Å; Q100-T102 PolarHBondContact NE2-OG1 3.41Å; Q100-N157 PolarHBondContact NE2-OD1 2.97Å; Q100-S159 PolarHBondContact NE2-OG 2.83Å
101	A	96.3	Very high	94.8	Very high	38 Å²	38	50.1 Å²	50.1	31%	0.314	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	148.1	159.7	0	0	0	0	0	109.5	Y62 F89 L98	Y62-A101 HydrophobicContact CE2-CB 4.28Å; F89-A101 HydrophobicContact CD1-CB 3.83Å; F89-A101 HydrophobicContact CE1-CB 3.87Å; L98-A101 HydrophobicContact CD1-CB 4.3Å; L98-A101 HydrophobicContact CD2-CB 4.37Å
102	T	96.4	Very high	94.6	Very high	10 Å²	10	56 Å²	56	6%	0.061	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	111.8	176.6	-63.9	0	0	0	0	109.3	L88 Q100 L158 S159	L88-T102 PolarHBondContact N-O 3.25Å; L88-T102 PolarHBondContact O-N 2.93Å; Q100-T102 PolarHBondContact NE2-OG1 3.41Å; T102-L158 HydrophobicContact CG2-CB 4.27Å; T102-S159 PolarHBondContact OG1-OG 2.88Å
103	A	95.3	Very high	94.6	Very high	68 Å²	68	57.7 Å²	57.7	56%	0.562	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.9	140	175.6	0	0	0	0	0	110.9	Y87	Y87-A103 HydrophobicContact CD1-CB 4.35Å; Y87-A103 HydrophobicContact CE1-CB 3.89Å
104	W	94.9	Very high	94.7	Very high	18 Å²	18	57.6 Å²	57.6	7%	0.068	32%	0.317	C	S	.	.			trans	-153.8	52.4	176.5	-172.1	26.3	0	0	0	109.7	N86 L88 N126 V128 T140 M149 R153	N86-W104 CarbonylContact O-C 3.5Å; N86-W104 VanDerWaalsContact O-C 3.3Å; N86-W104 PolarHBondContact O-N 2.76Å; L88-W104 HydrophobicContact CD1-CE3 3.8Å; L88-W104 HydrophobicContact CD1-CZ3 4.31Å; L88-W104 HydrophobicContact CD2-CE3 4.16Å; L88-W104 HydrophobicContact CD2-CZ3 4.38Å; L88-W104 HydrophobicContact CG-CE3 3.97Å; W104-N126 VanDerWaalsContact CD2-ND2 3.34Å; W104-N126 WeakPolarHBondContact O-CB 3.17Å; W104-N126 PolarHBondContact O-ND2 2.75Å; W104-V128 HydrophobicContact CE3-CG2 4.06Å; W104-V128 HydrophobicContact CZ3-CG2 4.04Å; W104-T140 HydrophobicContact CE3-CG2 4.46Å; W104-T140 HydrophobicContact CH2-CG2 3.86Å; W104-T140 HydrophobicContact CZ3-CG2 3.63Å; W104-T140 WeakPolarHBondContact CZ3-OG1 3.35Å; W104-M149 HydrophobicContact CZ2-CG 3.8Å; W104-M149 HydrophobicContact CZ2-SD 4.13Å; W104-M149 PolarHBondContact NE1-SD 2.89Å; W104-R153 VanDerWaalsContact CD1-NH2 3.35Å
105	G	93.3	Very high	94.9	Very high	35 Å²	35	55.6 Å²	55.6	36%	0.361	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-75.6	168.3	170.3	0	0	0	0	0	112.7	N86	N86-G105 PolarHBondContact O-N 2.72Å; N86-G105 WeakPolarHBondContact OD1-CA 3.49Å
106	S	94.8	Very high	95.1	Very high	11 Å²	11	56.5 Å²	56.5	8%	0.077	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-77.8	140	176.1	-30.6	0	0	0	0	111.8	T110 N126 N144 A145	S106-T110 VanDerWaalsContact CB-OG1 3.3Å; S106-T110 WeakPolarHBondContact CB-OG1 3.39Å; S106-N126 PolarHBondContact OG-N 2.92Å; S106-N144 WeakPolarHBondContact CA-OD1 3.33Å; S106-N144 VanDerWaalsContact CB-OD1 3.25Å; S106-N144 WeakPolarHBondContact CB-OD1 3.38Å; S106-N144 PolarHBondContact OG-OD1 2.89Å; S106-A145 PolarHBondContact OG-N 2.9Å
107	D	94.2	Very high	95	Very high	107 Å²	107	61.3 Å²	61.3	57%	0.572	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-60	145.6	176.3	-58.6	-58.7	0	0	0	111.2	D109 T110 R111	D107-D109 VanDerWaalsContact C-N 3.34Å; D107-D109 PolarHBondContact O-N 2.94Å; D107-T110 HydrophobicContact CB-CG2 4.27Å; D107-T110 PolarHBondContact N-OG1 3.36Å; D107-T110 WeakPolarHBondContact O-CA 3.46Å; D107-T110 WeakPolarHBondContact O-CB 3.47Å; D107-T110 PolarHBondContact O-N 2.82Å; D107-T110 PolarHBondContact O-OG1 3.48Å; D107-R111 PolarHBondContact O-N 3.43Å; D107-R111 VanDerWaalsContact O-N 3.16Å
108	E	93.9	Very high	94.9	Very high	103 Å²	103	62.1 Å²	62.1	48%	0.481	36%	0.359	S	S	.	.	H	α-helix	trans	-59	-40.5	-167.8	-169.3	177.2	154.7	0	0	113.7	T110 R111 R112	E108-T110 VanDerWaalsContact C-N 3.26Å; E108-T110 PolarHBondContact O-N 2.78Å; E108-R111 WeakPolarHBondContact O-CA 3.32Å; E108-R111 WeakPolarHBondContact O-CB 3.49Å; E108-R111 PolarHBondContact O-N 3.45Å; E108-R112 VanDerWaalsContact CD-NH2 3.31Å; E108-R112 HydrophobicContact CG-CG 4.46Å; E108-R112 WeakPolarHBondContact O-CG 3.45Å; E108-R112 PolarHBondContact O-N 3.39Å; E108-R112 IonicContact OE1-CZ 3.24Å; E108-R112 VanDerWaalsContact OE1-CZ 3.24Å; E108-R112 IonicContact OE1-NE 3.14Å; E108-R112 PolarHBondContact OE1-NE 3.45Å; E108-R112 VanDerWaalsContact OE1-NE 3.14Å; E108-R112 IonicContact OE1-NH2 2.8Å; E108-R112 PolarHBondContact OE1-NH2 3.07Å; E108-R112 IonicContact OE2-NH2 2.72Å
109	D	94.7	Very high	94.8	Very high	109 Å²	109	60.4 Å²	60.4	58%	0.583	35%	0.348	S	S	*	.	H	α-helix	trans	-65.8	-27.7	177	-63.3	-51.4	0	0	0	113	D107 R112 S113	D107-D109 VanDerWaalsContact C-N 3.34Å; D107-D109 PolarHBondContact O-N 2.94Å; D109-R112 IonicContact OD1-CZ 2.66Å; D109-R112 IonicContact OD1-NH1 3.64Å; D109-R112 PolarHBondContact OD1-NH1 2.94Å; D109-S113 WeakPolarHBondContact O-CB 3.27Å; D109-S113 PolarHBondContact O-N 3.47Å
110	T	94.3	Very high	94.7	Very high	36 Å²	36	59.9 Å²	59.9	22%	0.221	35%	0.349	C	S	.	.	H	α-helix	trans	-71.4	-36.8	171.5	71.5	0	0	0	0	111.4	S106 D107 E108 S113 C114	S106-T110 VanDerWaalsContact CB-OG1 3.3Å; S106-T110 WeakPolarHBondContact CB-OG1 3.39Å; D107-T110 HydrophobicContact CB-CG2 4.27Å; D107-T110 PolarHBondContact N-OG1 3.36Å; D107-T110 WeakPolarHBondContact O-CA 3.46Å; D107-T110 WeakPolarHBondContact O-CB 3.47Å; D107-T110 PolarHBondContact O-N 2.82Å; D107-T110 PolarHBondContact O-OG1 3.48Å; E108-T110 VanDerWaalsContact C-N 3.26Å; E108-T110 PolarHBondContact O-N 2.78Å; T110-S113 PolarHBondContact O-N 3.06Å; T110-C114 WeakPolarHBondContact O-CB 3.44Å; T110-C114 PolarHBondContact O-N 3.37Å
111	R	95.4	Very high	94.5	Very high	54 Å²	54	63.5 Å²	63.5	20%	0.204	37%	0.366	C	S	.	.	H	α-helix	trans	-65.9	-45.6	173.7	-58.6	-166.3	-68.3	117.9	-0.3	111.3	D107 E108 S113 C114 Q115 E121 C124 A145	D107-R111 PolarHBondContact O-N 3.43Å; D107-R111 VanDerWaalsContact O-N 3.16Å; E108-R111 WeakPolarHBondContact O-CA 3.32Å; E108-R111 WeakPolarHBondContact O-CB 3.49Å; E108-R111 PolarHBondContact O-N 3.45Å; R111-S113 PolarHBondContact O-N 2.97Å; R111-C114 WeakPolarHBondContact O-CB 3.49Å; R111-C114 PolarHBondContact O-N 2.94Å; R111-C114 VanDerWaalsContact O-N 3.16Å; R111-Q115 WeakPolarHBondContact O-CG 3.36Å; R111-Q115 PolarHBondContact O-N 2.91Å; R111-E121 IonicContact NH1-OE1 3.17Å; R111-E121 PolarHBondContact NH1-OE1 3Å; R111-C124 WeakPolarHBondContact CD-O 3.35Å; R111-C124 WeakPolarHBondContact CG-O 3.45Å; R111-A145 HydrophobicContact CG-CB 4.39Å
112	R	94.6	Very high	94.3	Very high	124 Å²	124	66.6 Å²	66.6	47%	0.468	37%	0.374	S	S	.	.	H	α-helix	trans	-59.3	-44.1	172.9	-64.8	172	-171.5	166.9	-7.3	111.8	E108 D109 C114 Q115 S116	E108-R112 VanDerWaalsContact CD-NH2 3.31Å; E108-R112 HydrophobicContact CG-CG 4.46Å; E108-R112 WeakPolarHBondContact O-CG 3.45Å; E108-R112 PolarHBondContact O-N 3.39Å; E108-R112 IonicContact OE1-CZ 3.24Å; E108-R112 VanDerWaalsContact OE1-CZ 3.24Å; E108-R112 IonicContact OE1-NE 3.14Å; E108-R112 PolarHBondContact OE1-NE 3.45Å; E108-R112 VanDerWaalsContact OE1-NE 3.14Å; E108-R112 IonicContact OE1-NH2 2.8Å; E108-R112 PolarHBondContact OE1-NH2 3.07Å; E108-R112 IonicContact OE2-NH2 2.72Å; D109-R112 IonicContact OD1-CZ 2.66Å; D109-R112 IonicContact OD1-NH1 3.64Å; D109-R112 PolarHBondContact OD1-NH1 2.94Å; R112-C114 VanDerWaalsContact C-N 3.27Å; R112-C114 PolarHBondContact O-N 2.91Å; R112-Q115 PolarHBondContact O-N 2.97Å; R112-S116 PolarHBondContact O-N 2.03Å; R112-S116 PolarHBondContact O-OG 2.8Å
113	S	95.2	Very high	94.2	Very high	51 Å²	51	67.4 Å²	67.4	36%	0.357	38%	0.377	S	S	.	.	H	α-helix	trans	-67.4	-23.9	176.7	-174.6	0	0	0	0	113.7	D109 T110 R111 S116 K117	D109-S113 WeakPolarHBondContact O-CB 3.27Å; D109-S113 PolarHBondContact O-N 3.47Å; T110-S113 PolarHBondContact O-N 3.06Å; R111-S113 PolarHBondContact O-N 2.97Å; S113-S116 PolarHBondContact O-OG 2.95Å; S113-K117 WeakPolarHBondContact O-CD 3.38Å; S113-K117 WeakPolarHBondContact O-CE 3.23Å; S113-K117 VanDerWaalsContact O-CG 3.3Å; S113-K117 WeakPolarHBondContact O-CG 3.02Å; S113-K117 PolarHBondContact O-NZ 3.12Å; S113-K117 PolarHBondContact OG-NZ 3.47Å
114	C	95.1	Very high	94.2	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-77.7	-46.6	171	172.7	0	0	0	0	111	T110 R111 R112 S116 K117 C124 A145	T110-C114 WeakPolarHBondContact O-CB 3.44Å; T110-C114 PolarHBondContact O-N 3.37Å; R111-C114 WeakPolarHBondContact O-CB 3.49Å; R111-C114 PolarHBondContact O-N 2.94Å; R111-C114 VanDerWaalsContact O-N 3.16Å; R112-C114 VanDerWaalsContact C-N 3.27Å; R112-C114 PolarHBondContact O-N 2.91Å; C114-S116 VanDerWaalsContact C-N 3.34Å; C114-S116 PolarHBondContact O-N 2.96Å; C114-K117 WeakPolarHBondContact O-CB 3.06Å; C114-K117 PolarHBondContact O-N 2.98Å; C114-C124 HydrophobicContact CB-CB 3.69Å; C114-C124 WeakPolarHBondContact CB-SG 3.38Å; C114-C124 WeakPolarHBondContact SG-CA 3.28Å; C114-C124 WeakPolarHBondContact SG-CB 3.4Å; C114-C124 CovalentContact SG-SG 2.04Å; C114-C124 PolarHBondContact SG-SG 3.06Å; C114-A145 HydrophobicContact CB-CB 3.86Å; C114-A145 WeakPolarHBondContact CB-O 3.22Å
115	Q	95.1	Very high	94.2	Very high	72 Å²	72	64 Å²	64	34%	0.336	35%	0.35	S	S	.	.	H	α-helix	trans	-60.6	-40.3	176.6	-71.7	167.8	-26.4	0	0	112.1	R111 R112 K117 G118 C124	R111-Q115 WeakPolarHBondContact O-CG 3.36Å; R111-Q115 PolarHBondContact O-N 2.91Å; R112-Q115 PolarHBondContact O-N 2.97Å; Q115-K117 PolarHBondContact O-N 3Å; Q115-K117 VanDerWaalsContact O-N 3.14Å; Q115-G118 PolarHBondContact O-N 2.85Å; Q115-C124 HydrophobicContact CG-CB 4.37Å; Q115-C124 PolarHBondContact N-SG 2.83Å
116	S	95.4	Very high	94.4	Very high	98 Å²	98	62.3 Å²	62.3	69%	0.685	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-9.7	175.5	71.7	0	0	0	0	114.3	R112 S113 C114 G118	R112-S116 PolarHBondContact O-N 2.03Å; R112-S116 PolarHBondContact O-OG 2.8Å; S113-S116 PolarHBondContact O-OG 2.95Å; C114-S116 VanDerWaalsContact C-N 3.34Å; C114-S116 PolarHBondContact O-N 2.96Å; S116-G118 VanDerWaalsContact C-N 3.34Å
117	K	92.9	Very high	94.5	Very high	102 Å²	102	63.1 Å²	63.1	44%	0.443	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	13.1	169.6	-63.1	162.5	-170.1	151.2	0	112.3	S113 C114 Q115 F197	S113-K117 WeakPolarHBondContact O-CD 3.38Å; S113-K117 WeakPolarHBondContact O-CE 3.23Å; S113-K117 VanDerWaalsContact O-CG 3.3Å; S113-K117 WeakPolarHBondContact O-CG 3.02Å; S113-K117 PolarHBondContact O-NZ 3.12Å; S113-K117 PolarHBondContact OG-NZ 3.47Å; C114-K117 WeakPolarHBondContact O-CB 3.06Å; C114-K117 PolarHBondContact O-N 2.98Å; Q115-K117 PolarHBondContact O-N 3Å; Q115-K117 VanDerWaalsContact O-N 3.14Å; K117-F197 HydrophobicContact CB-CE2 4.4Å; K117-F197 HydrophobicContact CB-CZ 3.86Å; K117-F197 HydrophobicContact CD-CE2 3.83Å; K117-F197 HydrophobicContact CD-CZ 4.08Å; K117-F197 HydrophobicContact CG-CZ 4.5Å
118	G	93.3	Very high	94.6	Very high	71 Å²	71	58 Å²	58	73%	0.732	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	80	23.2	177	0	0	0	0	0	115	Q115 S116	Q115-G118 PolarHBondContact O-N 2.85Å; S116-G118 VanDerWaalsContact C-N 3.34Å
119	K	93.9	Very high	94.7	Very high	43 Å²	43	54.5 Å²	54.5	19%	0.187	29%	0.29	C	S	.	.			trans	-99.5	147.3	177.8	-70.2	-74.1	178.9	169.9	0	111.7	E123 C124 F146 D174 F197	K119-E123 HydrophobicContact CB-CB 4.35Å; K119-E123 HydrophobicContact CD-CB 4.36Å; K119-E123 HydrophobicContact CD-CG 4.49Å; K119-E123 VanDerWaalsContact CD-OE1 3.26Å; K119-E123 WeakPolarHBondContact CD-OE1 3.18Å; K119-E123 IonicContact NZ-OE1 2.74Å; K119-E123 PolarHBondContact NZ-OE1 2.04Å; K119-C124 WeakPolarHBondContact CB-SG 3.32Å; K119-F146 HydrophobicContact CD-CE1 3.95Å; K119-F146 HydrophobicContact CD-CE2 3.94Å; K119-F146 HydrophobicContact CD-CZ 3.59Å; K119-F146 VanDerWaalsContact CE-CZ 3.45Å; K119-F146 HydrophobicContact CG-CD2 4.38Å; K119-F146 HydrophobicContact CG-CE1 4.47Å; K119-F146 HydrophobicContact CG-CE2 4.22Å; K119-F146 HydrophobicContact CG-CZ 4.26Å; K119-D174 IonicContact NZ-OD2 3.59Å; K119-D174 PolarHBondContact NZ-OD2 3.08Å; K119-F197 HydrophobicContact CG-CZ 4.34Å
120	T	94.5	Very high	94.7	Very high	77 Å²	77	49.6 Å²	49.6	47%	0.472	26%	0.263	S	S	.	.			trans	-71.6	158.3	-179.5	58.2	0	0	0	0	112.3	E122 E123 C124	T120-E122 PolarHBondContact O-N 2.87Å; T120-E123 WeakPolarHBondContact CB-OE2 3.31Å; T120-E123 PolarHBondContact N-OE2 3.43Å; T120-E123 PolarHBondContact O-N 2.81Å; T120-E123 VanDerWaalsContact O-N 3.17Å; T120-E123 WeakPolarHBondContact OG1-CB 3.26Å; T120-E123 VanDerWaalsContact OG1-CG 3.28Å; T120-E123 WeakPolarHBondContact OG1-CG 3.11Å; T120-E123 PolarHBondContact OG1-N 2.04Å; T120-E123 PolarHBondContact OG1-OE2 2.88Å; T120-C124 WeakPolarHBondContact O-CB 3.44Å; T120-C124 PolarHBondContact O-N 2.79Å; T120-C124 PolarHBondContact O-SG 2.76Å
121	E	91.8	Very high	94.8	Very high	106 Å²	106	48.5 Å²	48.5	50%	0.495	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-32.9	176.2	-178.2	158.9	-153.4	0	0	112.7	R111 C124 Q125	R111-E121 IonicContact NH1-OE1 3.17Å; R111-E121 PolarHBondContact NH1-OE1 3Å; E121-C124 PolarHBondContact O-N 2.97Å; E121-Q125 WeakPolarHBondContact O-CG 3.42Å; E121-Q125 PolarHBondContact O-NE2 3.29Å
122	E	91.9	Very high	94.7	Very high	103 Å²	103	47.3 Å²	47.3	48%	0.481	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-42.4	174	-72.2	-66.3	116.4	0	0	112.1	R85 T120 C124 Q125 Y127	R85-E122 IonicContact CZ-OE1 2.95Å; R85-E122 IonicContact CZ-OE2 3.34Å; R85-E122 VanDerWaalsContact NH1-CD 3.28Å; R85-E122 IonicContact NH1-OE1 3.94Å; R85-E122 PolarHBondContact NH1-OE1 2.84Å; R85-E122 VanDerWaalsContact NH1-OE1 3.14Å; R85-E122 IonicContact NH1-OE2 3.14Å; R85-E122 PolarHBondContact NH1-OE2 2.92Å; R85-E122 IonicContact NH2-OE1 3.05Å; R85-E122 PolarHBondContact NH2-OE1 3.36Å; R85-E122 IonicContact NH2-OE2 2.7Å; T120-E122 PolarHBondContact O-N 2.87Å; E122-C124 VanDerWaalsContact C-N 3.32Å; E122-C124 PolarHBondContact O-N 3.12Å; E122-Q125 VanDerWaalsContact O-CG 3.22Å; E122-Q125 WeakPolarHBondContact O-CG 3.44Å; E122-Y127 WeakPolarHBondContact O-CE2 3.46Å; E122-Y127 PolarHBondContact O-OH 3Å
123	E	92.9	Very high	94.7	Very high	28 Å²	28	43.3 Å²	43.3	13%	0.131	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-35.6	171.4	-80.2	171.3	118.7	0	0	112.5	K119 T120 Q125 F146 R176	K119-E123 HydrophobicContact CB-CB 4.35Å; K119-E123 HydrophobicContact CD-CB 4.36Å; K119-E123 HydrophobicContact CD-CG 4.49Å; K119-E123 VanDerWaalsContact CD-OE1 3.26Å; K119-E123 WeakPolarHBondContact CD-OE1 3.18Å; K119-E123 IonicContact NZ-OE1 2.74Å; K119-E123 PolarHBondContact NZ-OE1 2.04Å; T120-E123 WeakPolarHBondContact CB-OE2 3.31Å; T120-E123 PolarHBondContact N-OE2 3.43Å; T120-E123 PolarHBondContact O-N 2.81Å; T120-E123 VanDerWaalsContact O-N 3.17Å; T120-E123 WeakPolarHBondContact OG1-CB 3.26Å; T120-E123 VanDerWaalsContact OG1-CG 3.28Å; T120-E123 WeakPolarHBondContact OG1-CG 3.11Å; T120-E123 PolarHBondContact OG1-N 2.04Å; T120-E123 PolarHBondContact OG1-OE2 2.88Å; E123-Q125 PolarHBondContact O-N 3.46Å; E123-F146 HydrophobicContact CB-CE2 3.91Å; E123-F146 HydrophobicContact CB-CZ 4.44Å; E123-R176 IonicContact OE1-CZ 2.86Å; E123-R176 IonicContact OE1-NH1 2.93Å; E123-R176 IonicContact OE1-NH2 3.84Å; E123-R176 PolarHBondContact OE1-NH2 2.74Å
124	C	95.6	Very high	94.4	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.007	24%	0.243	C	C	.	.	S	Bend	trans	-81.8	49.3	-175.7	-64.6	0	0	0	0	114	R111 C114 Q115 K119 T120 E121 E122 A145	R111-C124 WeakPolarHBondContact CD-O 3.35Å; R111-C124 WeakPolarHBondContact CG-O 3.45Å; C114-C124 HydrophobicContact CB-CB 3.69Å; C114-C124 WeakPolarHBondContact CB-SG 3.38Å; C114-C124 WeakPolarHBondContact SG-CA 3.28Å; C114-C124 WeakPolarHBondContact SG-CB 3.4Å; C114-C124 CovalentContact SG-SG 2.04Å; C114-C124 PolarHBondContact SG-SG 3.06Å; Q115-C124 HydrophobicContact CG-CB 4.37Å; Q115-C124 PolarHBondContact N-SG 2.83Å; K119-C124 WeakPolarHBondContact CB-SG 3.32Å; T120-C124 WeakPolarHBondContact O-CB 3.44Å; T120-C124 PolarHBondContact O-N 2.79Å; T120-C124 PolarHBondContact O-SG 2.76Å; E121-C124 PolarHBondContact O-N 2.97Å; E122-C124 VanDerWaalsContact C-N 3.32Å; E122-C124 PolarHBondContact O-N 3.12Å; C124-A145 HydrophobicContact CB-CB 4.21Å
125	Q	95.8	Very high	94	Very high	13 Å²	13	48 Å²	48	6%	0.061	27%	0.27	C	S	.	.	S	Bend	trans	-125.4	170.7	179.3	-53.6	-68.9	-27.7	0	0	110.2	R85 N86 E121 E122 E123 Y127 T143 A145	R85-Q125 HydrophobicContact CG-CB 4.12Å; N86-Q125 PolarHBondContact ND2-OE1 2.92Å; E121-Q125 WeakPolarHBondContact O-CG 3.42Å; E121-Q125 PolarHBondContact O-NE2 3.29Å; E122-Q125 VanDerWaalsContact O-CG 3.22Å; E122-Q125 WeakPolarHBondContact O-CG 3.44Å; E123-Q125 PolarHBondContact O-N 3.46Å; Q125-Y127 HydrophobicContact CB-CD2 4.23Å; Q125-Y127 HydrophobicContact CB-CE2 3.8Å; Q125-Y127 HydrophobicContact CG-CE2 4.5Å; Q125-T143 PolarHBondContact O-OG1 2.75Å; Q125-T143 VanDerWaalsContact O-OG1 3.11Å; Q125-A145 PolarHBondContact O-N 2.82Å
126	N	96.7	Very high	93.8	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.29	C	S	.	.			trans	-93.1	98.9	173.7	-172.1	23.6	0	0	0	110.5	N86 W104 S106 G142 T143 N144	N86-N126 PolarHBondContact N-O 2.98Å; N86-N126 PolarHBondContact OD1-N 3.16Å; W104-N126 VanDerWaalsContact CD2-ND2 3.34Å; W104-N126 WeakPolarHBondContact O-CB 3.17Å; W104-N126 PolarHBondContact O-ND2 2.75Å; S106-N126 PolarHBondContact OG-N 2.92Å; N126-G142 VanDerWaalsContact OD1-CA 3.24Å; N126-G142 WeakPolarHBondContact OD1-CA 3.07Å; N126-T143 PolarHBondContact OD1-N 3.28Å; N126-N144 HydrophobicContact CB-CB 4.43Å; N126-N144 WeakPolarHBondContact OD1-CA 3.34Å; N126-N144 PolarHBondContact OD1-N 2.86Å
127	Y	96.9	Very high	93.6	Very high	28 Å²	28	52 Å²	52	11%	0.11	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-90.4	118.4	173.3	-70.1	-92.1	0	0	0	109.6	D67 R85 E122 Q125 R129 G142 T143 P175	D67-Y127 HydrophobicContact CB-CD1 3.96Å; D67-Y127 HydrophobicContact CB-CE1 3.9Å; D67-Y127 WeakPolarHBondContact OD2-CD1 3.4Å; R85-Y127 HydrophobicContact CB-CD1 4.18Å; R85-Y127 HydrophobicContact CB-CE1 4.01Å; R85-Y127 HydrophobicContact CG-CE1 4.25Å; E122-Y127 WeakPolarHBondContact O-CE2 3.46Å; E122-Y127 PolarHBondContact O-OH 3Å; Q125-Y127 HydrophobicContact CB-CD2 4.23Å; Q125-Y127 HydrophobicContact CB-CE2 3.8Å; Q125-Y127 HydrophobicContact CG-CE2 4.5Å; Y127-R129 PolarHBondContact O-N 3.24Å; Y127-G142 CarbonylContact O-C 3.3Å; Y127-G142 WeakPolarHBondContact O-CA 3.41Å; Y127-T143 PolarHBondContact N-OG1 3.02Å; Y127-T143 PolarHBondContact O-N 3.15Å; Y127-P175 HydrophobicContact CD1-CB 4.22Å; Y127-P175 HydrophobicContact CD2-CB 3.54Å; Y127-P175 HydrophobicContact CD2-CG 3.87Å; Y127-P175 HydrophobicContact CE2-CB 4.04Å; Y127-P175 HydrophobicContact CE2-CG 3.97Å; Y127-P175 HydrophobicContact CG-CB 3.63Å; Y127-P175 HydrophobicContact CG-CG 4.44Å
128	V	96.6	Very high	93.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	128.1	174.4	-176.5	0	0	0	0	109	Q70 A84 L88 W104 L131 T140	Q70-V128 HydrophobicContact CB-CG1 4.3Å; Q70-V128 HydrophobicContact CG-CG1 4.22Å; Q70-V128 WeakPolarHBondContact CG-O 3.5Å; A84-V128 WeakPolarHBondContact O-CG2 3.38Å; L88-V128 HydrophobicContact CD2-CG1 4.28Å; L88-V128 HydrophobicContact CD2-CG2 3.84Å; W104-V128 HydrophobicContact CE3-CG2 4.06Å; W104-V128 HydrophobicContact CZ3-CG2 4.04Å; V128-L131 HydrophobicContact CG1-CB 4.49Å; V128-T140 WeakPolarHBondContact CG1-OG1 3.02Å
129	R	95.6	Very high	93.7	Very high	29 Å²	29	44.2 Å²	44.2	11%	0.109	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	-13.5	-175.5	-72.4	-72.5	173.5	-90.3	10.8	113.7	D67 S69 Q70 Y127 C141 T143 P172 P175	D67-R129 IonicContact OD2-CZ 2.76Å; D67-R129 VanDerWaalsContact OD2-CZ 3.25Å; D67-R129 IonicContact OD2-NH1 3.68Å; D67-R129 PolarHBondContact OD2-NH1 2.96Å; D67-R129 IonicContact OD2-NH2 3.76Å; D67-R129 PolarHBondContact OD2-NH2 3.43Å; S69-R129 PolarHBondContact OG-NH1 2.91Å; Q70-R129 PolarHBondContact NE2-O 3.42Å; Y127-R129 PolarHBondContact O-N 3.24Å; R129-C141 PolarHBondContact N-O 3.46Å; R129-T143 HydrophobicContact CG-CG2 4.07Å; R129-P172 HydrophobicContact CB-CG 4.08Å; R129-P172 HydrophobicContact CG-CG 4Å; R129-P175 PolarHBondContact NE-O 2.84Å; R129-P175 PolarHBondContact NH2-O 3.09Å
130	V	95.3	Very high	93.8	Very high	5 Å²	5	42.1 Å²	42.1	3%	0.03	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	131.9	166.8	179.1	0	0	0	0	108.9	I132 F139 T140 C141 R170 A181	V130-I132 HydrophobicContact CG1-CD1 3.78Å; V130-I132 HydrophobicContact CG1-CG1 3.92Å; V130-F139 HydrophobicContact CG1-CD1 4.19Å; V130-F139 HydrophobicContact CG1-CE1 4.24Å; V130-T140 CarbonylContact O-C 3.5Å; V130-T140 WeakPolarHBondContact O-CA 3.37Å; V130-T140 WeakPolarHBondContact O-CB 3.45Å; V130-T140 PolarHBondContact O-OG1 2.96Å; V130-C141 HydrophobicContact CB-CB 4.02Å; V130-C141 HydrophobicContact CG2-CB 4.39Å; V130-C141 PolarHBondContact N-O 2.95Å; V130-C141 VanDerWaalsContact N-O 3.09Å; V130-C141 PolarHBondContact O-N 2.77Å; V130-R170 WeakPolarHBondContact CG2-O 3.33Å; V130-A181 HydrophobicContact CG1-CB 4.01Å; V130-A181 HydrophobicContact CG2-CB 4.07Å
131	L	95.6	Very high	93.9	Very high	14 Å²	14	38.5 Å²	38.5	7%	0.073	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	107	175.5	-176.7	66.6	0	0	0	109.4	Q70 A72 I81 L88 V128 V138	Q70-L131 HydrophobicContact CB-CB 3.92Å; Q70-L131 HydrophobicContact CB-CD2 4.15Å; A72-L131 HydrophobicContact CB-CD2 3.98Å; A72-L131 HydrophobicContact CB-CG 3.93Å; I81-L131 HydrophobicContact CB-CD2 4.45Å; I81-L131 HydrophobicContact CG2-CD1 4.05Å; I81-L131 HydrophobicContact CG2-CD2 4.18Å; I81-L131 WeakPolarHBondContact O-CD2 3.48Å; L88-L131 HydrophobicContact CD2-CD1 4.41Å; V128-L131 HydrophobicContact CG1-CB 4.49Å; L131-V138 HydrophobicContact CD1-CG1 3.62Å
132	I	94.7	Very high	94.1	Very high	29 Å²	29	33.4 Å²	33.4	15%	0.149	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	127.4	-174.2	-55.6	172.8	0	0	0	108.9	V130 V138 F139 A181 I183 L189	V130-I132 HydrophobicContact CG1-CD1 3.78Å; V130-I132 HydrophobicContact CG1-CG1 3.92Å; I132-V138 CarbonylContact O-C 3.59Å; I132-V138 WeakPolarHBondContact O-CA 3.35Å; I132-F139 PolarHBondContact N-O 2.93Å; I132-F139 PolarHBondContact O-N 2.91Å; I132-A181 HydrophobicContact CD1-CB 4.17Å; I132-I183 HydrophobicContact CB-CD1 4.13Å; I132-I183 HydrophobicContact CD1-CD1 4.15Å; I132-I183 HydrophobicContact CD1-CG1 3.9Å; I132-I183 HydrophobicContact CG2-CB 4.17Å; I132-I183 HydrophobicContact CG2-CD1 3.96Å; I132-I183 HydrophobicContact CG2-CG1 4.16Å; I132-L189 HydrophobicContact CD1-CD1 4.25Å
133	V	92.9	Very high	94.3	Very high	39 Å²	39	28.5 Å²	28.5	24%	0.236	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	120.7	173.9	-179.4	0	0	0	0	108.6	A72 D74 I81 V138 V155	A72-V133 HydrophobicContact CB-CG2 4.02Å; D74-V133 HydrophobicContact CB-CG1 4.44Å; I81-V133 HydrophobicContact CD1-CG2 3.85Å; I81-V133 HydrophobicContact CG1-CG2 4.45Å; V133-V138 HydrophobicContact CG2-CG2 4.49Å; V133-V155 HydrophobicContact CG1-CG2 4.21Å
134	Y	89.4	Confident	94.5	Very high	94 Å²	94	27.7 Å²	27.7	37%	0.369	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	111.6	-178.4	176	-105.9	0	0	0	111	K136 K137 I183 S185	Y134-K136 PolarHBondContact O-N 2.03Å; Y134-K137 PolarHBondContact N-O 3.44Å; Y134-K137 PolarHBondContact O-N 3.47Å; Y134-K137 VanDerWaalsContact O-O 3.09Å; Y134-I183 HydrophobicContact CD1-CG2 4.49Å; Y134-I183 HydrophobicContact CD2-CG2 4.02Å; Y134-I183 HydrophobicContact CE2-CG2 4.42Å; Y134-I183 HydrophobicContact CG-CG2 4.07Å; Y134-S185 PolarHBondContact OH-O 2.85Å
135	G	87.6	Confident	94.5	Very high	55 Å²	55	27.7 Å²	27.7	57%	0.567	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.9	-101.8	-179.9	0	0	0	0	0	112.6	R77	R77-G135 PolarHBondContact NH2-O 3.02Å
136	K	89.4	Confident	94.5	Very high	174 Å²	174	27.3 Å²	27.3	76%	0.757	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.2	3.5	176.8	-64.7	178.5	-179	175	0	113.5	Y134 V155	Y134-K136 PolarHBondContact O-N 2.03Å; K136-V155 VanDerWaalsContact C-CG2 3.4Å; K136-V155 WeakPolarHBondContact O-CG2 3.33Å; K136-V155 PolarHBondContact O-N 2.97Å
137	K	92.2	Very high	94.4	Very high	82 Å²	82	30.1 Å²	30.1	36%	0.357	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	148.5	177.2	-63.1	-164.1	175.1	-167.6	0	111.2	Y134 R153 V155 I162 D163	Y134-K137 PolarHBondContact N-O 3.44Å; Y134-K137 PolarHBondContact O-N 3.47Å; Y134-K137 VanDerWaalsContact O-O 3.09Å; K137-R153 CarbonylContact C-O 3.54Å; K137-R153 WeakPolarHBondContact CA-O 3.41Å; K137-V155 VanDerWaalsContact C-CG2 3.4Å; K137-V155 WeakPolarHBondContact O-CG2 3.5Å; K137-I162 HydrophobicContact CD-CD1 4.07Å; K137-I162 HydrophobicContact CG-CD1 3.78Å; K137-D163 IonicContact NZ-OD1 3.96Å; K137-D163 PolarHBondContact NZ-OD1 2.9Å
138	V	94.2	Very high	94.3	Very high	1 Å²	1	29 Å²	29	1%	0.006	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	118.6	159.5	-174.2	0	0	0	0	106.5	I81 L131 I132 V133 S152 R153 V155 L158	I81-V138 HydrophobicContact CD1-CG2 3.56Å; L131-V138 HydrophobicContact CD1-CG1 3.62Å; I132-V138 CarbonylContact O-C 3.59Å; I132-V138 WeakPolarHBondContact O-CA 3.35Å; V133-V138 HydrophobicContact CG2-CG2 4.49Å; V138-S152 CarbonylContact O-C 3.58Å; V138-S152 VanDerWaalsContact O-CA 3.29Å; V138-S152 WeakPolarHBondContact O-CA 3.35Å; V138-R153 PolarHBondContact N-O 2.03Å; V138-R153 PolarHBondContact O-N 2.83Å; V138-V155 HydrophobicContact CG2-CB 4.24Å; V138-V155 HydrophobicContact CG2-CG2 3.6Å; V138-L158 HydrophobicContact CB-CD2 4.48Å; V138-L158 HydrophobicContact CG2-CD2 3.9Å
139	F	95	Very high	94.3	Very high	7 Å²	7	30.4 Å²	30.4	3%	0.031	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	127.3	167.6	-178.4	-100.6	0	0	0	108.5	V130 I132 C141 C150 I165 I183 L189 L208	V130-F139 HydrophobicContact CG1-CD1 4.19Å; V130-F139 HydrophobicContact CG1-CE1 4.24Å; I132-F139 PolarHBondContact N-O 2.93Å; I132-F139 PolarHBondContact O-N 2.91Å; F139-C141 WeakPolarHBondContact CE1-SG 3.5Å; F139-C141 WeakPolarHBondContact CZ-SG 3.27Å; F139-C150 HydrophobicContact CE2-CB 4.02Å; F139-C150 HydrophobicContact CZ-CB 3.82Å; F139-I165 HydrophobicContact CE2-CD1 4.05Å; F139-I183 HydrophobicContact CB-CD1 3.56Å; F139-I183 HydrophobicContact CD1-CD1 3.85Å; F139-I183 HydrophobicContact CG-CD1 3.79Å; F139-L189 HydrophobicContact CD1-CD1 4.16Å; F139-L189 HydrophobicContact CE1-CD1 3.79Å; F139-L189 HydrophobicContact CE1-CD2 3.58Å; F139-L189 HydrophobicContact CE1-CG 4.33Å; F139-L189 HydrophobicContact CZ-CD2 3.58Å; F139-L208 HydrophobicContact CD2-CD1 4.34Å; F139-L208 HydrophobicContact CE2-CD1 3.69Å; F139-L208 HydrophobicContact CZ-CD1 4.02Å
140	T	95.8	Very high	94.3	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	143.3	179.2	-177.7	0	0	0	0	112.3	L88 W104 V128 V130 C150 S151	L88-T140 HydrophobicContact CD1-CG2 4Å; L88-T140 HydrophobicContact CD2-CG2 4.44Å; W104-T140 HydrophobicContact CE3-CG2 4.46Å; W104-T140 HydrophobicContact CH2-CG2 3.86Å; W104-T140 HydrophobicContact CZ3-CG2 3.63Å; W104-T140 WeakPolarHBondContact CZ3-OG1 3.35Å; V128-T140 WeakPolarHBondContact CG1-OG1 3.02Å; V130-T140 CarbonylContact O-C 3.5Å; V130-T140 WeakPolarHBondContact O-CA 3.37Å; V130-T140 WeakPolarHBondContact O-CB 3.45Å; V130-T140 PolarHBondContact O-OG1 2.96Å; T140-C150 CarbonylContact O-C 3.57Å; T140-C150 VanDerWaalsContact O-CA 3.31Å; T140-C150 WeakPolarHBondContact O-CA 3.05Å; T140-S151 PolarHBondContact N-O 3.24Å; T140-S151 PolarHBondContact O-N 3.01Å
141	C	96.1	Very high	94.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	148.8	176.4	-46.8	0	0	0	0	110.9	R129 V130 F139 M149 C150 C171	R129-C141 PolarHBondContact N-O 3.46Å; V130-C141 HydrophobicContact CB-CB 4.02Å; V130-C141 HydrophobicContact CG2-CB 4.39Å; V130-C141 PolarHBondContact N-O 2.95Å; V130-C141 VanDerWaalsContact N-O 3.09Å; V130-C141 PolarHBondContact O-N 2.77Å; F139-C141 WeakPolarHBondContact CE1-SG 3.5Å; F139-C141 WeakPolarHBondContact CZ-SG 3.27Å; C141-M149 WeakPolarHBondContact CA-O 3.09Å; C141-C150 HydrophobicContact CB-CB 4.04Å; C141-C150 WeakPolarHBondContact CB-SG 3.43Å; C141-C150 WeakPolarHBondContact SG-CB 3.4Å; C141-C150 CovalentContact SG-SG 2.03Å; C141-C150 PolarHBondContact SG-SG 2.97Å; C141-C171 HydrophobicContact CB-CB 3.55Å
142	G	96.5	Very high	94.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	162.3	174.1	0	0	0	0	0	113	N126 Y127 N144 P148 M149 C171	N126-G142 VanDerWaalsContact OD1-CA 3.24Å; N126-G142 WeakPolarHBondContact OD1-CA 3.07Å; Y127-G142 CarbonylContact O-C 3.3Å; Y127-G142 WeakPolarHBondContact O-CA 3.41Å; G142-N144 PolarHBondContact O-N 3.5Å; G142-P148 WeakPolarHBondContact O-CA 3.07Å; G142-M149 PolarHBondContact N-O 2.79Å; G142-M149 PolarHBondContact O-N 2.98Å; G142-C171 VanDerWaalsContact CA-SG 3.57Å
143	T	95.9	Very high	94.2	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.147	C	C	.	.			trans	-61.5	-26.8	-173.7	59.7	0	0	0	0	113.7	Q125 N126 Y127 R129 A145 F146 S147 Y173 P175	Q125-T143 PolarHBondContact O-OG1 2.75Å; Q125-T143 VanDerWaalsContact O-OG1 3.11Å; N126-T143 PolarHBondContact OD1-N 3.28Å; Y127-T143 PolarHBondContact N-OG1 3.02Å; Y127-T143 PolarHBondContact O-N 3.15Å; R129-T143 HydrophobicContact CG-CG2 4.07Å; T143-A145 PolarHBondContact O-N 3.19Å; T143-F146 PolarHBondContact O-N 2.66Å; T143-F146 VanDerWaalsContact O-N 3.08Å; T143-S147 CarbonylContact O-C 3.56Å; T143-S147 PolarHBondContact O-N 3.18Å; T143-Y173 WeakPolarHBondContact CB-O 3.36Å; T143-P175 HydrophobicContact CG2-CB 4.22Å
144	N	96.4	Very high	94.3	Very high	11 Å²	11	29.2 Å²	29.2	6%	0.059	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	39.6	60.5	177.7	178.7	59.6	0	0	0	113.1	S106 N126 G142 F146 S147 M149	S106-N144 WeakPolarHBondContact CA-OD1 3.33Å; S106-N144 VanDerWaalsContact CB-OD1 3.25Å; S106-N144 WeakPolarHBondContact CB-OD1 3.38Å; S106-N144 PolarHBondContact OG-OD1 2.89Å; N126-N144 HydrophobicContact CB-CB 4.43Å; N126-N144 WeakPolarHBondContact OD1-CA 3.34Å; N126-N144 PolarHBondContact OD1-N 2.86Å; G142-N144 PolarHBondContact O-N 3.5Å; N144-F146 PolarHBondContact O-N 2.87Å; N144-S147 WeakPolarHBondContact CB-O 3.45Å; N144-S147 PolarHBondContact ND2-O 2.97Å; N144-S147 WeakPolarHBondContact O-CB 3.47Å; N144-S147 PolarHBondContact O-N 3.08Å; N144-S147 VanDerWaalsContact O-N 3.14Å; N144-M149 HydrophobicContact CB-CB 4.36Å; N144-M149 HydrophobicContact CB-CG 3.71Å; N144-M149 HydrophobicContact CB-SD 3.88Å; N144-M149 VanDerWaalsContact CG-SD 3.5Å
145	A	95.9	Very high	94.4	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.008	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	54.7	-177.9	0	0	0	0	0	113.6	S106 R111 C114 C124 Q125 T143 S147	S106-A145 PolarHBondContact OG-N 2.9Å; R111-A145 HydrophobicContact CG-CB 4.39Å; C114-A145 HydrophobicContact CB-CB 3.86Å; C114-A145 WeakPolarHBondContact CB-O 3.22Å; C124-A145 HydrophobicContact CB-CB 4.21Å; Q125-A145 PolarHBondContact O-N 2.82Å; T143-A145 PolarHBondContact O-N 3.19Å; A145-S147 VanDerWaalsContact C-N 3.25Å; A145-S147 PolarHBondContact O-N 2.68Å
146	F	94.9	Very high	94.5	Very high	4 Å²	4	24.4 Å²	24.4	2%	0.018	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	37.8	-178.4	-65.8	-111.9	0	0	0	112.8	K119 E123 T143 N144 Y173 D174 F197	K119-F146 HydrophobicContact CD-CE1 3.95Å; K119-F146 HydrophobicContact CD-CE2 3.94Å; K119-F146 HydrophobicContact CD-CZ 3.59Å; K119-F146 VanDerWaalsContact CE-CZ 3.45Å; K119-F146 HydrophobicContact CG-CD2 4.38Å; K119-F146 HydrophobicContact CG-CE1 4.47Å; K119-F146 HydrophobicContact CG-CE2 4.22Å; K119-F146 HydrophobicContact CG-CZ 4.26Å; E123-F146 HydrophobicContact CB-CE2 3.91Å; E123-F146 HydrophobicContact CB-CZ 4.44Å; T143-F146 PolarHBondContact O-N 2.66Å; T143-F146 VanDerWaalsContact O-N 3.08Å; N144-F146 PolarHBondContact O-N 2.87Å; F146-Y173 HydrophobicContact CB-CD1 4.25Å; F146-Y173 VanDerWaalsContact O-CD1 3.23Å; F146-Y173 WeakPolarHBondContact O-CD1 3.04Å; F146-Y173 WeakPolarHBondContact O-CE1 3.43Å; F146-D174 HydrophobicContact CE1-CB 3.57Å; F146-D174 VanDerWaalsContact CE1-OD2 3.26Å; F146-D174 WeakPolarHBondContact CE1-OD2 3.35Å; F146-D174 HydrophobicContact CZ-CB 3.84Å; F146-D174 WeakPolarHBondContact CZ-OD2 3.37Å; F146-F197 HydrophobicContact CB-CD2 3.85Å; F146-F197 HydrophobicContact CB-CE2 3.59Å; F146-F197 AromaticContact CD1-CD2 3.85Å; F146-F197 HydrophobicContact CD1-CD2 3.85Å; F146-F197 AromaticContact CD1-CE2 3.54Å; F146-F197 HydrophobicContact CD1-CE2 3.54Å; F146-F197 HydrophobicContact CD1-CZ 4.22Å; F146-F197 HydrophobicContact CG-CD2 4.28Å; F146-F197 AromaticContact CG-CE2 3.82Å; F146-F197 HydrophobicContact CG-CE2 3.82Å
147	S	95.1	Very high	94.7	Very high	60 Å²	60	19.3 Å²	19.3	42%	0.42	11%	0.112	S	C	.	.	S	Bend	trans	-145.3	66.8	175.2	-166.1	0	0	0	0	108.4	T143 N144 A145 M149	T143-S147 CarbonylContact O-C 3.56Å; T143-S147 PolarHBondContact O-N 3.18Å; N144-S147 WeakPolarHBondContact CB-O 3.45Å; N144-S147 PolarHBondContact ND2-O 2.97Å; N144-S147 WeakPolarHBondContact O-CB 3.47Å; N144-S147 PolarHBondContact O-N 3.08Å; N144-S147 VanDerWaalsContact O-N 3.14Å; A145-S147 VanDerWaalsContact C-N 3.25Å; A145-S147 PolarHBondContact O-N 2.68Å; S147-M149 PolarHBondContact O-N 2.75Å
148	P	95.6	Very high	94.8	Very high	5 Å²	5	15.4 Å²	15.4	3%	0.032	10%	0.095	C	C	.	.			trans	-59.6	136.3	-160.8	22.1	-33.4	0	0	0	112.2	G142 G167 V168 C171 Y173	G142-P148 WeakPolarHBondContact O-CA 3.07Å; P148-G167 WeakPolarHBondContact O-CA 3.5Å; P148-G167 PolarHBondContact O-N 2.97Å; P148-V168 HydrophobicContact CG-CG2 4.5Å; P148-C171 HydrophobicContact CB-CB 4.04Å; P148-Y173 HydrophobicContact CG-CD1 4.36Å; P148-Y173 HydrophobicContact CG-CD2 3.77Å; P148-Y173 HydrophobicContact CG-CE1 4.24Å; P148-Y173 HydrophobicContact CG-CE2 3.6Å; P148-Y173 HydrophobicContact CG-CG 4.14Å
149	M	95.7	Very high	94.7	Very high	28 Å²	28	18.8 Å²	18.8	14%	0.138	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	146.6	-176.6	74.6	-179.5	-52.5	0	0	111.5	W104 C141 G142 N144 S147	W104-M149 HydrophobicContact CZ2-CG 3.8Å; W104-M149 HydrophobicContact CZ2-SD 4.13Å; W104-M149 PolarHBondContact NE1-SD 2.89Å; C141-M149 WeakPolarHBondContact CA-O 3.09Å; G142-M149 PolarHBondContact N-O 2.79Å; G142-M149 PolarHBondContact O-N 2.98Å; N144-M149 HydrophobicContact CB-CB 4.36Å; N144-M149 HydrophobicContact CB-CG 3.71Å; N144-M149 HydrophobicContact CB-SD 3.88Å; N144-M149 VanDerWaalsContact CG-SD 3.5Å; S147-M149 PolarHBondContact O-N 2.75Å
150	C	96	Very high	94.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	152.5	173.9	-63.7	0	0	0	0	111.1	F139 T140 C141 I165	F139-C150 HydrophobicContact CE2-CB 4.02Å; F139-C150 HydrophobicContact CZ-CB 3.82Å; T140-C150 CarbonylContact O-C 3.57Å; T140-C150 VanDerWaalsContact O-CA 3.31Å; T140-C150 WeakPolarHBondContact O-CA 3.05Å; C141-C150 HydrophobicContact CB-CB 4.04Å; C141-C150 WeakPolarHBondContact CB-SG 3.43Å; C141-C150 WeakPolarHBondContact SG-CB 3.4Å; C141-C150 CovalentContact SG-SG 2.03Å; C141-C150 PolarHBondContact SG-SG 2.97Å; C150-I165 WeakPolarHBondContact CA-O 3.16Å; C150-I165 HydrophobicContact CB-CB 4.01Å; C150-I165 HydrophobicContact CB-CG2 4.33Å; C150-I165 WeakPolarHBondContact CB-O 3.47Å; C150-I165 PolarHBondContact N-O 3.21Å; C150-I165 PolarHBondContact O-N 3.2Å; C150-I165 VanDerWaalsContact O-O 3.08Å
151	S	95.2	Very high	94.6	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.007	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	137.7	171.1	59.3	0	0	0	0	110.8	T140 R153 D163	T140-S151 PolarHBondContact N-O 3.24Å; T140-S151 PolarHBondContact O-N 3.01Å; S151-R153 PolarHBondContact OG-NE 2.84Å; S151-D163 VanDerWaalsContact CA-O 3.32Å; S151-D163 WeakPolarHBondContact CA-O 3.09Å
152	S	94.1	Very high	94.5	Very high	8 Å²	8	30.5 Å²	30.5	6%	0.056	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	135.5	162.4	-47.8	0	0	0	0	109.9	V138 I162 D163	V138-S152 CarbonylContact O-C 3.58Å; V138-S152 VanDerWaalsContact O-CA 3.29Å; V138-S152 WeakPolarHBondContact O-CA 3.35Å; S152-I162 PolarHBondContact O-N 2.82Å; S152-D163 VanDerWaalsContact CB-CG 3.47Å; S152-D163 WeakPolarHBondContact CB-OD1 3.43Å; S152-D163 WeakPolarHBondContact CB-OD2 3.43Å; S152-D163 PolarHBondContact N-O 3Å; S152-D163 PolarHBondContact O-N 3.48Å; S152-D163 PolarHBondContact OG-OD1 3.29Å; S152-D163 PolarHBondContact OG-OD2 2.87Å
153	R	95.1	Very high	94.2	Very high	6 Å²	6	32.4 Å²	32.4	2%	0.023	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	156.6	-175.9	-66.8	164.8	-177.9	-113.4	10	110.7	W104 K137 V138 S151 L158 K160 I161	W104-R153 VanDerWaalsContact CD1-NH2 3.35Å; K137-R153 CarbonylContact C-O 3.54Å; K137-R153 WeakPolarHBondContact CA-O 3.41Å; V138-R153 PolarHBondContact N-O 2.03Å; V138-R153 PolarHBondContact O-N 2.83Å; S151-R153 PolarHBondContact OG-NE 2.84Å; R153-L158 WeakPolarHBondContact CD-O 3.25Å; R153-L158 PolarHBondContact NH1-O 3.4Å; R153-K160 WeakPolarHBondContact CA-O 3.32Å; R153-I161 HydrophobicContact CG-CG1 4.21Å
154	Q	94.4	Very high	94.1	Very high	77 Å²	77	40.3 Å²	40.3	36%	0.36	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	126.7	175.3	-175.3	171.3	-20.2	0	0	110.3	G156 N157 K160 I162	Q154-G156 PolarHBondContact O-N 3.02Å; Q154-G156 VanDerWaalsContact O-N 3.15Å; Q154-N157 CarbonylContact O-C 3.59Å; Q154-N157 PolarHBondContact O-N 3.46Å; Q154-K160 HydrophobicContact CB-CB 4.44Å; Q154-K160 PolarHBondContact N-O 3.2Å; Q154-I162 HydrophobicContact CB-CD1 4.41Å
155	V	92	Very high	93.9	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.018	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-36.9	-177.7	171.7	0	0	0	0	113.2	D74 R90 V133 K136 K137 V138 N157	D74-V155 WeakPolarHBondContact OD2-CG1 3.39Å; R90-V155 PolarHBondContact NE-O 3.1Å; V133-V155 HydrophobicContact CG1-CG2 4.21Å; K136-V155 VanDerWaalsContact C-CG2 3.4Å; K136-V155 WeakPolarHBondContact O-CG2 3.33Å; K136-V155 PolarHBondContact O-N 2.97Å; K137-V155 VanDerWaalsContact C-CG2 3.4Å; K137-V155 WeakPolarHBondContact O-CG2 3.5Å; V138-V155 HydrophobicContact CG2-CB 4.24Å; V138-V155 HydrophobicContact CG2-CG2 3.6Å; V155-N157 VanDerWaalsContact C-N 3.33Å; V155-N157 PolarHBondContact O-N 2.89Å
156	G	89.9	Confident	93.7	Very high	44 Å²	44	46.3 Å²	46.3	45%	0.454	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-8.3	178.2	0	0	0	0	0	115.6	R90 Q154	R90-G156 VanDerWaalsContact NH1-C 3.31Å; R90-G156 PolarHBondContact NH1-O 2.95Å; Q154-G156 PolarHBondContact O-N 3.02Å; Q154-G156 VanDerWaalsContact O-N 3.15Å
157	N	93.3	Very high	93.6	Very high	67 Å²	67	46.1 Å²	46.1	36%	0.358	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	102	176.8	-176.7	-13.8	0	0	0	110.8	Q100 Q154 V155 S159 K160	Q100-N157 PolarHBondContact NE2-OD1 2.97Å; Q154-N157 CarbonylContact O-C 3.59Å; Q154-N157 PolarHBondContact O-N 3.46Å; V155-N157 VanDerWaalsContact C-N 3.33Å; V155-N157 PolarHBondContact O-N 2.89Å; N157-S159 VanDerWaalsContact C-N 3.26Å; N157-S159 PolarHBondContact O-N 2.02Å; N157-S159 WeakPolarHBondContact OD1-CB 3.48Å; N157-S159 PolarHBondContact OD1-N 3.04Å; N157-S159 VanDerWaalsContact OD1-N 3.13Å; N157-K160 PolarHBondContact O-N 2.98Å; N157-K160 VanDerWaalsContact O-N 3.09Å
158	L	92.9	Very high	93.5	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	-20.3	-175	-58.4	-169.1	0	0	0	114.5	I81 L88 R90 T102 V138 R153 K160	I81-L158 HydrophobicContact CG2-CD1 4.03Å; L88-L158 HydrophobicContact CB-CD1 3.64Å; L88-L158 HydrophobicContact CD1-CD1 4.47Å; R90-L158 HydrophobicContact CG-CD1 3.8Å; R90-L158 HydrophobicContact CG-CD2 4.4Å; R90-L158 HydrophobicContact CG-CG 3.9Å; T102-L158 HydrophobicContact CG2-CB 4.27Å; V138-L158 HydrophobicContact CB-CD2 4.48Å; V138-L158 HydrophobicContact CG2-CD2 3.9Å; R153-L158 WeakPolarHBondContact CD-O 3.25Å; R153-L158 PolarHBondContact NH1-O 3.4Å; L158-K160 PolarHBondContact O-N 2.95Å
159	S	93.1	Very high	93.2	Very high	72 Å²	72	45.3 Å²	45.3	50%	0.503	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	-24.2	173.4	-50.8	0	0	0	0	111.9	Q100 T102 N157 I161	Q100-S159 PolarHBondContact NE2-OG 2.83Å; T102-S159 PolarHBondContact OG1-OG 2.88Å; N157-S159 VanDerWaalsContact C-N 3.26Å; N157-S159 PolarHBondContact O-N 2.02Å; N157-S159 WeakPolarHBondContact OD1-CB 3.48Å; N157-S159 PolarHBondContact OD1-N 3.04Å; N157-S159 VanDerWaalsContact OD1-N 3.13Å; S159-I161 PolarHBondContact O-N 3.36Å
160	K	94.1	Very high	93.1	Very high	114 Å²	114	45.5 Å²	45.5	50%	0.496	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	93.6	178.9	-170.6	177.6	169.2	-164.3	0	110.9	R153 Q154 N157 L158	R153-K160 WeakPolarHBondContact CA-O 3.32Å; Q154-K160 HydrophobicContact CB-CB 4.44Å; Q154-K160 PolarHBondContact N-O 3.2Å; N157-K160 PolarHBondContact O-N 2.98Å; N157-K160 VanDerWaalsContact O-N 3.09Å; L158-K160 PolarHBondContact O-N 2.95Å
161	I	94.7	Very high	93.1	Very high	57 Å²	57	45.5 Å²	45.5	29%	0.292	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	137.2	168	-57.2	172.7	0	0	0	108.9	R153 S159 D163 R164	R153-I161 HydrophobicContact CG-CG1 4.21Å; S159-I161 PolarHBondContact O-N 3.36Å; I161-D163 WeakPolarHBondContact CG2-O 3.04Å; I161-R164 HydrophobicContact CG2-CG 3.94Å
162	I	92.8	Very high	93.1	Very high	81 Å²	81	45.4 Å²	45.4	42%	0.415	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	-46.6	175.8	-57.3	169	0	0	0	109.3	K137 S152 Q154	K137-I162 HydrophobicContact CD-CD1 4.07Å; K137-I162 HydrophobicContact CG-CD1 3.78Å; S152-I162 PolarHBondContact O-N 2.82Å; Q154-I162 HydrophobicContact CB-CD1 4.41Å
163	D	91.2	Very high	93.1	Very high	41 Å²	41	47 Å²	47	22%	0.219	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	147	-178.5	48.9	-98.9	0	0	0	110.1	K137 S151 S152 I161 I165	K137-D163 IonicContact NZ-OD1 3.96Å; K137-D163 PolarHBondContact NZ-OD1 2.9Å; S151-D163 VanDerWaalsContact CA-O 3.32Å; S151-D163 WeakPolarHBondContact CA-O 3.09Å; S152-D163 VanDerWaalsContact CB-CG 3.47Å; S152-D163 WeakPolarHBondContact CB-OD1 3.43Å; S152-D163 WeakPolarHBondContact CB-OD2 3.43Å; S152-D163 PolarHBondContact N-O 3Å; S152-D163 PolarHBondContact O-N 3.48Å; S152-D163 PolarHBondContact OG-OD1 3.29Å; S152-D163 PolarHBondContact OG-OD2 2.87Å; I161-D163 WeakPolarHBondContact CG2-O 3.04Å; D163-I165 WeakPolarHBondContact OD2-CD1 3.31Å
164	R	93.4	Very high	93	Very high	165 Å²	165	47 Å²	47	62%	0.623	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-113.6	134.9	172.6	-70.5	-168.7	179.4	-153.1	1.6	108.5	I161	I161-R164 HydrophobicContact CG2-CG 3.94Å
165	I	92.6	Very high	93	Very high	36 Å²	36	44.1 Å²	44.1	19%	0.185	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	143.5	-171.3	-66	160.9	0	0	0	108.4	F139 C150 D163 G167 L208	F139-I165 HydrophobicContact CE2-CD1 4.05Å; C150-I165 WeakPolarHBondContact CA-O 3.16Å; C150-I165 HydrophobicContact CB-CB 4.01Å; C150-I165 HydrophobicContact CB-CG2 4.33Å; C150-I165 WeakPolarHBondContact CB-O 3.47Å; C150-I165 PolarHBondContact N-O 3.21Å; C150-I165 PolarHBondContact O-N 3.2Å; C150-I165 VanDerWaalsContact O-O 3.08Å; D163-I165 WeakPolarHBondContact OD2-CD1 3.31Å; I165-G167 PolarHBondContact O-N 3.38Å; I165-L208 HydrophobicContact CD1-CD1 4.08Å; I165-L208 HydrophobicContact CD1-CD2 3.95Å; I165-L208 HydrophobicContact CG2-CD2 4.29Å
166	N	92.4	Very high	92.9	Very high	102 Å²	102	51.5 Å²	51.5	55%	0.545	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	130.6	174.6	-175.4	0.6	0	0	0	110.7	V168 R170	N166-V168 WeakPolarHBondContact OD1-CG2 3.48Å; N166-V168 PolarHBondContact OD1-N 3.36Å; N166-V168 VanDerWaalsContact OD1-N 3.16Å; N166-R170 PolarHBondContact O-NH1 3.19Å
167	G	91.3	Very high	93	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.251	C	S	.	.			trans	-84.7	-8.3	-178	0	0	0	0	0	115.2	P148 I165 A169 R170 C171	P148-G167 WeakPolarHBondContact O-CA 3.5Å; P148-G167 PolarHBondContact O-N 2.97Å; I165-G167 PolarHBondContact O-N 3.38Å; G167-A169 PolarHBondContact O-N 2.86Å; G167-R170 CarbonylContact O-C 3.59Å; G167-R170 WeakPolarHBondContact O-CA 3.32Å; G167-R170 WeakPolarHBondContact O-CB 3.21Å; G167-R170 PolarHBondContact O-N 2.74Å; G167-C171 PolarHBondContact O-N 3.28Å
168	V	93.3	Very high	92.9	Very high	41 Å²	41	53 Å²	53	25%	0.248	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	135.1	171.9	176.3	0	0	0	0	110.6	P148 N166 R170 Y173 I195	P148-V168 HydrophobicContact CG-CG2 4.5Å; N166-V168 WeakPolarHBondContact OD1-CG2 3.48Å; N166-V168 PolarHBondContact OD1-N 3.36Å; N166-V168 VanDerWaalsContact OD1-N 3.16Å; V168-R170 PolarHBondContact O-N 2.94Å; V168-Y173 HydrophobicContact CG2-CE2 4.43Å; V168-Y173 WeakPolarHBondContact CG2-OH 3.48Å; V168-I195 HydrophobicContact CG1-CG2 3.99Å
169	A	90.4	Very high	93	Very high	7 Å²	7	54 Å²	54	6%	0.058	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.6	4.4	-173.5	0	0	0	0	0	116.3	G167 I195 Y205	G167-A169 PolarHBondContact O-N 2.86Å; A169-I195 HydrophobicContact CB-CD1 3.72Å; A169-I195 HydrophobicContact CB-CG1 3.73Å; A169-Y205 HydrophobicContact CB-CD1 3.44Å; A169-Y205 VanDerWaalsContact CB-CD1 3.44Å; A169-Y205 HydrophobicContact CB-CD2 4.44Å; A169-Y205 HydrophobicContact CB-CE1 3.83Å; A169-Y205 HydrophobicContact CB-CG 3.78Å; A169-Y205 WeakPolarHBondContact O-CD1 3.42Å
170	R	93.7	Very high	93.1	Very high	32 Å²	32	51.6 Å²	51.6	12%	0.121	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.2	-22.3	177.2	-59.1	-179.6	177.2	90.7	8.2	113	V130 N166 G167 V168 L189 S207	V130-R170 WeakPolarHBondContact CG2-O 3.33Å; N166-R170 PolarHBondContact O-NH1 3.19Å; G167-R170 CarbonylContact O-C 3.59Å; G167-R170 WeakPolarHBondContact O-CA 3.32Å; G167-R170 WeakPolarHBondContact O-CB 3.21Å; G167-R170 PolarHBondContact O-N 2.74Å; V168-R170 PolarHBondContact O-N 2.94Å; R170-L189 HydrophobicContact CB-CD2 4.16Å; R170-L189 HydrophobicContact CG-CD2 3.76Å; R170-S207 PolarHBondContact NE-OG 2.91Å; R170-S207 PolarHBondContact NH2-OG 3.1Å
171	C	94.2	Very high	93.1	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.227	C	C	.	.	S	Bend	trans	-150.6	142.4	-175.1	-179.9	0	0	0	0	109.6	C141 G142 P148 G167	C141-C171 HydrophobicContact CB-CB 3.55Å; G142-C171 VanDerWaalsContact CA-SG 3.57Å; P148-C171 HydrophobicContact CB-CB 4.04Å; G167-C171 PolarHBondContact O-N 3.28Å
172	P	95.4	Very high	93.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.22	C	C	.	.			trans	-68.8	157.8	178.3	27.8	-35.2	0	0	0	112	R129 H177 S179 T193	R129-P172 HydrophobicContact CB-CG 4.08Å; R129-P172 HydrophobicContact CG-CG 4Å; P172-H177 HydrophobicContact CB-CB 3.9Å; P172-S179 VanDerWaalsContact CD-OG 3.24Å; P172-S179 WeakPolarHBondContact CD-OG 3.43Å; P172-T193 WeakPolarHBondContact CA-OG1 3.39Å; P172-T193 WeakPolarHBondContact CD-OG1 3.02Å
173	Y	94.4	Very high	93.2	Very high	40 Å²	40	42.8 Å²	42.8	16%	0.157	21%	0.206	C	C	.	.	S	Bend	trans	-78.2	-49.6	171.1	-80.4	-106.7	0	0	0	112.3	T143 F146 P148 V168 I195 F197	T143-Y173 WeakPolarHBondContact CB-O 3.36Å; F146-Y173 HydrophobicContact CB-CD1 4.25Å; F146-Y173 VanDerWaalsContact O-CD1 3.23Å; F146-Y173 WeakPolarHBondContact O-CD1 3.04Å; F146-Y173 WeakPolarHBondContact O-CE1 3.43Å; P148-Y173 HydrophobicContact CG-CD1 4.36Å; P148-Y173 HydrophobicContact CG-CD2 3.77Å; P148-Y173 HydrophobicContact CG-CE1 4.24Å; P148-Y173 HydrophobicContact CG-CE2 3.6Å; P148-Y173 HydrophobicContact CG-CG 4.14Å; V168-Y173 HydrophobicContact CG2-CE2 4.43Å; V168-Y173 WeakPolarHBondContact CG2-OH 3.48Å; Y173-I195 WeakPolarHBondContact CE2-O 3.47Å; Y173-F197 HydrophobicContact CD1-CB 4.14Å; Y173-F197 HydrophobicContact CD1-CD2 4.09Å; Y173-F197 HydrophobicContact CE1-CB 4.35Å
174	D	94	Very high	93.2	Very high	7 Å²	7	41 Å²	41	4%	0.037	20%	0.196	C	C	.	.	S	Bend	trans	-89.7	131.3	-179.1	-163.1	-67.9	0	0	0	110.4	K119 F146 R176 H177	K119-D174 IonicContact NZ-OD2 3.59Å; K119-D174 PolarHBondContact NZ-OD2 3.08Å; F146-D174 HydrophobicContact CE1-CB 3.57Å; F146-D174 VanDerWaalsContact CE1-OD2 3.26Å; F146-D174 WeakPolarHBondContact CE1-OD2 3.35Å; F146-D174 HydrophobicContact CZ-CB 3.84Å; F146-D174 WeakPolarHBondContact CZ-OD2 3.37Å; D174-R176 PolarHBondContact O-N 3.18Å; D174-R176 VanDerWaalsContact O-N 3.1Å; D174-R176 VanDerWaalsContact OD1-CB 3.3Å; D174-R176 WeakPolarHBondContact OD1-CB 3.43Å; D174-R176 IonicContact OD1-CZ 3.42Å; D174-R176 PolarHBondContact OD1-N 3.5Å; D174-R176 IonicContact OD1-NE 3.82Å; D174-R176 PolarHBondContact OD1-NE 3.18Å; D174-R176 IonicContact OD1-NH2 3.56Å; D174-R176 PolarHBondContact OD1-NH2 2.98Å; D174-R176 IonicContact OD2-CZ 2.65Å; D174-R176 IonicContact OD2-NE 3.44Å; D174-R176 IonicContact OD2-NH2 2.7Å; D174-R176 PolarHBondContact OD2-NH2 3.35Å; D174-H177 PolarHBondContact O-N 2.03Å; D174-H177 VanDerWaalsContact O-N 3.07Å
175	P	92.8	Very high	92.7	Very high	17 Å²	17	37.7 Å²	37.7	11%	0.11	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-12.9	-178.9	26.9	-35.3	0	0	0	114.3	Y127 R129 T143	Y127-P175 HydrophobicContact CD1-CB 4.22Å; Y127-P175 HydrophobicContact CD2-CB 3.54Å; Y127-P175 HydrophobicContact CD2-CG 3.87Å; Y127-P175 HydrophobicContact CE2-CB 4.04Å; Y127-P175 HydrophobicContact CE2-CG 3.97Å; Y127-P175 HydrophobicContact CG-CB 3.63Å; Y127-P175 HydrophobicContact CG-CG 4.44Å; R129-P175 PolarHBondContact NE-O 2.84Å; R129-P175 PolarHBondContact NH2-O 3.09Å; T143-P175 HydrophobicContact CG2-CB 4.22Å
176	R	91.6	Very high	92.2	Very high	157 Å²	157	44.4 Å²	44.4	59%	0.592	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87	-14.5	174.8	-61.3	168.6	-71.1	-149.5	-11.3	113.8	E123 D174 N178	E123-R176 IonicContact OE1-CZ 2.86Å; E123-R176 IonicContact OE1-NH1 2.93Å; E123-R176 IonicContact OE1-NH2 3.84Å; E123-R176 PolarHBondContact OE1-NH2 2.74Å; D174-R176 PolarHBondContact O-N 3.18Å; D174-R176 VanDerWaalsContact O-N 3.1Å; D174-R176 VanDerWaalsContact OD1-CB 3.3Å; D174-R176 WeakPolarHBondContact OD1-CB 3.43Å; D174-R176 IonicContact OD1-CZ 3.42Å; D174-R176 PolarHBondContact OD1-N 3.5Å; D174-R176 IonicContact OD1-NE 3.82Å; D174-R176 PolarHBondContact OD1-NE 3.18Å; D174-R176 IonicContact OD1-NH2 3.56Å; D174-R176 PolarHBondContact OD1-NH2 2.98Å; D174-R176 IonicContact OD2-CZ 2.65Å; D174-R176 IonicContact OD2-NE 3.44Å; D174-R176 IonicContact OD2-NH2 2.7Å; D174-R176 PolarHBondContact OD2-NH2 3.35Å; R176-N178 PolarHBondContact O-N 3.47Å
177	H	92.1	Very high	91.9	Very high	64 Å²	64	40.5 Å²	40.5	30%	0.296	21%	0.206	S	C	.	.	S	Bend	trans	-77.9	118.4	178.8	-67.7	171.7	0	0	0	109.9	P172 D174 V194	P172-H177 HydrophobicContact CB-CB 3.9Å; D174-H177 PolarHBondContact O-N 2.03Å; D174-H177 VanDerWaalsContact O-N 3.07Å; H177-V194 HydrophobicContact CB-CG2 4.48Å; H177-V194 WeakPolarHBondContact ND1-CG2 3.47Å
178	N	91.2	Very high	91.9	Very high	80 Å²	80	40.9 Å²	40.9	43%	0.428	21%	0.208	S	C	.	.			trans	-68.8	135.7	175.8	-72.3	-13	0	0	0	110.4	R176 N228 F229	R176-N178 PolarHBondContact O-N 3.47Å; N178-N228 WeakPolarHBondContact CB-OD1 3.19Å; N178-N228 PolarHBondContact ND2-ND2 2.8Å; N178-N228 VanDerWaalsContact ND2-ND2 3.2Å; N178-N228 PolarHBondContact ND2-OD1 2.89Å; N178-F229 WeakPolarHBondContact CB-O 3.24Å
179	S	93.4	Very high	92	Very high	20 Å²	20	39 Å²	39	14%	0.14	20%	0.196	C	C	.	.			trans	-143.8	153.4	-178.4	59.6	0	0	0	0	109.8	P172 A192	P172-S179 VanDerWaalsContact CD-OG 3.24Å; P172-S179 WeakPolarHBondContact CD-OG 3.43Å; S179-A192 WeakPolarHBondContact CA-O 3Å
180	T	95.5	Very high	92.3	Very high	22 Å²	22	38.6 Å²	38.6	14%	0.135	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	152.5	175.8	-168.6	0	0	0	0	110.6	A192 F229 A231 A232	T180-A192 HydrophobicContact CG2-CB 4.06Å; T180-A192 PolarHBondContact N-O 3.09Å; T180-A192 PolarHBondContact O-N 3.13Å; T180-F229 HydrophobicContact CG2-CB 4.05Å; T180-A231 VanDerWaalsContact CG2-C 3.43Å; T180-A231 VanDerWaalsContact OG1-CA 3.26Å; T180-A231 WeakPolarHBondContact OG1-CA 3.38Å; T180-A232 HydrophobicContact CG2-CB 3.98Å; T180-A232 PolarHBondContact OG1-N 2.03Å; T180-A232 VanDerWaalsContact OG1-N 3.11Å
181	A	95.4	Very high	92.4	Very high	20 Å²	20	37.2 Å²	37.2	17%	0.165	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	150.1	178.2	0	0	0	0	0	111.2	V130 I132 L189 Y190 A191	V130-A181 HydrophobicContact CG1-CB 4.01Å; V130-A181 HydrophobicContact CG2-CB 4.07Å; I132-A181 HydrophobicContact CD1-CB 4.17Å; A181-L189 HydrophobicContact CB-CD1 4.14Å; A181-Y190 CarbonylContact C-O 3.34Å; A181-Y190 WeakPolarHBondContact CA-O 3.47Å; A181-A191 HydrophobicContact CB-CB 3.95Å
182	V	95.4	Very high	92.5	Very high	24 Å²	24	37.2 Å²	37.2	15%	0.145	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	145.8	175.4	65.8	0	0	0	0	109.3	Y190 A232 D234 T239	V182-Y190 PolarHBondContact N-O 3.04Å; V182-Y190 PolarHBondContact O-N 3.47Å; V182-A232 HydrophobicContact CB-CB 4.3Å; V182-A232 HydrophobicContact CG1-CB 3.93Å; V182-D234 HydrophobicContact CG2-CB 3.92Å; V182-T239 HydrophobicContact CG1-CG2 3.82Å
183	I	93.7	Very high	92.5	Very high	23 Å²	23	37.3 Å²	37.3	12%	0.118	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	126.8	171.8	-67.3	173.6	0	0	0	107.5	I132 Y134 F139 E188 L189	I132-I183 HydrophobicContact CB-CD1 4.13Å; I132-I183 HydrophobicContact CD1-CD1 4.15Å; I132-I183 HydrophobicContact CD1-CG1 3.9Å; I132-I183 HydrophobicContact CG2-CB 4.17Å; I132-I183 HydrophobicContact CG2-CD1 3.96Å; I132-I183 HydrophobicContact CG2-CG1 4.16Å; Y134-I183 HydrophobicContact CD1-CG2 4.49Å; Y134-I183 HydrophobicContact CD2-CG2 4.02Å; Y134-I183 HydrophobicContact CE2-CG2 4.42Å; Y134-I183 HydrophobicContact CG-CG2 4.07Å; F139-I183 HydrophobicContact CB-CD1 3.56Å; F139-I183 HydrophobicContact CD1-CD1 3.85Å; F139-I183 HydrophobicContact CG-CD1 3.79Å; I183-E188 CarbonylContact C-O 3.57Å; I183-E188 VanDerWaalsContact CA-O 3.32Å; I183-E188 WeakPolarHBondContact CA-O 3.41Å; I183-L189 HydrophobicContact CD1-CD1 4.22Å; I183-L189 HydrophobicContact CG1-CB 4.32Å; I183-L189 HydrophobicContact CG1-CD1 3.61Å
184	T	90.1	Very high	92.5	Very high	3 Å²	3	36 Å²	36	2%	0.018	19%	0.185	C	C	.	.			trans	-76	166.8	-179.6	67.9	0	0	0	0	112	R186 G187 E188 Y190 D234	T184-R186 PolarHBondContact O-N 3.01Å; T184-R186 PolarHBondContact OG1-N 2.97Å; T184-G187 PolarHBondContact O-N 2.7Å; T184-E188 PolarHBondContact N-O 2.86Å; T184-E188 WeakPolarHBondContact OG1-CB 3.49Å; T184-E188 PolarHBondContact OG1-N 2.71Å; T184-Y190 HydrophobicContact CG2-CD2 3.63Å; T184-Y190 HydrophobicContact CG2-CE2 3.41Å; T184-Y190 VanDerWaalsContact CG2-CE2 3.41Å; T184-D234 VanDerWaalsContact CA-OD2 3.29Å; T184-D234 WeakPolarHBondContact CA-OD2 3.39Å
185	S	84.3	Confident	92.4	Very high	97 Å²	97	37.1 Å²	37.1	68%	0.678	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-14.8	170.4	60.1	0	0	0	0	115	Y134	Y134-S185 PolarHBondContact OH-O 2.85Å
186	R	82.2	Confident	92.3	Very high	177 Å²	177	37.8 Å²	37.8	67%	0.668	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-4.7	173.4	-65.9	-178.5	177.6	-173.7	-2.5	113.6	T184 E188	T184-R186 PolarHBondContact O-N 3.01Å; T184-R186 PolarHBondContact OG1-N 2.97Å; R186-E188 HydrophobicContact CB-CG 4.01Å
187	G	86.3	Confident	92.1	Very high	20 Å²	20	34 Å²	34	21%	0.206	18%	0.181	C	C	.	.	S	Bend	trans	85.4	3.3	-175.4	0	0	0	0	0	114.8	T184	T184-G187 PolarHBondContact O-N 2.7Å
188	E	91.4	Very high	91.9	Very high	8 Å²	8	34.5 Å²	34.5	4%	0.037	19%	0.192	C	C	.	.			trans	-75.1	130.9	179.1	-50.2	178.9	170.6	0	0	110.5	I183 T184 R186 Y190	I183-E188 CarbonylContact C-O 3.57Å; I183-E188 VanDerWaalsContact CA-O 3.32Å; I183-E188 WeakPolarHBondContact CA-O 3.41Å; T184-E188 PolarHBondContact N-O 2.86Å; T184-E188 WeakPolarHBondContact OG1-CB 3.49Å; T184-E188 PolarHBondContact OG1-N 2.71Å; R186-E188 HydrophobicContact CB-CG 4.01Å; E188-Y190 HydrophobicContact CB-CD2 4.29Å; E188-Y190 HydrophobicContact CB-CE2 3.68Å; E188-Y190 VanDerWaalsContact OE2-CE2 3.29Å; E188-Y190 WeakPolarHBondContact OE2-CE2 3.37Å; E188-Y190 PolarHBondContact OE2-OH 2.74Å
189	L	94.2	Very high	91.7	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	121.6	175.8	177.3	73.1	0	0	0	110.4	I132 F139 R170 A181 I183 R206 S207 L208	I132-L189 HydrophobicContact CD1-CD1 4.25Å; F139-L189 HydrophobicContact CD1-CD1 4.16Å; F139-L189 HydrophobicContact CE1-CD1 3.79Å; F139-L189 HydrophobicContact CE1-CD2 3.58Å; F139-L189 HydrophobicContact CE1-CG 4.33Å; F139-L189 HydrophobicContact CZ-CD2 3.58Å; R170-L189 HydrophobicContact CB-CD2 4.16Å; R170-L189 HydrophobicContact CG-CD2 3.76Å; A181-L189 HydrophobicContact CB-CD1 4.14Å; I183-L189 HydrophobicContact CD1-CD1 4.22Å; I183-L189 HydrophobicContact CG1-CB 4.32Å; I183-L189 HydrophobicContact CG1-CD1 3.61Å; L189-R206 CarbonylContact O-C 3.49Å; L189-R206 WeakPolarHBondContact O-CA 3.41Å; L189-S207 PolarHBondContact N-O 3.04Å; L189-S207 PolarHBondContact O-N 2.93Å; L189-L208 HydrophobicContact CB-CB 4.32Å; L189-L208 HydrophobicContact CB-CD1 3.97Å; L189-L208 HydrophobicContact CB-CG 4.19Å; L189-L208 HydrophobicContact CD2-CD1 4.01Å
190	Y	96.3	Very high	91.5	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	120.2	169.5	-69.1	-108.7	0	0	0	107.8	A181 V182 T184 E188 R206 T239 F241 V263 K265 W278	A181-Y190 CarbonylContact C-O 3.34Å; A181-Y190 WeakPolarHBondContact CA-O 3.47Å; V182-Y190 PolarHBondContact N-O 3.04Å; V182-Y190 PolarHBondContact O-N 3.47Å; T184-Y190 HydrophobicContact CG2-CD2 3.63Å; T184-Y190 HydrophobicContact CG2-CE2 3.41Å; T184-Y190 VanDerWaalsContact CG2-CE2 3.41Å; E188-Y190 HydrophobicContact CB-CD2 4.29Å; E188-Y190 HydrophobicContact CB-CE2 3.68Å; E188-Y190 VanDerWaalsContact OE2-CE2 3.29Å; E188-Y190 WeakPolarHBondContact OE2-CE2 3.37Å; E188-Y190 PolarHBondContact OE2-OH 2.74Å; Y190-R206 HydrophobicContact CD1-CB 4.28Å; Y190-R206 HydrophobicContact CD1-CG 4.42Å; Y190-R206 HydrophobicContact CD2-CG 4.45Å; Y190-R206 HydrophobicContact CE1-CB 4.22Å; Y190-R206 HydrophobicContact CE1-CG 4.09Å; Y190-R206 HydrophobicContact CE2-CG 4.09Å; Y190-R206 WeakPolarHBondContact OH-CD 3.06Å; Y190-T239 HydrophobicContact CD1-CG2 3.93Å; Y190-T239 WeakPolarHBondContact CD1-OG1 3.31Å; Y190-T239 WeakPolarHBondContact CE1-OG1 3.3Å; Y190-T239 HydrophobicContact CG-CG2 3.94Å; Y190-F241 HydrophobicContact CD1-CZ 4.3Å; Y190-V263 HydrophobicContact CD1-CG2 4.24Å; Y190-V263 HydrophobicContact CE1-CG2 4.07Å; Y190-K265 WeakPolarHBondContact OH-CA 3.34Å; Y190-K265 PolarHBondContact OH-O 2.91Å; Y190-W278 HydrophobicContact CD1-CH2 4.09Å; Y190-W278 AromaticContact CE1-CH2 3.67Å; Y190-W278 HydrophobicContact CE1-CH2 3.67Å; Y190-W278 HydrophobicContact CE1-CZ3 4.37Å
191	A	96.6	Very high	91.4	Very high	2 Å²	2	39.3 Å²	39.3	2%	0.017	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	148.2	-176.9	0	0	0	0	0	111.2	A181 I204 Y205	A181-A191 HydrophobicContact CB-CB 3.95Å; A191-I204 WeakPolarHBondContact O-CA 3.4Å; A191-Y205 PolarHBondContact N-O 3.28Å; A191-Y205 PolarHBondContact O-N 3.24Å
192	A	96.8	Very high	91.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	116	175	0	0	0	0	0	109.8	S179 T180 A203 I204 F229 F241	S179-A192 WeakPolarHBondContact CA-O 3Å; T180-A192 HydrophobicContact CG2-CB 4.06Å; T180-A192 PolarHBondContact N-O 3.09Å; T180-A192 PolarHBondContact O-N 3.13Å; A192-A203 WeakPolarHBondContact CA-O 3.35Å; A192-I204 HydrophobicContact CB-CG1 3.79Å; A192-F229 HydrophobicContact CB-CB 4.32Å; A192-F229 HydrophobicContact CB-CD1 3.52Å; A192-F229 HydrophobicContact CB-CD2 4.11Å; A192-F229 HydrophobicContact CB-CE1 3.74Å; A192-F229 HydrophobicContact CB-CE2 4.27Å; A192-F229 HydrophobicContact CB-CG 3.73Å; A192-F229 HydrophobicContact CB-CZ 4.1Å; A192-F241 HydrophobicContact CB-CD1 3.89Å; A192-F241 HydrophobicContact CB-CE1 4.14Å
193	T	95.7	Very high	91.4	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.012	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.9	177.6	-170	-168.7	0	0	0	0	110.9	P172 A203	P172-T193 WeakPolarHBondContact CA-OG1 3.39Å; P172-T193 WeakPolarHBondContact CD-OG1 3.02Å; T193-A203 PolarHBondContact N-O 3.06Å; T193-A203 PolarHBondContact O-N 3.45Å; T193-A203 VanDerWaalsContact O-O 3.13Å
194	V	93.7	Very high	91.6	Very high	14 Å²	14	37 Å²	37	9%	0.085	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	141.7	165.6	-63.6	0	0	0	0	110.5	H177 D201	H177-V194 HydrophobicContact CB-CG2 4.48Å; H177-V194 WeakPolarHBondContact ND1-CG2 3.47Å; V194-D201 WeakPolarHBondContact CA-O 3.38Å
195	I	91.6	Very high	91.9	Very high	30 Å²	30	39 Å²	39	15%	0.154	20%	0.199	C	C	.	.			trans	-89.2	-21.6	-178.8	-67.5	-171.5	0	0	0	112.2	V168 A169 Y173 D201 A203	V168-I195 HydrophobicContact CG1-CG2 3.99Å; A169-I195 HydrophobicContact CB-CD1 3.72Å; A169-I195 HydrophobicContact CB-CG1 3.73Å; Y173-I195 WeakPolarHBondContact CE2-O 3.47Å; I195-D201 HydrophobicContact CB-CB 4.34Å; I195-D201 PolarHBondContact N-O 2.76Å; I195-A203 HydrophobicContact CD1-CB 3.37Å; I195-A203 HydrophobicContact CG1-CB 3.8Å
196	D	89.9	Confident	92.4	Very high	30 Å²	30	34.4 Å²	34.4	16%	0.16	17%	0.167	C	C	.	.	S	Bend	trans	-115	162.8	-170.8	76.6	-60.9	0	0	0	114.2	S198 G199 R200 D201	D196-S198 VanDerWaalsContact C-N 3.28Å; D196-S198 PolarHBondContact O-N 2.89Å; D196-S198 VanDerWaalsContact OD2-CA 3.24Å; D196-S198 WeakPolarHBondContact OD2-CA 3.35Å; D196-S198 VanDerWaalsContact OD2-CB 3.32Å; D196-S198 WeakPolarHBondContact OD2-CB 3.41Å; D196-S198 PolarHBondContact OD2-N 3.18Å; D196-S198 PolarHBondContact OD2-OG 3.42Å; D196-G199 PolarHBondContact O-N 3.03Å; D196-G199 WeakPolarHBondContact OD1-CA 3.04Å; D196-G199 PolarHBondContact OD1-N 3.3Å; D196-G199 PolarHBondContact OD2-N 2.04Å; D196-R200 PolarHBondContact OD1-N 2.94Å; D196-R200 PolarHBondContact OD2-N 3.28Å; D196-D201 HydrophobicContact CB-CB 4.36Å; D196-D201 PolarHBondContact OD1-N 3.05Å
197	F	88.3	Confident	92.9	Very high	79 Å²	79	26.3 Å²	26.3	35%	0.346	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-26.9	177.2	179.9	-88.5	0	0	0	113.7	K117 K119 F146 Y173	K117-F197 HydrophobicContact CB-CE2 4.4Å; K117-F197 HydrophobicContact CB-CZ 3.86Å; K117-F197 HydrophobicContact CD-CE2 3.83Å; K117-F197 HydrophobicContact CD-CZ 4.08Å; K117-F197 HydrophobicContact CG-CZ 4.5Å; K119-F197 HydrophobicContact CG-CZ 4.34Å; F146-F197 HydrophobicContact CB-CD2 3.85Å; F146-F197 HydrophobicContact CB-CE2 3.59Å; F146-F197 AromaticContact CD1-CD2 3.85Å; F146-F197 HydrophobicContact CD1-CD2 3.85Å; F146-F197 AromaticContact CD1-CE2 3.54Å; F146-F197 HydrophobicContact CD1-CE2 3.54Å; F146-F197 HydrophobicContact CD1-CZ 4.22Å; F146-F197 HydrophobicContact CG-CD2 4.28Å; F146-F197 AromaticContact CG-CE2 3.82Å; F146-F197 HydrophobicContact CG-CE2 3.82Å; Y173-F197 HydrophobicContact CD1-CB 4.14Å; Y173-F197 HydrophobicContact CD1-CD2 4.09Å; Y173-F197 HydrophobicContact CE1-CB 4.35Å
198	S	87.9	Confident	92.8	Very high	73 Å²	73	28.9 Å²	28.9	51%	0.51	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-4.9	-177.5	77.7	0	0	0	0	114.5	D196 R200	D196-S198 VanDerWaalsContact C-N 3.28Å; D196-S198 PolarHBondContact O-N 2.89Å; D196-S198 VanDerWaalsContact OD2-CA 3.24Å; D196-S198 WeakPolarHBondContact OD2-CA 3.35Å; D196-S198 VanDerWaalsContact OD2-CB 3.32Å; D196-S198 WeakPolarHBondContact OD2-CB 3.41Å; D196-S198 PolarHBondContact OD2-N 3.18Å; D196-S198 PolarHBondContact OD2-OG 3.42Å; S198-R200 VanDerWaalsContact C-N 3.35Å; S198-R200 WeakPolarHBondContact OG-CD 3.35Å; S198-R200 WeakPolarHBondContact OG-CG 3.5Å
199	G	87.4	Confident	92.4	Very high	25 Å²	25	29.6 Å²	29.6	26%	0.258	16%	0.156	S	C	.	.	S	Bend	trans	73.3	20.1	-179.9	0	0	0	0	0	115.1	D196	D196-G199 PolarHBondContact O-N 3.03Å; D196-G199 WeakPolarHBondContact OD1-CA 3.04Å; D196-G199 PolarHBondContact OD1-N 3.3Å; D196-G199 PolarHBondContact OD2-N 2.04Å
200	R	89.2	Confident	91.7	Very high	196 Å²	196	38 Å²	38	74%	0.74	20%	0.201	S	C	*	.			trans	-99.6	-11.7	-174.4	-66.6	-178.2	179.6	-164.4	-0.1	114.8	D196 S198 P202	D196-R200 PolarHBondContact OD1-N 2.94Å; D196-R200 PolarHBondContact OD2-N 3.28Å; S198-R200 VanDerWaalsContact C-N 3.35Å; S198-R200 WeakPolarHBondContact OG-CD 3.35Å; S198-R200 WeakPolarHBondContact OG-CG 3.5Å; R200-P202 WeakPolarHBondContact O-CD 3.43Å
201	D	93.6	Very high	91	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.011	21%	0.212	C	C	.	.			trans	-110.9	77.8	174.1	-170.1	15.8	0	0	0	110.9	V194 I195 D196 R215 Q218 Y219	V194-D201 WeakPolarHBondContact CA-O 3.38Å; I195-D201 HydrophobicContact CB-CB 4.34Å; I195-D201 PolarHBondContact N-O 2.76Å; D196-D201 HydrophobicContact CB-CB 4.36Å; D196-D201 PolarHBondContact OD1-N 3.05Å; D201-R215 IonicContact OD1-CZ 2.81Å; D201-R215 IonicContact OD1-NH1 3.69Å; D201-R215 IonicContact OD1-NH2 3.27Å; D201-R215 PolarHBondContact OD1-NH2 2.95Å; D201-R215 IonicContact OD2-CZ 3.6Å; D201-R215 IonicContact OD2-NH1 2.76Å; D201-R215 PolarHBondContact OD2-NH1 3.02Å; D201-R215 IonicContact OD2-NH2 3.62Å; D201-R215 PolarHBondContact OD2-NH2 3.3Å; D201-Q218 WeakPolarHBondContact OD1-CG 3.49Å; D201-Q218 WeakPolarHBondContact OD2-CG 3.31Å; D201-Q218 PolarHBondContact OD2-NE2 3.41Å; D201-Y219 HydrophobicContact CB-CE1 3.87Å
202	P	95.2	Very high	90.5	Very high	18 Å²	18	42.6 Å²	42.6	12%	0.117	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	135.6	172.9	31.5	-35.1	0	0	0	110.7	R200 L224 P227	R200-P202 WeakPolarHBondContact O-CD 3.43Å; P202-L224 HydrophobicContact CB-CD1 4.4Å; P202-L224 HydrophobicContact CG-CB 4.11Å; P202-P227 HydrophobicContact CB-CG 3.43Å; P202-P227 VanDerWaalsContact CB-CG 3.43Å; P202-P227 HydrophobicContact CG-CG 4.01Å
203	A	95.6	Very high	90.3	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.008	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	146.7	177.6	0	0	0	0	0	114.1	A192 T193 I195 T216	A192-A203 WeakPolarHBondContact CA-O 3.35Å; T193-A203 PolarHBondContact N-O 3.06Å; T193-A203 PolarHBondContact O-N 3.45Å; T193-A203 VanDerWaalsContact O-O 3.13Å; I195-A203 HydrophobicContact CD1-CB 3.37Å; I195-A203 HydrophobicContact CG1-CB 3.8Å; A203-T216 VanDerWaalsContact CA-OG1 3.28Å; A203-T216 WeakPolarHBondContact CA-OG1 3.27Å
204	I	97.2	Very high	90.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	121.5	156.9	-68.7	161	0	0	0	107	A191 A192 R215 T216 L224 F229 F241 F243 W278 F281	A191-I204 WeakPolarHBondContact O-CA 3.4Å; A192-I204 HydrophobicContact CB-CG1 3.79Å; I204-R215 CarbonylContact O-C 3.48Å; I204-R215 WeakPolarHBondContact O-CA 3.39Å; I204-T216 HydrophobicContact CB-CG2 3.85Å; I204-T216 PolarHBondContact N-OG1 3.45Å; I204-T216 VanDerWaalsContact N-OG1 3.11Å; I204-T216 PolarHBondContact O-N 3.01Å; I204-T216 VanDerWaalsContact O-N 3.12Å; I204-L224 HydrophobicContact CD1-CD2 4.46Å; I204-F229 HydrophobicContact CD1-CE1 4.33Å; I204-F229 HydrophobicContact CG1-CE1 4.03Å; I204-F229 HydrophobicContact CG1-CZ 4.46Å; I204-F241 HydrophobicContact CD1-CB 4.16Å; I204-F241 HydrophobicContact CD1-CD1 4.47Å; I204-F241 HydrophobicContact CD1-CD2 4.17Å; I204-F241 HydrophobicContact CD1-CG 4.01Å; I204-F241 HydrophobicContact CG1-CD1 4.27Å; I204-F241 HydrophobicContact CG1-CG 4.31Å; I204-F241 HydrophobicContact CG2-CD1 4.25Å; I204-F241 HydrophobicContact CG2-CD2 3.98Å; I204-F241 HydrophobicContact CG2-CE1 3.77Å; I204-F241 HydrophobicContact CG2-CE2 3.46Å; I204-F241 VanDerWaalsContact CG2-CE2 3.46Å; I204-F241 HydrophobicContact CG2-CG 4.34Å; I204-F241 HydrophobicContact CG2-CZ 3.33Å; I204-F243 HydrophobicContact CD1-CE1 4.49Å; I204-W278 PolarHBondContact O-NE1 2.81Å; I204-F281 HydrophobicContact CD1-CE2 3.79Å
205	Y	95.8	Very high	90.2	Very high	44 Å²	44	46.6 Å²	46.6	17%	0.173	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	138.3	-166.9	179.1	-117.3	0	0	0	112.2	A169 A191 P213 L214 R215	A169-Y205 HydrophobicContact CB-CD1 3.44Å; A169-Y205 VanDerWaalsContact CB-CD1 3.44Å; A169-Y205 HydrophobicContact CB-CD2 4.44Å; A169-Y205 HydrophobicContact CB-CE1 3.83Å; A169-Y205 HydrophobicContact CB-CG 3.78Å; A169-Y205 WeakPolarHBondContact O-CD1 3.42Å; A191-Y205 PolarHBondContact N-O 3.28Å; A191-Y205 PolarHBondContact O-N 3.24Å; Y205-P213 HydrophobicContact CE2-CB 3.88Å; Y205-L214 WeakPolarHBondContact CA-O 3.49Å; Y205-L214 VanDerWaalsContact CD2-O 3.32Å; Y205-L214 WeakPolarHBondContact CD2-O 3.38Å; Y205-R215 HydrophobicContact CD2-CB 4.08Å
206	R	95	Very high	90.4	Very high	1 Å²	1	45.2 Å²	45.2	0%	0.004	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	139.8	171.4	178.6	-176.1	69.9	-160.5	-2.7	111.4	L189 Y190 V211 P212 P213 L214 K265 D267 W278	L189-R206 CarbonylContact O-C 3.49Å; L189-R206 WeakPolarHBondContact O-CA 3.41Å; Y190-R206 HydrophobicContact CD1-CB 4.28Å; Y190-R206 HydrophobicContact CD1-CG 4.42Å; Y190-R206 HydrophobicContact CD2-CG 4.45Å; Y190-R206 HydrophobicContact CE1-CB 4.22Å; Y190-R206 HydrophobicContact CE1-CG 4.09Å; Y190-R206 HydrophobicContact CE2-CG 4.09Å; Y190-R206 WeakPolarHBondContact OH-CD 3.06Å; R206-V211 VanDerWaalsContact CZ-CG2 3.42Å; R206-P212 PolarHBondContact NE-O 2.82Å; R206-P212 PolarHBondContact NH2-O 3.24Å; R206-P213 VanDerWaalsContact O-CA 3.26Å; R206-P213 WeakPolarHBondContact O-CA 3.4Å; R206-P213 WeakPolarHBondContact O-CB 3.14Å; R206-L214 PolarHBondContact N-O 3.42Å; R206-L214 VanDerWaalsContact NH2-CD1 3.32Å; R206-K265 PolarHBondContact NH1-O 3.48Å; R206-D267 PolarHBondContact NH1-O 3.34Å; R206-D267 PolarHBondContact NH2-O 2.86Å; R206-W278 HydrophobicContact CB-CH2 3.53Å; R206-W278 HydrophobicContact CB-CZ2 3.69Å; R206-W278 HydrophobicContact CG-CH2 4.39Å
207	S	92.6	Very high	90.5	Very high	7 Å²	7	44.9 Å²	44.9	5%	0.049	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	-176	170.1	66.1	0	0	0	0	112.8	R170 L189 G209	R170-S207 PolarHBondContact NE-OG 2.91Å; R170-S207 PolarHBondContact NH2-OG 3.1Å; L189-S207 PolarHBondContact N-O 3.04Å; L189-S207 PolarHBondContact O-N 2.93Å; S207-G209 PolarHBondContact O-N 2.87Å
208	L	85.5	Confident	90.6	Very high	75 Å²	75	46 Å²	46	39%	0.393	25%	0.251	S	S	.	.	S	Bend	trans	64.4	2.4	-180	-48.3	-176.2	0	0	0	115.6	F139 I165 L189	F139-L208 HydrophobicContact CD2-CD1 4.34Å; F139-L208 HydrophobicContact CE2-CD1 3.69Å; F139-L208 HydrophobicContact CZ-CD1 4.02Å; I165-L208 HydrophobicContact CD1-CD1 4.08Å; I165-L208 HydrophobicContact CD1-CD2 3.95Å; I165-L208 HydrophobicContact CG2-CD2 4.29Å; L189-L208 HydrophobicContact CB-CB 4.32Å; L189-L208 HydrophobicContact CB-CD1 3.97Å; L189-L208 HydrophobicContact CB-CG 4.19Å; L189-L208 HydrophobicContact CD2-CD1 4.01Å
209	G	82	Confident	90.6	Very high	23 Å²	23	50 Å²	50	24%	0.237	26%	0.256	C	S	.	.	S	Bend	trans	-88.4	176.8	169.2	0	0	0	0	0	113.8	S207 V211	S207-G209 PolarHBondContact O-N 2.87Å; G209-V211 VanDerWaalsContact C-N 3.33Å
210	N	79.6	Confident	90.7	Very high	176 Å²	176	51.4 Å²	51.4	94%	0.941	26%	0.258	S	S	*	.	S	Bend	trans	-82.9	-12.2	172.7	-63	-15.9	0	0	0	113
211	V	82.6	Confident	90.7	Very high	40 Å²	40	45.1 Å²	45.1	24%	0.242	24%	0.243	C	C	.	.	S	Bend	trans	-89	154.9	175.7	-73.7	0	0	0	0	111.1	R206 G209 I268	R206-V211 VanDerWaalsContact CZ-CG2 3.42Å; G209-V211 VanDerWaalsContact C-N 3.33Å; V211-I268 HydrophobicContact CG1-CG2 4.2Å
212	P	85.9	Confident	90.6	Very high	58 Å²	58	47.6 Å²	47.6	38%	0.377	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-56.3	147.5	179.8	21.8	-34	0	0	0	112.7	R206 L214 I268	R206-P212 PolarHBondContact NE-O 2.82Å; R206-P212 PolarHBondContact NH2-O 3.24Å; P212-L214 PolarHBondContact O-N 2.83Å; P212-I268 HydrophobicContact CG-CB 4.11Å; P212-I268 HydrophobicContact CG-CG2 4.43Å; P212-I268 WeakPolarHBondContact CG-O 3.44Å
213	P	91.5	Very high	90.5	Very high	59 Å²	59	46.9 Å²	46.9	38%	0.383	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-71.9	127.5	175.8	30.8	-33	0	0	0	110.1	Y205 R206	Y205-P213 HydrophobicContact CE2-CB 3.88Å; R206-P213 VanDerWaalsContact O-CA 3.26Å; R206-P213 WeakPolarHBondContact O-CA 3.4Å; R206-P213 WeakPolarHBondContact O-CB 3.14Å
214	L	94.3	Very high	90.4	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.251	C	S	.	.			trans	-116.9	142.9	179.3	-61.9	177.3	0	0	0	110.7	Y205 R206 P212 D267 D276 W278	Y205-L214 WeakPolarHBondContact CA-O 3.49Å; Y205-L214 VanDerWaalsContact CD2-O 3.32Å; Y205-L214 WeakPolarHBondContact CD2-O 3.38Å; R206-L214 PolarHBondContact N-O 3.42Å; R206-L214 VanDerWaalsContact NH2-CD1 3.32Å; P212-L214 PolarHBondContact O-N 2.83Å; L214-D267 HydrophobicContact CD1-CB 4.07Å; L214-D276 WeakPolarHBondContact CA-O 3.08Å; L214-W278 HydrophobicContact CB-CD2 3.88Å; L214-W278 HydrophobicContact CB-CE3 4.05Å; L214-W278 HydrophobicContact CB-CG 4.44Å; L214-W278 HydrophobicContact CB-CH2 4.2Å; L214-W278 HydrophobicContact CB-CZ2 4.02Å; L214-W278 HydrophobicContact CB-CZ3 4.21Å; L214-W278 HydrophobicContact CD1-CD2 4.27Å; L214-W278 HydrophobicContact CD1-CE3 3.68Å; L214-W278 HydrophobicContact CD1-CZ3 3.85Å
215	R	94.5	Very high	90.3	Very high	42 Å²	42	49 Å²	49	16%	0.158	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-122.7	163.5	172.6	62.9	163.2	-67.2	155.3	11	112.9	D201 I204 Y205 D276 T277 W278	D201-R215 IonicContact OD1-CZ 2.81Å; D201-R215 IonicContact OD1-NH1 3.69Å; D201-R215 IonicContact OD1-NH2 3.27Å; D201-R215 PolarHBondContact OD1-NH2 2.95Å; D201-R215 IonicContact OD2-CZ 3.6Å; D201-R215 IonicContact OD2-NH1 2.76Å; D201-R215 PolarHBondContact OD2-NH1 3.02Å; D201-R215 IonicContact OD2-NH2 3.62Å; D201-R215 PolarHBondContact OD2-NH2 3.3Å; I204-R215 CarbonylContact O-C 3.48Å; I204-R215 WeakPolarHBondContact O-CA 3.39Å; Y205-R215 HydrophobicContact CD2-CB 4.08Å; R215-D276 PolarHBondContact N-O 2.92Å; R215-T277 HydrophobicContact CG-CG2 4.33Å; R215-T277 WeakPolarHBondContact O-CA 3.36Å; R215-T277 WeakPolarHBondContact O-CB 3.31Å; R215-T277 WeakPolarHBondContact O-CG2 3.25Å; R215-W278 VanDerWaalsContact O-CD1 3.27Å; R215-W278 PolarHBondContact O-N 2.91Å
216	T	94.8	Very high	90.1	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.006	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-72.5	149.7	163.8	45.2	0	0	0	0	111.3	A203 I204 Q218 W223 L224 F281	A203-T216 VanDerWaalsContact CA-OG1 3.28Å; A203-T216 WeakPolarHBondContact CA-OG1 3.27Å; I204-T216 HydrophobicContact CB-CG2 3.85Å; I204-T216 PolarHBondContact N-OG1 3.45Å; I204-T216 VanDerWaalsContact N-OG1 3.11Å; I204-T216 PolarHBondContact O-N 3.01Å; I204-T216 VanDerWaalsContact O-N 3.12Å; T216-Q218 PolarHBondContact O-N 2.76Å; T216-W223 HydrophobicContact CG2-CE3 3.83Å; T216-W223 HydrophobicContact CG2-CZ3 4.09Å; T216-L224 HydrophobicContact CG2-CD1 4.22Å; T216-L224 WeakPolarHBondContact OG1-CD1 3.14Å; T216-F281 HydrophobicContact CG2-CD2 4.17Å; T216-F281 HydrophobicContact CG2-CE2 4.18Å; T216-F281 HydrophobicContact CG2-CG 4.42Å; T216-F281 HydrophobicContact CG2-CZ 4.44Å
217	A	91.3	Very high	90.2	Very high	22 Å²	22	54.4 Å²	54.4	18%	0.182	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-50.8	127.7	-177.6	0	0	0	0	0	112.7	N220 W223	A217-N220 HydrophobicContact CB-CB 3.9Å; A217-W223 HydrophobicContact CB-CD2 3.75Å; A217-W223 HydrophobicContact CB-CE3 4.02Å; A217-W223 HydrophobicContact CB-CG 4.13Å; A217-W223 HydrophobicContact CB-CH2 4.46Å; A217-W223 HydrophobicContact CB-CZ2 4.25Å; A217-W223 HydrophobicContact CB-CZ3 4.37Å
218	Q	90.9	Very high	90.3	Very high	103 Å²	103	56.1 Å²	56.1	48%	0.481	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	138.6	-174	-159	177.9	31.2	0	0	111.9	D201 T216 N220	D201-Q218 WeakPolarHBondContact OD1-CG 3.49Å; D201-Q218 WeakPolarHBondContact OD2-CG 3.31Å; D201-Q218 PolarHBondContact OD2-NE2 3.41Å; T216-Q218 PolarHBondContact O-N 2.76Å; Q218-N220 PolarHBondContact O-N 3.05Å
219	Y	87.6	Confident	90.9	Very high	158 Å²	158	52.8 Å²	52.8	62%	0.62	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	15.4	-179.9	-51.5	-55.7	0	0	0	115.9	D201 S221	D201-Y219 HydrophobicContact CB-CE1 3.87Å; Y219-S221 PolarHBondContact O-N 3.14Å
220	N	90.2	Very high	91.6	Very high	54 Å²	54	53.1 Å²	53.1	29%	0.289	28%	0.276	S	S	.	.			trans	-90.9	95.4	-179.4	-172.7	-19.5	0	0	0	110.9	A217 Q218 K222 W223 L224	A217-N220 HydrophobicContact CB-CB 3.9Å; Q218-N220 PolarHBondContact O-N 3.05Å; N220-K222 PolarHBondContact O-N 3.21Å; N220-K222 VanDerWaalsContact O-N 3.17Å; N220-K222 WeakPolarHBondContact OD1-CB 3.28Å; N220-K222 PolarHBondContact OD1-N 2.97Å; N220-K222 VanDerWaalsContact OD1-N 3.09Å; N220-W223 HydrophobicContact CB-CB 4.33Å; N220-W223 HydrophobicContact CB-CG 4.41Å; N220-W223 WeakPolarHBondContact O-CB 3.05Å; N220-W223 PolarHBondContact O-N 2.88Å; N220-L224 PolarHBondContact O-N 3.37Å
221	S	89.9	Confident	92.4	Very high	63 Å²	63	45.2 Å²	45.2	44%	0.441	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-24.9	179.7	58.1	0	0	0	0	114	Y219 W223 L224 N225 V248	Y219-S221 PolarHBondContact O-N 3.14Å; S221-W223 VanDerWaalsContact C-N 3.3Å; S221-W223 PolarHBondContact O-N 3.15Å; S221-L224 CarbonylContact O-C 3.53Å; S221-N225 WeakPolarHBondContact O-CB 3.06Å; S221-V248 WeakPolarHBondContact O-CG1 3.45Å
222	K	89.8	Confident	93	Very high	54 Å²	54	43.8 Å²	43.8	24%	0.235	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-34.2	174.2	-61.2	-166.5	170.2	-165.1	0	111.6	N220 K283 Q348 W355 F391	N220-K222 PolarHBondContact O-N 3.21Å; N220-K222 VanDerWaalsContact O-N 3.17Å; N220-K222 WeakPolarHBondContact OD1-CB 3.28Å; N220-K222 PolarHBondContact OD1-N 2.97Å; N220-K222 VanDerWaalsContact OD1-N 3.09Å; K222-K283 VanDerWaalsContact O-CE 3.31Å; K222-K283 WeakPolarHBondContact O-CE 3.25Å; K222-K283 PolarHBondContact O-NZ 3.48Å; K222-Q348 PolarHBondContact NZ-O 3.12Å; K222-W355 HydrophobicContact CD-CH2 4.06Å; K222-W355 HydrophobicContact CG-CH2 4.39Å; K222-F391 HydrophobicContact CB-CE2 3.67Å; K222-F391 HydrophobicContact CB-CZ 3.46Å; K222-F391 VanDerWaalsContact CB-CZ 3.46Å; K222-F391 HydrophobicContact CD-CZ 4.17Å; K222-F391 HydrophobicContact CG-CZ 4.44Å; K222-F391 VanDerWaalsContact O-CE2 3.28Å; K222-F391 WeakPolarHBondContact O-CE2 3.12Å
223	W	93.1	Very high	93.5	Very high	3 Å²	3	43 Å²	43	1%	0.011	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-49.3	176	-80.2	48	0	0	0	112.3	T216 A217 N220 S221 W278 F281 K283 F391	T216-W223 HydrophobicContact CG2-CE3 3.83Å; T216-W223 HydrophobicContact CG2-CZ3 4.09Å; A217-W223 HydrophobicContact CB-CD2 3.75Å; A217-W223 HydrophobicContact CB-CE3 4.02Å; A217-W223 HydrophobicContact CB-CG 4.13Å; A217-W223 HydrophobicContact CB-CH2 4.46Å; A217-W223 HydrophobicContact CB-CZ2 4.25Å; A217-W223 HydrophobicContact CB-CZ3 4.37Å; N220-W223 HydrophobicContact CB-CB 4.33Å; N220-W223 HydrophobicContact CB-CG 4.41Å; N220-W223 WeakPolarHBondContact O-CB 3.05Å; N220-W223 PolarHBondContact O-N 2.88Å; S221-W223 VanDerWaalsContact C-N 3.3Å; S221-W223 PolarHBondContact O-N 3.15Å; W223-W278 WeakPolarHBondContact CH2-O 3.4Å; W223-W278 HydrophobicContact CZ3-CB 4.37Å; W223-F281 HydrophobicContact CB-CE1 4.37Å; W223-F281 AromaticContact CD2-CD1 3.99Å; W223-F281 HydrophobicContact CD2-CD1 3.99Å; W223-F281 HydrophobicContact CD2-CE1 4.21Å; W223-F281 AromaticContact CE3-CD1 3.5Å; W223-F281 HydrophobicContact CE3-CD1 3.5Å; W223-F281 VanDerWaalsContact CE3-CD1 3.5Å; W223-F281 AromaticContact CE3-CE1 3.89Å; W223-F281 HydrophobicContact CE3-CE1 3.89Å; W223-F281 HydrophobicContact CE3-CG 4.15Å; W223-F281 HydrophobicContact CG-CE1 4.43Å; W223-F281 HydrophobicContact CH2-CB 4.41Å; W223-F281 HydrophobicContact CH2-CD1 4.47Å; W223-F281 HydrophobicContact CZ3-CB 3.98Å; W223-F281 AromaticContact CZ3-CD1 3.78Å; W223-F281 HydrophobicContact CZ3-CD1 3.78Å; W223-F281 HydrophobicContact CZ3-CG 4.05Å; W223-K283 WeakPolarHBondContact O-CE 3.42Å; W223-K283 PolarHBondContact O-NZ 3.18Å; W223-F391 AromaticContact CD1-CD1 3.66Å; W223-F391 AromaticContact CD1-CE1 3.72Å; W223-F391 AromaticContact CD1-CG 3.97Å; W223-F391 AromaticContact NE1-CD1 3.32Å; W223-F391 VanDerWaalsContact NE1-CD1 3.32Å; W223-F391 AromaticContact NE1-CE1 3.61Å; W223-F391 AromaticContact NE1-CG 3.93Å
224	L	94.9	Very high	93.7	Very high	10 Å²	10	42.6 Å²	42.6	5%	0.052	21%	0.212	C	C	.	.			trans	-146.8	119.9	-179.8	-71.6	176.9	0	0	0	110.4	P202 I204 T216 N220 S221 P227 F229 F243 F281	P202-L224 HydrophobicContact CB-CD1 4.4Å; P202-L224 HydrophobicContact CG-CB 4.11Å; I204-L224 HydrophobicContact CD1-CD2 4.46Å; T216-L224 HydrophobicContact CG2-CD1 4.22Å; T216-L224 WeakPolarHBondContact OG1-CD1 3.14Å; N220-L224 PolarHBondContact O-N 3.37Å; S221-L224 CarbonylContact O-C 3.53Å; L224-P227 HydrophobicContact CB-CG 4.09Å; L224-P227 HydrophobicContact CD2-CB 4.38Å; L224-P227 HydrophobicContact CD2-CG 4.24Å; L224-F229 HydrophobicContact CD1-CZ 4.23Å; L224-F229 HydrophobicContact CD2-CE1 4.41Å; L224-F243 HydrophobicContact CD2-CE1 4.44Å; L224-F243 HydrophobicContact CD2-CE2 3.74Å; L224-F243 HydrophobicContact CD2-CZ 3.69Å; L224-F281 HydrophobicContact CD2-CZ 4.47Å
225	N	94	Very high	93.6	Very high	36 Å²	36	43.2 Å²	43.2	19%	0.193	22%	0.215	C	C	.	.	S	Bend	trans	-118.2	92.9	-174.1	-163.3	16.5	0	0	0	113.1	S221 E245 N246 V248	S221-N225 WeakPolarHBondContact O-CB 3.06Å; N225-E245 PolarHBondContact N-OE2 3.45Å; N225-E245 WeakPolarHBondContact O-CB 3.49Å; N225-N246 HydrophobicContact CB-CB 4.27Å; N225-N246 VanDerWaalsContact CB-O 3.32Å; N225-N246 WeakPolarHBondContact CB-O 3.23Å; N225-N246 VanDerWaalsContact ND2-CB 3.3Å; N225-N246 WeakPolarHBondContact ND2-CB 3.39Å; N225-N246 PolarHBondContact ND2-O 3.01Å; N225-N246 PolarHBondContact O-N 3.26Å; N225-V248 HydrophobicContact CB-CG1 4.04Å; N225-V248 WeakPolarHBondContact ND2-CG1 3.36Å
226	E	93.4	Very high	93.4	Very high	141 Å²	141	44.3 Å²	44.3	66%	0.659	24%	0.239	S	C	*	.	S	Bend	trans	48.3	50.5	-172.9	-59.5	178.9	168.4	0	0	112.9	N246	E226-N246 PolarHBondContact OE2-ND2 3.13Å
227	P	95.6	Very high	93.1	Very high	17 Å²	17	48.8 Å²	48.8	11%	0.11	26%	0.262	C	S	.	.			trans	-73.1	140.4	-172.1	33.9	-38.2	0	0	0	112.7	P202 L224 F229 F243 R244 E245	P202-P227 HydrophobicContact CB-CG 3.43Å; P202-P227 VanDerWaalsContact CB-CG 3.43Å; P202-P227 HydrophobicContact CG-CG 4.01Å; L224-P227 HydrophobicContact CB-CG 4.09Å; L224-P227 HydrophobicContact CD2-CB 4.38Å; L224-P227 HydrophobicContact CD2-CG 4.24Å; P227-F229 HydrophobicContact CB-CE1 4.11Å; P227-F229 HydrophobicContact CB-CE2 4.4Å; P227-F229 HydrophobicContact CB-CZ 3.99Å; P227-F229 HydrophobicContact CG-CE1 4.17Å; P227-F229 HydrophobicContact CG-CE2 3.9Å; P227-F229 HydrophobicContact CG-CZ 3.56Å; P227-F243 HydrophobicContact CB-CD2 3.83Å; P227-F243 HydrophobicContact CB-CE2 4.32Å; P227-R244 CarbonylContact C-O 3.54Å; P227-R244 WeakPolarHBondContact CA-O 3.02Å; P227-E245 HydrophobicContact CB-CB 4.25Å
228	N	95.9	Very high	93.2	Very high	44 Å²	44	48.8 Å²	48.8	24%	0.235	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	116	165.8	-173.1	-62.6	0	0	0	108.1	N178 I230 F243 R244	N178-N228 WeakPolarHBondContact CB-OD1 3.19Å; N178-N228 PolarHBondContact ND2-ND2 2.8Å; N178-N228 VanDerWaalsContact ND2-ND2 3.2Å; N178-N228 PolarHBondContact ND2-OD1 2.89Å; N228-I230 VanDerWaalsContact O-CD1 3.27Å; N228-I230 WeakPolarHBondContact O-CD1 3.31Å; N228-F243 CarbonylContact O-C 3.5Å; N228-F243 VanDerWaalsContact O-CA 3.26Å; N228-F243 WeakPolarHBondContact O-CA 3.28Å; N228-F243 WeakPolarHBondContact O-CB 3.06Å; N228-R244 HydrophobicContact CB-CG 4.01Å; N228-R244 PolarHBondContact N-O 3.36Å; N228-R244 PolarHBondContact O-N 3.46Å
229	F	97.1	Very high	93.4	Very high	4 Å²	4	43.9 Å²	43.9	2%	0.018	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	129.1	-174.4	-59.1	-74.9	0	0	0	112.3	N178 T180 A192 I204 L224 P227 F243	N178-F229 WeakPolarHBondContact CB-O 3.24Å; T180-F229 HydrophobicContact CG2-CB 4.05Å; A192-F229 HydrophobicContact CB-CB 4.32Å; A192-F229 HydrophobicContact CB-CD1 3.52Å; A192-F229 HydrophobicContact CB-CD2 4.11Å; A192-F229 HydrophobicContact CB-CE1 3.74Å; A192-F229 HydrophobicContact CB-CE2 4.27Å; A192-F229 HydrophobicContact CB-CG 3.73Å; A192-F229 HydrophobicContact CB-CZ 4.1Å; I204-F229 HydrophobicContact CD1-CE1 4.33Å; I204-F229 HydrophobicContact CG1-CE1 4.03Å; I204-F229 HydrophobicContact CG1-CZ 4.46Å; L224-F229 HydrophobicContact CD1-CZ 4.23Å; L224-F229 HydrophobicContact CD2-CE1 4.41Å; P227-F229 HydrophobicContact CB-CE1 4.11Å; P227-F229 HydrophobicContact CB-CE2 4.4Å; P227-F229 HydrophobicContact CB-CZ 3.99Å; P227-F229 HydrophobicContact CG-CE1 4.17Å; P227-F229 HydrophobicContact CG-CE2 3.9Å; P227-F229 HydrophobicContact CG-CZ 3.56Å; F229-F243 HydrophobicContact CD1-CB 3.73Å; F229-F243 HydrophobicContact CD1-CD1 4.35Å; F229-F243 HydrophobicContact CD1-CG 4.14Å; F229-F243 HydrophobicContact CE1-CB 4.36Å; F229-F243 HydrophobicContact CE1-CD1 4.44Å; F229-F243 HydrophobicContact CE1-CG 4.32Å; F229-F243 HydrophobicContact CG-CB 4.46Å
230	I	96.3	Very high	93.8	Very high	31 Å²	31	36.7 Å²	36.7	16%	0.159	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-54.8	-175.6	-74.2	81.3	0	0	0	111	N228 F242 R244 L301 T304	N228-I230 VanDerWaalsContact O-CD1 3.27Å; N228-I230 WeakPolarHBondContact O-CD1 3.31Å; I230-F242 PolarHBondContact N-O 2.97Å; I230-R244 HydrophobicContact CD1-CG 4.38Å; I230-L301 HydrophobicContact CD1-CD2 4.47Å; I230-L301 HydrophobicContact CD1-CG 4.42Å; I230-L301 VanDerWaalsContact CD1-O 3.24Å; I230-L301 WeakPolarHBondContact CD1-O 3.34Å; I230-L301 HydrophobicContact CG1-CG 4.3Å; I230-T304 HydrophobicContact CG2-CG2 4.47Å
231	A	96.1	Very high	94.2	Very high	10 Å²	10	34.2 Å²	34.2	8%	0.083	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	157.2	-173.9	0	0	0	0	0	113.1	T180 Y233 F242 T304	T180-A231 VanDerWaalsContact CG2-C 3.43Å; T180-A231 VanDerWaalsContact OG1-CA 3.26Å; T180-A231 WeakPolarHBondContact OG1-CA 3.38Å; A231-Y233 HydrophobicContact CB-CE2 3.93Å; A231-F242 HydrophobicContact CB-CB 4.38Å; A231-F242 PolarHBondContact N-O 3.22Å; A231-F242 PolarHBondContact O-N 3.04Å; A231-T304 WeakPolarHBondContact CB-OG1 3.33Å
232	A	96.9	Very high	94.6	Very high	10 Å²	10	31.2 Å²	31.2	8%	0.083	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	141.7	165.4	0	0	0	0	0	109.8	T180 V182 Y240 F241	T180-A232 HydrophobicContact CG2-CB 3.98Å; T180-A232 PolarHBondContact OG1-N 2.03Å; T180-A232 VanDerWaalsContact OG1-N 3.11Å; V182-A232 HydrophobicContact CB-CB 4.3Å; V182-A232 HydrophobicContact CG1-CB 3.93Å; A232-Y240 CarbonylContact C-O 3.57Å; A232-Y240 WeakPolarHBondContact CA-O 3.32Å; A232-F241 HydrophobicContact CB-CD1 3.75Å; A232-F241 HydrophobicContact CB-CE1 3.9Å
233	Y	96.2	Very high	95	Very high	41 Å²	41	28.7 Å²	28.7	16%	0.161	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	136.8	-179.8	-58.6	-64.9	0	0	0	111.2	A231 Y240 F242 T304 F305 Y306 I313	A231-Y233 HydrophobicContact CB-CE2 3.93Å; Y233-Y240 PolarHBondContact N-O 3.39Å; Y233-Y240 PolarHBondContact O-N 3.31Å; Y233-F242 AromaticContact CD2-CD2 3.83Å; Y233-F242 HydrophobicContact CD2-CD2 3.83Å; Y233-F242 AromaticContact CD2-CE2 3.77Å; Y233-F242 HydrophobicContact CD2-CE2 3.77Å; Y233-F242 AromaticContact CE2-CD2 3.92Å; Y233-F242 HydrophobicContact CE2-CD2 3.92Å; Y233-F242 HydrophobicContact CE2-CE2 4.1Å; Y233-T304 WeakPolarHBondContact OH-CB 3.28Å; Y233-T304 PolarHBondContact OH-O 3.09Å; Y233-T304 VanDerWaalsContact OH-O 3.05Å; Y233-T304 PolarHBondContact OH-OG1 3.2Å; Y233-F305 PolarHBondContact OH-N 3.17Å; Y233-Y306 HydrophobicContact CD1-CD1 4.46Å; Y233-I313 HydrophobicContact CD2-CD1 4.5Å
234	D	94.1	Very high	95.2	Very high	50 Å²	50	30 Å²	30	27%	0.267	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	102	176	-174.3	23.6	0	0	0	109.3	V182 T184 K265	V182-D234 HydrophobicContact CG2-CB 3.92Å; T184-D234 VanDerWaalsContact CA-OD2 3.29Å; T184-D234 WeakPolarHBondContact CA-OD2 3.39Å; D234-K265 WeakPolarHBondContact OD1-CE 3.17Å; D234-K265 IonicContact OD1-NZ 3.12Å; D234-K265 PolarHBondContact OD1-NZ 3.26Å
235	I	93.3	Very high	95.2	Very high	14 Å²	14	29.7 Å²	29.7	7%	0.072	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	116.1	-170	-51.2	178.5	0	0	0	111.3	L237 F238 Y240 Y306 I313 L334	I235-L237 PolarHBondContact O-N 3.13Å; I235-F238 PolarHBondContact N-O 2.92Å; I235-F238 PolarHBondContact O-N 2.85Å; I235-F238 VanDerWaalsContact O-N 3.11Å; I235-Y240 HydrophobicContact CB-CD2 3.89Å; I235-Y240 HydrophobicContact CB-CE2 3.94Å; I235-Y240 HydrophobicContact CD1-CD2 4.04Å; I235-Y240 HydrophobicContact CG1-CD2 4.2Å; I235-Y240 HydrophobicContact CG2-CE2 4.41Å; I235-Y306 HydrophobicContact CD1-CD1 4.27Å; I235-Y306 HydrophobicContact CD1-CD2 4.23Å; I235-Y306 HydrophobicContact CD1-CE1 3.96Å; I235-Y306 HydrophobicContact CD1-CE2 3.91Å; I235-Y306 HydrophobicContact CD1-CG 4.4Å; I235-Y306 HydrophobicContact CG1-CE1 4.03Å; I235-I313 HydrophobicContact CD1-CD1 4.38Å; I235-L334 HydrophobicContact CD1-CD1 4.41Å; I235-L334 HydrophobicContact CG2-CD2 3.69Å
236	G	89.1	Confident	95.2	Very high	64 Å²	64	29.2 Å²	29.2	66%	0.66	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.2	-115.7	177.8	0	0	0	0	0	112.3	K265	G236-K265 PolarHBondContact O-NZ 3.34Å
237	L	89.7	Confident	95.2	Very high	95 Å²	95	23.1 Å²	23.1	50%	0.497	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-2.3	178.4	-57.2	174.5	0	0	0	113.9	I235 K265 C367	I235-L237 PolarHBondContact O-N 3.13Å; L237-K265 WeakPolarHBondContact O-CG 3.41Å; L237-K265 PolarHBondContact O-N 3.36Å; L237-C367 HydrophobicContact CB-CB 3.81Å; L237-C367 HydrophobicContact CD1-CB 4.45Å; L237-C367 PolarHBondContact O-SG 3.27Å
238	F	92.6	Very high	94.9	Very high	23 Å²	23	23.7 Å²	23.7	10%	0.101	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	157.8	-177.5	-64.2	-90.6	0	0	0	111.6	I235 Y240 R262 V263 K265 C367	I235-F238 PolarHBondContact N-O 2.92Å; I235-F238 PolarHBondContact O-N 2.85Å; I235-F238 VanDerWaalsContact O-N 3.11Å; F238-Y240 HydrophobicContact CB-CD2 4.2Å; F238-Y240 HydrophobicContact CB-CE2 3.72Å; F238-Y240 HydrophobicContact CG-CE2 4.49Å; F238-R262 HydrophobicContact CD1-CB 4.08Å; F238-R262 HydrophobicContact CD1-CG 4.07Å; F238-R262 HydrophobicContact CE1-CG 4.3Å; F238-V263 VanDerWaalsContact CA-O 3.29Å; F238-V263 WeakPolarHBondContact CA-O 3.28Å; F238-K265 WeakPolarHBondContact O-CE 3.41Å; F238-C367 WeakPolarHBondContact CD1-SG 3.39Å; F238-C367 WeakPolarHBondContact CE1-SG 3.01Å; F238-C367 WeakPolarHBondContact CZ-SG 3.46Å
239	T	95.1	Very high	94.5	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	124.5	159.9	-52.9	0	0	0	0	108	V182 Y190 F241 R262 V263	V182-T239 HydrophobicContact CG1-CG2 3.82Å; Y190-T239 HydrophobicContact CD1-CG2 3.93Å; Y190-T239 WeakPolarHBondContact CD1-OG1 3.31Å; Y190-T239 WeakPolarHBondContact CE1-OG1 3.3Å; Y190-T239 HydrophobicContact CG-CG2 3.94Å; T239-F241 HydrophobicContact CG2-CE1 4.4Å; T239-F241 HydrophobicContact CG2-CE2 3.82Å; T239-F241 HydrophobicContact CG2-CZ 3.71Å; T239-R262 WeakPolarHBondContact O-CA 3.33Å; T239-V263 PolarHBondContact N-O 2.89Å; T239-V263 PolarHBondContact O-N 3.25Å; T239-V263 VanDerWaalsContact O-N 3.11Å
240	Y	97.1	Very high	93.8	Very high	7 Å²	7	25 Å²	25	3%	0.027	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	143.1	179.7	-70.2	-90.5	0	0	0	111.2	A232 Y233 I235 F238 V260 A261 R262 L334 I337 F341	A232-Y240 CarbonylContact C-O 3.57Å; A232-Y240 WeakPolarHBondContact CA-O 3.32Å; Y233-Y240 PolarHBondContact N-O 3.39Å; Y233-Y240 PolarHBondContact O-N 3.31Å; I235-Y240 HydrophobicContact CB-CD2 3.89Å; I235-Y240 HydrophobicContact CB-CE2 3.94Å; I235-Y240 HydrophobicContact CD1-CD2 4.04Å; I235-Y240 HydrophobicContact CG1-CD2 4.2Å; I235-Y240 HydrophobicContact CG2-CE2 4.41Å; F238-Y240 HydrophobicContact CB-CD2 4.2Å; F238-Y240 HydrophobicContact CB-CE2 3.72Å; F238-Y240 HydrophobicContact CG-CE2 4.49Å; Y240-V260 HydrophobicContact CD1-CG2 3.96Å; Y240-A261 CarbonylContact C-O 3.59Å; Y240-A261 VanDerWaalsContact CA-O 3.29Å; Y240-A261 WeakPolarHBondContact CA-O 3.26Å; Y240-R262 HydrophobicContact CD1-CB 3.88Å; Y240-R262 HydrophobicContact CE1-CB 3.81Å; Y240-L334 HydrophobicContact CE2-CD1 4.13Å; Y240-I337 HydrophobicContact CD1-CG2 4.44Å; Y240-I337 HydrophobicContact CE1-CG2 3.91Å; Y240-F341 HydrophobicContact CE1-CE2 4.09Å
241	F	98.2	Very high	92.6	Very high	1 Å²	1	29.5 Å²	29.5	0%	0.004	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	133.1	178.2	-60.3	-90.8	0	0	0	110.8	Y190 A192 I204 A232 T239 F243 V260 A261 V263	Y190-F241 HydrophobicContact CD1-CZ 4.3Å; A192-F241 HydrophobicContact CB-CD1 3.89Å; A192-F241 HydrophobicContact CB-CE1 4.14Å; I204-F241 HydrophobicContact CD1-CB 4.16Å; I204-F241 HydrophobicContact CD1-CD1 4.47Å; I204-F241 HydrophobicContact CD1-CD2 4.17Å; I204-F241 HydrophobicContact CD1-CG 4.01Å; I204-F241 HydrophobicContact CG1-CD1 4.27Å; I204-F241 HydrophobicContact CG1-CG 4.31Å; I204-F241 HydrophobicContact CG2-CD1 4.25Å; I204-F241 HydrophobicContact CG2-CD2 3.98Å; I204-F241 HydrophobicContact CG2-CE1 3.77Å; I204-F241 HydrophobicContact CG2-CE2 3.46Å; I204-F241 VanDerWaalsContact CG2-CE2 3.46Å; I204-F241 HydrophobicContact CG2-CG 4.34Å; I204-F241 HydrophobicContact CG2-CZ 3.33Å; A232-F241 HydrophobicContact CB-CD1 3.75Å; A232-F241 HydrophobicContact CB-CE1 3.9Å; T239-F241 HydrophobicContact CG2-CE1 4.4Å; T239-F241 HydrophobicContact CG2-CE2 3.82Å; T239-F241 HydrophobicContact CG2-CZ 3.71Å; F241-F243 HydrophobicContact CB-CD1 4.46Å; F241-V260 CarbonylContact O-C 3.5Å; F241-V260 WeakPolarHBondContact O-CA 3.42Å; F241-A261 PolarHBondContact N-O 2.86Å; F241-A261 PolarHBondContact O-N 2.87Å; F241-V263 HydrophobicContact CE2-CG2 3.98Å
242	F	98.3	Very high	91.3	Very high	1 Å²	1	34.1 Å²	34.1	0%	0.004	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	122.6	-178.8	-74.4	-94.2	0	0	0	109.6	I230 A231 Y233 V260 L286 L301 T304 I313 I337	I230-F242 PolarHBondContact N-O 2.97Å; A231-F242 HydrophobicContact CB-CB 4.38Å; A231-F242 PolarHBondContact N-O 3.22Å; A231-F242 PolarHBondContact O-N 3.04Å; Y233-F242 AromaticContact CD2-CD2 3.83Å; Y233-F242 HydrophobicContact CD2-CD2 3.83Å; Y233-F242 AromaticContact CD2-CE2 3.77Å; Y233-F242 HydrophobicContact CD2-CE2 3.77Å; Y233-F242 AromaticContact CE2-CD2 3.92Å; Y233-F242 HydrophobicContact CE2-CD2 3.92Å; Y233-F242 HydrophobicContact CE2-CE2 4.1Å; F242-V260 HydrophobicContact CD1-CB 4.2Å; F242-V260 HydrophobicContact CD1-CG2 4.4Å; F242-V260 HydrophobicContact CE1-CB 3.72Å; F242-V260 HydrophobicContact CE1-CG2 3.75Å; F242-V260 HydrophobicContact CE2-CG2 3.89Å; F242-V260 HydrophobicContact CZ-CB 3.98Å; F242-V260 HydrophobicContact CZ-CG2 3.43Å; F242-V260 VanDerWaalsContact CZ-CG2 3.43Å; F242-L286 HydrophobicContact CD1-CD1 3.9Å; F242-L286 HydrophobicContact CE1-CD1 4.07Å; F242-L286 HydrophobicContact CE1-CD2 4.45Å; F242-L301 HydrophobicContact CB-CD2 4Å; F242-L301 HydrophobicContact CD1-CD2 4.25Å; F242-T304 HydrophobicContact CB-CG2 4.16Å; F242-T304 HydrophobicContact CD1-CG2 3.94Å; F242-T304 HydrophobicContact CG-CG2 4.11Å; F242-I313 HydrophobicContact CE1-CD1 4.49Å; F242-I313 HydrophobicContact CE1-CG2 4.07Å; F242-I313 HydrophobicContact CE2-CD1 3.85Å; F242-I313 HydrophobicContact CZ-CD1 3.5Å; F242-I313 VanDerWaalsContact CZ-CD1 3.5Å; F242-I313 HydrophobicContact CZ-CG2 4.01Å; F242-I337 HydrophobicContact CZ-CD1 4.27Å
243	F	98.1	Very high	90.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	169.6	-174.6	61.6	-85.8	0	0	0	111.7	I204 L224 P227 N228 F229 F241 E245 R259 A261 K283	I204-F243 HydrophobicContact CD1-CE1 4.49Å; L224-F243 HydrophobicContact CD2-CE1 4.44Å; L224-F243 HydrophobicContact CD2-CE2 3.74Å; L224-F243 HydrophobicContact CD2-CZ 3.69Å; P227-F243 HydrophobicContact CB-CD2 3.83Å; P227-F243 HydrophobicContact CB-CE2 4.32Å; N228-F243 CarbonylContact O-C 3.5Å; N228-F243 VanDerWaalsContact O-CA 3.26Å; N228-F243 WeakPolarHBondContact O-CA 3.28Å; N228-F243 WeakPolarHBondContact O-CB 3.06Å; F229-F243 HydrophobicContact CD1-CB 3.73Å; F229-F243 HydrophobicContact CD1-CD1 4.35Å; F229-F243 HydrophobicContact CD1-CG 4.14Å; F229-F243 HydrophobicContact CE1-CB 4.36Å; F229-F243 HydrophobicContact CE1-CD1 4.44Å; F229-F243 HydrophobicContact CE1-CG 4.32Å; F229-F243 HydrophobicContact CG-CB 4.46Å; F241-F243 HydrophobicContact CB-CD1 4.46Å; F243-E245 HydrophobicContact CD2-CB 4.21Å; F243-E245 HydrophobicContact CD2-CG 4.41Å; F243-E245 HydrophobicContact CE2-CB 4.18Å; F243-E245 HydrophobicContact CE2-CG 4.06Å; F243-R259 HydrophobicContact CD1-CB 4.18Å; F243-R259 HydrophobicContact CD2-CB 4.03Å; F243-R259 HydrophobicContact CD2-CG 4.14Å; F243-R259 HydrophobicContact CE1-CB 3.95Å; F243-R259 HydrophobicContact CE2-CB 3.79Å; F243-R259 HydrophobicContact CE2-CG 3.71Å; F243-R259 HydrophobicContact CG-CB 4.22Å; F243-R259 HydrophobicContact CZ-CB 3.74Å; F243-R259 HydrophobicContact CZ-CG 4.02Å; F243-R259 PolarHBondContact N-O 2.95Å; F243-R259 PolarHBondContact O-N 3.47Å; F243-A261 HydrophobicContact CE1-CB 3.73Å; F243-A261 HydrophobicContact CZ-CB 4.38Å; F243-K283 HydrophobicContact CZ-CD 4.18Å
244	R	96.7	Very high	89.6	Confident	32 Å²	32	42.9 Å²	42.9	12%	0.121	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	141.1	165.8	65.2	-179.2	-170.1	-91.5	11.9	110.2	P227 N228 I230 V256 Y257 E300 L301	P227-R244 CarbonylContact C-O 3.54Å; P227-R244 WeakPolarHBondContact CA-O 3.02Å; N228-R244 HydrophobicContact CB-CG 4.01Å; N228-R244 PolarHBondContact N-O 3.36Å; N228-R244 PolarHBondContact O-N 3.46Å; I230-R244 HydrophobicContact CD1-CG 4.38Å; R244-V256 HydrophobicContact CB-CG1 3.95Å; R244-V256 HydrophobicContact CG-CG1 4.19Å; R244-Y257 WeakPolarHBondContact CA-O 3.34Å; R244-E300 IonicContact CZ-OE2 2.8Å; R244-E300 IonicContact NE-OE2 3.52Å; R244-E300 PolarHBondContact NE-OE2 2.82Å; R244-E300 IonicContact NH2-OE2 2.74Å; R244-E300 PolarHBondContact NH2-OE2 2.81Å; R244-L301 WeakPolarHBondContact CD-O 3.26Å; R244-L301 PolarHBondContact NH1-O 2.75Å
245	E	95.6	Very high	89.3	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.009	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	164.3	-176.1	65.3	168.8	-176.4	0	0	110.7	N225 P227 F243 A247 V256 Y257 R259 K283	N225-E245 PolarHBondContact N-OE2 3.45Å; N225-E245 WeakPolarHBondContact O-CB 3.49Å; P227-E245 HydrophobicContact CB-CB 4.25Å; F243-E245 HydrophobicContact CD2-CB 4.21Å; F243-E245 HydrophobicContact CD2-CG 4.41Å; F243-E245 HydrophobicContact CE2-CB 4.18Å; F243-E245 HydrophobicContact CE2-CG 4.06Å; E245-A247 PolarHBondContact O-N 3.32Å; E245-V256 CarbonylContact O-C 3.59Å; E245-V256 WeakPolarHBondContact O-CA 3.45Å; E245-V256 WeakPolarHBondContact O-CG1 3.04Å; E245-Y257 PolarHBondContact N-O 2.86Å; E245-Y257 PolarHBondContact O-N 3.34Å; E245-R259 HydrophobicContact CG-CG 3.88Å; E245-R259 IonicContact OE1-CZ 2.71Å; E245-R259 VanDerWaalsContact OE1-CZ 3.29Å; E245-R259 IonicContact OE1-NE 2.7Å; E245-R259 PolarHBondContact OE1-NE 3.36Å; E245-R259 IonicContact OE1-NH2 2.71Å; E245-R259 PolarHBondContact OE1-NH2 3.22Å; E245-K283 WeakPolarHBondContact OE1-CE 3.45Å; E245-K283 IonicContact OE1-NZ 3.45Å; E245-K283 PolarHBondContact OE1-NZ 2.79Å; E245-K283 IonicContact OE2-NZ 3.48Å; E245-K283 PolarHBondContact OE2-NZ 2.7Å
246	N	93.9	Very high	89.4	Confident	27 Å²	27	43 Å²	43	14%	0.144	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	122.4	169.1	-70.8	-35.6	0	0	0	110	N225 E226 V248 T255	N225-N246 HydrophobicContact CB-CB 4.27Å; N225-N246 VanDerWaalsContact CB-O 3.32Å; N225-N246 WeakPolarHBondContact CB-O 3.23Å; N225-N246 VanDerWaalsContact ND2-CB 3.3Å; N225-N246 WeakPolarHBondContact ND2-CB 3.39Å; N225-N246 PolarHBondContact ND2-O 3.01Å; N225-N246 PolarHBondContact O-N 3.26Å; E226-N246 PolarHBondContact OE2-ND2 3.13Å; N246-V248 PolarHBondContact O-N 3.34Å; N246-T255 CarbonylContact C-O 3.59Å; N246-T255 WeakPolarHBondContact CA-O 3.46Å
247	A	92.9	Very high	89.7	Confident	12 Å²	12	41.1 Å²	41.1	10%	0.099	23%	0.227	C	C	.	.			trans	-61.3	126.3	178.7	0	0	0	0	0	110.7	E245 H250 T255 Y257	E245-A247 PolarHBondContact O-N 3.32Å; A247-H250 HydrophobicContact CB-CB 4.05Å; A247-T255 PolarHBondContact N-O 2.82Å; A247-Y257 HydrophobicContact CB-CD2 3.47Å; A247-Y257 VanDerWaalsContact CB-CD2 3.47Å; A247-Y257 HydrophobicContact CB-CE2 3.79Å; A247-Y257 HydrophobicContact CB-CG 3.91Å
248	V	89.4	Confident	90.1	Very high	29 Å²	29	36.7 Å²	36.7	18%	0.176	20%	0.204	C	C	.	.	S	Bend	trans	-91.8	-15.6	174.9	-66.7	0	0	0	0	111.9	S221 N225 N246 W355	S221-V248 WeakPolarHBondContact O-CG1 3.45Å; N225-V248 HydrophobicContact CB-CG1 4.04Å; N225-V248 WeakPolarHBondContact ND2-CG1 3.36Å; N246-V248 PolarHBondContact O-N 3.34Å; V248-W355 HydrophobicContact CB-CH2 4.49Å; V248-W355 HydrophobicContact CB-CZ2 4.03Å; V248-W355 HydrophobicContact CG2-CH2 3.79Å; V248-W355 HydrophobicContact CG2-CZ2 3.79Å; V248-W355 VanDerWaalsContact O-CE2 3.31Å; V248-W355 WeakPolarHBondContact O-CZ2 3.02Å; V248-W355 PolarHBondContact O-NE1 2.92Å
249	E	86.9	Confident	90.3	Very high	11 Å²	11	35.6 Å²	35.6	5%	0.051	20%	0.199	C	C	.	.	S	Bend	trans	-100.8	12.9	-172.8	80.6	-83.2	-155.2	0	0	114.5	Y257 R259 R346 W355 L392	E249-Y257 WeakPolarHBondContact OE1-CD2 3.41Å; E249-R259 VanDerWaalsContact CD-NH2 3.3Å; E249-R259 IonicContact OE1-CZ 2.7Å; E249-R259 VanDerWaalsContact OE1-CZ 3.28Å; E249-R259 IonicContact OE1-NH1 3.85Å; E249-R259 PolarHBondContact OE1-NH1 2.97Å; E249-R259 IonicContact OE1-NH2 3.46Å; E249-R259 PolarHBondContact OE1-NH2 2.71Å; E249-R259 IonicContact OE2-CZ 2.88Å; E249-R259 IonicContact OE2-NH1 3.22Å; E249-R259 IonicContact OE2-NH2 2.79Å; E249-R259 PolarHBondContact OE2-NH2 3.24Å; E249-R346 PolarHBondContact O-NH2 3.37Å; E249-W355 HydrophobicContact CB-CD2 3.84Å; E249-W355 HydrophobicContact CB-CE3 4.25Å; E249-W355 HydrophobicContact CB-CG 3.99Å; E249-L392 HydrophobicContact CB-CD2 3.91Å; E249-L392 HydrophobicContact CG-CD2 4.12Å
250	H	83.3	Confident	90.5	Very high	65 Å²	65	35.6 Å²	35.6	30%	0.301	20%	0.199	S	C	.	.			trans	-123.9	105.4	-178.1	-170.7	81.3	0	0	0	110.1	A247 C252 T255 Y257	A247-H250 HydrophobicContact CB-CB 4.05Å; H250-C252 VanDerWaalsContact C-N 3.28Å; H250-C252 PolarHBondContact O-N 2.83Å; H250-T255 PolarHBondContact CD2-OG1 3.01Å; H250-Y257 PolarHBondContact ND1-OH 3.35Å
251	D	70.7	Confident	90.5	Very high	125 Å²	125	35.3 Å²	35.3	67%	0.668	20%	0.198	S	C	*	.			trans	-75.8	-15.5	-171.1	-49	-61	0	0	0	113.3	G253	D251-G253 PolarHBondContact O-N 3.21Å; D251-G253 VanDerWaalsContact O-N 3.15Å
252	C	69.3	Low	90.3	Very high	108 Å²	108	35.4 Å²	35.4	73%	0.73	20%	0.198	S	C	*	.	S	Bend	trans	-90.3	64.2	-176.3	-160.4	0	0	0	0	112.9	H250	H250-C252 VanDerWaalsContact C-N 3.28Å; H250-C252 PolarHBondContact O-N 2.83Å
253	G	74.7	Confident	90.1	Very high	52 Å²	52	35.3 Å²	35.3	54%	0.536	20%	0.198	S	C	.	.	S	Bend	trans	77.3	-177.5	173.2	0	0	0	0	0	115.1	D251 T255	D251-G253 PolarHBondContact O-N 3.21Å; D251-G253 VanDerWaalsContact O-N 3.15Å; G253-T255 PolarHBondContact O-N 3.5Å; G253-T255 VanDerWaalsContact O-N 3.14Å
254	K	82.3	Confident	89.8	Confident	182 Å²	182	35.4 Å²	35.4	79%	0.791	20%	0.198	S	C	*	.			trans	-73.4	106	-175.6	-70.5	-164.5	173.9	-161.6	0	111.2
255	T	88.9	Confident	89.5	Confident	37 Å²	37	35.1 Å²	35.1	23%	0.227	20%	0.198	C	C	.	.			trans	-116.1	143.6	168.7	57.3	0	0	0	0	110.1	N246 A247 H250 G253	N246-T255 CarbonylContact C-O 3.59Å; N246-T255 WeakPolarHBondContact CA-O 3.46Å; A247-T255 PolarHBondContact N-O 2.82Å; H250-T255 PolarHBondContact CD2-OG1 3.01Å; G253-T255 PolarHBondContact O-N 3.5Å; G253-T255 VanDerWaalsContact O-N 3.14Å
256	V	93.9	Very high	89.1	Confident	30 Å²	30	38.7 Å²	38.7	18%	0.182	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	136.1	172.2	179.7	0	0	0	0	107.9	R244 E245 N299 E300	R244-V256 HydrophobicContact CB-CG1 3.95Å; R244-V256 HydrophobicContact CG-CG1 4.19Å; E245-V256 CarbonylContact O-C 3.59Å; E245-V256 WeakPolarHBondContact O-CA 3.45Å; E245-V256 WeakPolarHBondContact O-CG1 3.04Å; V256-N299 VanDerWaalsContact O-CB 3.28Å; V256-N299 WeakPolarHBondContact O-CB 3.46Å; V256-E300 HydrophobicContact CB-CG 4.14Å; V256-E300 HydrophobicContact CG1-CG 3.88Å
257	Y	95.9	Very high	88.8	Confident	25 Å²	25	37.7 Å²	37.7	10%	0.098	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	147.2	170.6	-75.6	-17.5	0	0	0	111.8	R244 E245 A247 E249 H250 R285 N299	R244-Y257 WeakPolarHBondContact CA-O 3.34Å; E245-Y257 PolarHBondContact N-O 2.86Å; E245-Y257 PolarHBondContact O-N 3.34Å; A247-Y257 HydrophobicContact CB-CD2 3.47Å; A247-Y257 VanDerWaalsContact CB-CD2 3.47Å; A247-Y257 HydrophobicContact CB-CE2 3.79Å; A247-Y257 HydrophobicContact CB-CG 3.91Å; E249-Y257 WeakPolarHBondContact OE1-CD2 3.41Å; H250-Y257 PolarHBondContact ND1-OH 3.35Å; Y257-R285 HydrophobicContact CD2-CG 4.43Å; Y257-R285 VanDerWaalsContact CE1-CZ 3.5Å; Y257-R285 HydrophobicContact CG-CG 4.5Å; Y257-N299 HydrophobicContact CD1-CB 4.39Å
258	S	97.9	Very high	88.5	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.014	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	139.1	172.6	-64.5	0	0	0	0	111.7	L286 N299 L301	S258-L286 PolarHBondContact O-N 3.44Å; S258-N299 PolarHBondContact N-O 2.87Å; S258-N299 VanDerWaalsContact N-O 3.15Å; S258-N299 PolarHBondContact OG-O 2.04Å; S258-L301 VanDerWaalsContact OG-CB 3.22Å; S258-L301 WeakPolarHBondContact OG-CB 3.46Å; S258-L301 PolarHBondContact OG-N 2.96Å
259	R	97.7	Very high	88.3	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	146.4	-174.7	-57.8	-60.2	-165.9	-158.3	-4.8	111.9	F243 E245 E249 A284	F243-R259 HydrophobicContact CD1-CB 4.18Å; F243-R259 HydrophobicContact CD2-CB 4.03Å; F243-R259 HydrophobicContact CD2-CG 4.14Å; F243-R259 HydrophobicContact CE1-CB 3.95Å; F243-R259 HydrophobicContact CE2-CB 3.79Å; F243-R259 HydrophobicContact CE2-CG 3.71Å; F243-R259 HydrophobicContact CG-CB 4.22Å; F243-R259 HydrophobicContact CZ-CB 3.74Å; F243-R259 HydrophobicContact CZ-CG 4.02Å; F243-R259 PolarHBondContact N-O 2.95Å; F243-R259 PolarHBondContact O-N 3.47Å; E245-R259 HydrophobicContact CG-CG 3.88Å; E245-R259 IonicContact OE1-CZ 2.71Å; E245-R259 VanDerWaalsContact OE1-CZ 3.29Å; E245-R259 IonicContact OE1-NE 2.7Å; E245-R259 PolarHBondContact OE1-NE 3.36Å; E245-R259 IonicContact OE1-NH2 2.71Å; E245-R259 PolarHBondContact OE1-NH2 3.22Å; E249-R259 VanDerWaalsContact CD-NH2 3.3Å; E249-R259 IonicContact OE1-CZ 2.7Å; E249-R259 VanDerWaalsContact OE1-CZ 3.28Å; E249-R259 IonicContact OE1-NH1 3.85Å; E249-R259 PolarHBondContact OE1-NH1 2.97Å; E249-R259 IonicContact OE1-NH2 3.46Å; E249-R259 PolarHBondContact OE1-NH2 2.71Å; E249-R259 IonicContact OE2-CZ 2.88Å; E249-R259 IonicContact OE2-NH1 3.22Å; E249-R259 IonicContact OE2-NH2 2.79Å; E249-R259 PolarHBondContact OE2-NH2 3.24Å; R259-A284 WeakPolarHBondContact CA-O 3.07Å
260	V	98.2	Very high	88.1	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	136.3	151.1	57.1	0	0	0	0	107.8	Y240 F241 F242 K283 A284 L286 I337 F341 V397	Y240-V260 HydrophobicContact CD1-CG2 3.96Å; F241-V260 CarbonylContact O-C 3.5Å; F241-V260 WeakPolarHBondContact O-CA 3.42Å; F242-V260 HydrophobicContact CD1-CB 4.2Å; F242-V260 HydrophobicContact CD1-CG2 4.4Å; F242-V260 HydrophobicContact CE1-CB 3.72Å; F242-V260 HydrophobicContact CE1-CG2 3.75Å; F242-V260 HydrophobicContact CE2-CG2 3.89Å; F242-V260 HydrophobicContact CZ-CB 3.98Å; F242-V260 HydrophobicContact CZ-CG2 3.43Å; F242-V260 VanDerWaalsContact CZ-CG2 3.43Å; V260-K283 CarbonylContact O-C 3.56Å; V260-K283 VanDerWaalsContact O-CA 3.31Å; V260-K283 WeakPolarHBondContact O-CA 3.46Å; V260-A284 HydrophobicContact CG1-CB 4.25Å; V260-A284 PolarHBondContact N-O 3.12Å; V260-A284 VanDerWaalsContact N-O 3.1Å; V260-A284 PolarHBondContact O-N 3.47Å; V260-L286 HydrophobicContact CB-CD1 4.48Å; V260-L286 HydrophobicContact CB-CD2 4.1Å; V260-L286 HydrophobicContact CB-CG 4.36Å; V260-L286 HydrophobicContact CG1-CD2 3.8Å; V260-L286 HydrophobicContact CG1-CG 4.28Å; V260-I337 HydrophobicContact CG1-CG2 4.17Å; V260-I337 HydrophobicContact CG2-CG2 4.16Å; V260-F341 HydrophobicContact CG1-CE2 4.25Å; V260-F341 HydrophobicContact CG1-CZ 4.13Å; V260-F341 HydrophobicContact CG2-CE2 4.35Å; V260-F341 HydrophobicContact CG2-CZ 4.41Å; V260-V397 HydrophobicContact CG1-CG2 3.98Å
261	A	97.4	Very high	87.7	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	158	168.7	0	0	0	0	0	111.1	Y240 F241 F243 F281 M282 K283	Y240-A261 CarbonylContact C-O 3.59Å; Y240-A261 VanDerWaalsContact CA-O 3.29Å; Y240-A261 WeakPolarHBondContact CA-O 3.26Å; F241-A261 PolarHBondContact N-O 2.86Å; F241-A261 PolarHBondContact O-N 2.87Å; F243-A261 HydrophobicContact CE1-CB 3.73Å; F243-A261 HydrophobicContact CZ-CB 4.38Å; A261-F281 HydrophobicContact CB-CE2 3.78Å; A261-F281 HydrophobicContact CB-CZ 4.38Å; A261-M282 CarbonylContact C-O 3.55Å; A261-M282 WeakPolarHBondContact CA-O 3.06Å; A261-M282 VanDerWaalsContact CB-O 3.31Å; A261-M282 WeakPolarHBondContact CB-O 3.37Å; A261-K283 HydrophobicContact CB-CB 3.85Å
262	R	95.1	Very high	87.9	Confident	3 Å²	3	45.1 Å²	45.1	1%	0.011	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	152.2	173.5	69.8	179.1	-173.1	173.3	0	111.4	F238 T239 Y240 M282 F341	F238-R262 HydrophobicContact CD1-CB 4.08Å; F238-R262 HydrophobicContact CD1-CG 4.07Å; F238-R262 HydrophobicContact CE1-CG 4.3Å; T239-R262 WeakPolarHBondContact O-CA 3.33Å; Y240-R262 HydrophobicContact CD1-CB 3.88Å; Y240-R262 HydrophobicContact CE1-CB 3.81Å; R262-M282 HydrophobicContact CG-CB 4.38Å; R262-M282 PolarHBondContact N-O 2.87Å; R262-M282 PolarHBondContact O-N 2.92Å; R262-F341 HydrophobicContact CB-CE2 4.26Å; R262-F341 HydrophobicContact CB-CZ 4.31Å; R262-F341 HydrophobicContact CG-CD1 4.34Å; R262-F341 HydrophobicContact CG-CD2 4.2Å; R262-F341 HydrophobicContact CG-CE1 4.16Å; R262-F341 HydrophobicContact CG-CE2 4Å; R262-F341 HydrophobicContact CG-CG 4.37Å; R262-F341 HydrophobicContact CG-CZ 3.99Å; R262-F341 VanDerWaalsContact CZ-CB 3.43Å
263	V	94.3	Very high	88.2	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	152.2	165.5	-57.4	0	0	0	0	109.3	Y190 F238 T239 F241 W278 F281	Y190-V263 HydrophobicContact CD1-CG2 4.24Å; Y190-V263 HydrophobicContact CE1-CG2 4.07Å; F238-V263 VanDerWaalsContact CA-O 3.29Å; F238-V263 WeakPolarHBondContact CA-O 3.28Å; T239-V263 PolarHBondContact N-O 2.89Å; T239-V263 PolarHBondContact O-N 3.25Å; T239-V263 VanDerWaalsContact O-N 3.11Å; F241-V263 HydrophobicContact CE2-CG2 3.98Å; V263-W278 HydrophobicContact CB-CD2 4.17Å; V263-W278 HydrophobicContact CB-CE3 3.78Å; V263-W278 HydrophobicContact CB-CH2 4.42Å; V263-W278 HydrophobicContact CB-CZ3 3.91Å; V263-W278 HydrophobicContact CG1-CD2 3.83Å; V263-W278 HydrophobicContact CG1-CE3 3.97Å; V263-W278 HydrophobicContact CG1-CG 4.11Å; V263-W278 HydrophobicContact CG1-CZ3 4.44Å; V263-W278 HydrophobicContact CG2-CE3 4.17Å; V263-W278 HydrophobicContact CG2-CH2 3.9Å; V263-W278 HydrophobicContact CG2-CZ2 4.34Å; V263-W278 HydrophobicContact CG2-CZ3 3.81Å; V263-F281 HydrophobicContact CG1-CB 4.25Å; V263-F281 HydrophobicContact CG1-CD2 4.03Å
264	C	91.1	Very high	88.6	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.007	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	141.1	172.6	-78.3	0	0	0	0	112.1	N266 D267 T280 F365 C367	C264-N266 VanDerWaalsContact C-N 3.32Å; C264-N266 PolarHBondContact O-N 3.31Å; C264-D267 HydrophobicContact CB-CB 4.3Å; C264-D267 WeakPolarHBondContact O-CB 3.49Å; C264-D267 PolarHBondContact O-N 2.03Å; C264-T280 HydrophobicContact CB-CG2 3.9Å; C264-T280 PolarHBondContact N-OG1 3.22Å; C264-F365 VanDerWaalsContact SG-CE1 3.54Å; C264-C367 WeakPolarHBondContact CA-SG 3.35Å; C264-C367 HydrophobicContact CB-CB 3.75Å; C264-C367 WeakPolarHBondContact CB-SG 3.24Å; C264-C367 WeakPolarHBondContact SG-CA 3Å; C264-C367 WeakPolarHBondContact SG-CB 3.38Å; C264-C367 CovalentContact SG-SG 2.04Å; C264-C367 PolarHBondContact SG-SG 3.05Å
265	K	89.4	Confident	88.6	Confident	27 Å²	27	38.5 Å²	38.5	12%	0.117	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-33.1	177.9	-65.3	170.4	-167.2	-176.6	0	113.1	Y190 R206 D234 G236 L237 F238	Y190-K265 WeakPolarHBondContact OH-CA 3.34Å; Y190-K265 PolarHBondContact OH-O 2.91Å; R206-K265 PolarHBondContact NH1-O 3.48Å; D234-K265 WeakPolarHBondContact OD1-CE 3.17Å; D234-K265 IonicContact OD1-NZ 3.12Å; D234-K265 PolarHBondContact OD1-NZ 3.26Å; G236-K265 PolarHBondContact O-NZ 3.34Å; L237-K265 WeakPolarHBondContact O-CG 3.41Å; L237-K265 PolarHBondContact O-N 3.36Å; F238-K265 WeakPolarHBondContact O-CE 3.41Å
266	N	87.3	Confident	88.6	Confident	76 Å²	76	41.9 Å²	41.9	41%	0.406	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	8.4	178.1	70	-34.9	0	0	0	114	C264 I268 C367	C264-N266 VanDerWaalsContact C-N 3.32Å; C264-N266 PolarHBondContact O-N 3.31Å; N266-I268 PolarHBondContact O-N 3.02Å; N266-C367 WeakPolarHBondContact OD1-CB 3.35Å
267	D	87.9	Confident	88.5	Confident	7 Å²	7	41.5 Å²	41.5	4%	0.037	20%	0.199	C	C	.	.			trans	-59.3	133	168.3	-166.5	-20.3	0	0	0	108.8	R206 L214 C264 G269 W278 T279 T280	R206-D267 PolarHBondContact NH1-O 3.34Å; R206-D267 PolarHBondContact NH2-O 2.86Å; L214-D267 HydrophobicContact CD1-CB 4.07Å; C264-D267 HydrophobicContact CB-CB 4.3Å; C264-D267 WeakPolarHBondContact O-CB 3.49Å; C264-D267 PolarHBondContact O-N 2.03Å; D267-G269 PolarHBondContact OD1-N 3.09Å; D267-W278 HydrophobicContact CB-CE3 4.01Å; D267-W278 HydrophobicContact CB-CZ3 4.11Å; D267-T279 VanDerWaalsContact CG-OG1 3.22Å; D267-T279 PolarHBondContact OD1-N 3.46Å; D267-T279 PolarHBondContact OD1-OG1 2.9Å; D267-T279 PolarHBondContact OD2-N 2.71Å; D267-T279 PolarHBondContact OD2-OG1 3.04Å; D267-T280 HydrophobicContact CB-CG2 4.21Å; D267-T280 WeakPolarHBondContact OD2-CB 3.29Å; D267-T280 WeakPolarHBondContact OD2-CG2 3.45Å; D267-T280 PolarHBondContact OD2-N 3.24Å; D267-T280 PolarHBondContact OD2-OG1 2.95Å
268	I	86.2	Confident	88.4	Confident	72 Å²	72	40.4 Å²	40.4	37%	0.369	19%	0.194	S	C	.	.			trans	-123.2	10.8	-179.7	56	173.7	0	0	0	112.7	V211 P212 N266 N376	V211-I268 HydrophobicContact CG1-CG2 4.2Å; P212-I268 HydrophobicContact CG-CB 4.11Å; P212-I268 HydrophobicContact CG-CG2 4.43Å; P212-I268 WeakPolarHBondContact CG-O 3.44Å; N266-I268 PolarHBondContact O-N 3.02Å; I268-N376 HydrophobicContact CD1-CB 4.16Å
269	G	85.6	Confident	87.9	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.01	20%	0.202	C	C	.	.			trans	84.1	175.1	-174.1	0	0	0	0	0	112.6	D267 T277 T279	D267-G269 PolarHBondContact OD1-N 3.09Å; G269-T277 WeakPolarHBondContact CA-O 3.35Å; G269-T279 VanDerWaalsContact C-CG2 3.49Å
270	G	82.8	Confident	87.6	Confident	10 Å²	10	42.2 Å²	42.2	10%	0.103	21%	0.206	C	C	.	.			trans	-84.5	-174.5	170.1	0	0	0	0	0	112.4	L273 L274	G270-L273 CarbonylContact C-O 3.52Å; G270-L273 VanDerWaalsContact CA-O 3.28Å; G270-L273 WeakPolarHBondContact CA-O 3.48Å; G270-L274 PolarHBondContact N-O 3.17Å
271	R	74.1	Confident	87.4	Confident	136 Å²	136	42.6 Å²	42.6	51%	0.513	21%	0.207	S	C	.	.	S	Bend	trans	-109.4	-20.2	-177.2	-172.9	173.8	177.8	174.1	-0.6	114.6	E377	R271-E377 IonicContact NH1-OE1 2.88Å
272	F	75.6	Confident	87.2	Confident	179 Å²	179	43.7 Å²	43.7	79%	0.785	21%	0.213	S	C	*	.	S	Bend	trans	-147.6	-55.9	-177.6	-60.8	-71.1	0	0	0	109.8
273	L	76.6	Confident	87.3	Confident	55 Å²	55	43.5 Å²	43.5	29%	0.288	21%	0.212	S	C	.	.	S	Bend	trans	-77.9	143.7	156.3	-65.9	172.6	0	0	0	108.3	G270 E275 E381 L384 Q385	G270-L273 CarbonylContact C-O 3.52Å; G270-L273 VanDerWaalsContact CA-O 3.28Å; G270-L273 WeakPolarHBondContact CA-O 3.48Å; L273-E275 PolarHBondContact O-N 2.82Å; L273-E381 HydrophobicContact CD1-CG 4.32Å; L273-L384 HydrophobicContact CB-CB 4.18Å; L273-L384 HydrophobicContact CB-CD1 4.48Å; L273-L384 HydrophobicContact CD1-CB 4.44Å; L273-Q385 HydrophobicContact CD1-CG 3.74Å
274	L	82.5	Confident	87.4	Confident	20 Å²	20	43.5 Å²	43.5	11%	0.105	21%	0.212	C	C	.	.	S	Bend	trans	61.4	27.5	171.2	-55.6	179.2	0	0	0	117.1	G270 T277 T279 A387 Q388	G270-L274 PolarHBondContact N-O 3.17Å; L274-T277 VanDerWaalsContact C-OG1 3.27Å; L274-T277 WeakPolarHBondContact CA-OG1 3.05Å; L274-T277 VanDerWaalsContact CB-OG1 3.27Å; L274-T277 WeakPolarHBondContact CB-OG1 3.4Å; L274-T277 WeakPolarHBondContact CD2-OG1 3.49Å; L274-T277 PolarHBondContact O-N 3.43Å; L274-T277 VanDerWaalsContact O-N 3.12Å; L274-T277 PolarHBondContact O-OG1 3.37Å; L274-T277 VanDerWaalsContact O-OG1 3.08Å; L274-T279 HydrophobicContact CB-CG2 4.46Å; L274-T279 HydrophobicContact CD1-CG2 4.49Å; L274-A387 HydrophobicContact CD1-CB 4.02Å; L274-Q388 HydrophobicContact CD1-CB 4.41Å; L274-Q388 HydrophobicContact CD2-CB 4.34Å; L274-Q388 HydrophobicContact CD2-CG 4.26Å
275	E	82.4	Confident	87.7	Confident	128 Å²	128	45.3 Å²	45.3	60%	0.598	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.9	-65	-174.5	-165.7	172.4	-172.7	0	0	114.5	L273 T277	L273-E275 PolarHBondContact O-N 2.82Å; E275-T277 VanDerWaalsContact C-N 3.26Å; E275-T277 PolarHBondContact O-N 3.45Å
276	D	88.5	Confident	88.1	Confident	107 Å²	107	44.3 Å²	44.3	57%	0.572	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.6	19	176.9	-75.5	-45.8	0	0	0	114.1	L214 R215	L214-D276 WeakPolarHBondContact CA-O 3.08Å; R215-D276 PolarHBondContact N-O 2.92Å
277	T	92.3	Very high	88.5	Confident	23 Å²	23	41.4 Å²	41.4	14%	0.141	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-132.9	149.3	-169.9	60	0	0	0	0	114.8	R215 G269 L274 E275 T279	R215-T277 HydrophobicContact CG-CG2 4.33Å; R215-T277 WeakPolarHBondContact O-CA 3.36Å; R215-T277 WeakPolarHBondContact O-CB 3.31Å; R215-T277 WeakPolarHBondContact O-CG2 3.25Å; G269-T277 WeakPolarHBondContact CA-O 3.35Å; L274-T277 VanDerWaalsContact C-OG1 3.27Å; L274-T277 WeakPolarHBondContact CA-OG1 3.05Å; L274-T277 VanDerWaalsContact CB-OG1 3.27Å; L274-T277 WeakPolarHBondContact CB-OG1 3.4Å; L274-T277 WeakPolarHBondContact CD2-OG1 3.49Å; L274-T277 PolarHBondContact O-N 3.43Å; L274-T277 VanDerWaalsContact O-N 3.12Å; L274-T277 PolarHBondContact O-OG1 3.37Å; L274-T277 VanDerWaalsContact O-OG1 3.08Å; E275-T277 VanDerWaalsContact C-N 3.26Å; E275-T277 PolarHBondContact O-N 3.45Å; T277-T279 PolarHBondContact O-N 2.91Å
278	W	92.7	Very high	88.9	Confident	1 Å²	1	41.2 Å²	41.2	0%	0.004	20%	0.198	C	C	.	.			trans	-53.1	127.1	179.1	-59.1	108.2	0	0	0	113	Y190 I204 R206 L214 R215 W223 V263 D267 F281	Y190-W278 HydrophobicContact CD1-CH2 4.09Å; Y190-W278 AromaticContact CE1-CH2 3.67Å; Y190-W278 HydrophobicContact CE1-CH2 3.67Å; Y190-W278 HydrophobicContact CE1-CZ3 4.37Å; I204-W278 PolarHBondContact O-NE1 2.81Å; R206-W278 HydrophobicContact CB-CH2 3.53Å; R206-W278 HydrophobicContact CB-CZ2 3.69Å; R206-W278 HydrophobicContact CG-CH2 4.39Å; L214-W278 HydrophobicContact CB-CD2 3.88Å; L214-W278 HydrophobicContact CB-CE3 4.05Å; L214-W278 HydrophobicContact CB-CG 4.44Å; L214-W278 HydrophobicContact CB-CH2 4.2Å; L214-W278 HydrophobicContact CB-CZ2 4.02Å; L214-W278 HydrophobicContact CB-CZ3 4.21Å; L214-W278 HydrophobicContact CD1-CD2 4.27Å; L214-W278 HydrophobicContact CD1-CE3 3.68Å; L214-W278 HydrophobicContact CD1-CZ3 3.85Å; R215-W278 VanDerWaalsContact O-CD1 3.27Å; R215-W278 PolarHBondContact O-N 2.91Å; W223-W278 WeakPolarHBondContact CH2-O 3.4Å; W223-W278 HydrophobicContact CZ3-CB 4.37Å; V263-W278 HydrophobicContact CB-CD2 4.17Å; V263-W278 HydrophobicContact CB-CE3 3.78Å; V263-W278 HydrophobicContact CB-CH2 4.42Å; V263-W278 HydrophobicContact CB-CZ3 3.91Å; V263-W278 HydrophobicContact CG1-CD2 3.83Å; V263-W278 HydrophobicContact CG1-CE3 3.97Å; V263-W278 HydrophobicContact CG1-CG 4.11Å; V263-W278 HydrophobicContact CG1-CZ3 4.44Å; V263-W278 HydrophobicContact CG2-CE3 4.17Å; V263-W278 HydrophobicContact CG2-CH2 3.9Å; V263-W278 HydrophobicContact CG2-CZ2 4.34Å; V263-W278 HydrophobicContact CG2-CZ3 3.81Å; D267-W278 HydrophobicContact CB-CE3 4.01Å; D267-W278 HydrophobicContact CB-CZ3 4.11Å; W278-F281 HydrophobicContact CB-CB 3.69Å; W278-F281 HydrophobicContact CG-CB 4.35Å
279	T	88.9	Confident	89.4	Confident	28 Å²	28	38.3 Å²	38.3	17%	0.172	18%	0.184	C	C	.	.	S	Bend	trans	-89.3	-18	168.9	61.8	0	0	0	0	112	D267 G269 L274 T277 L384 A387	D267-T279 VanDerWaalsContact CG-OG1 3.22Å; D267-T279 PolarHBondContact OD1-N 3.46Å; D267-T279 PolarHBondContact OD1-OG1 2.9Å; D267-T279 PolarHBondContact OD2-N 2.71Å; D267-T279 PolarHBondContact OD2-OG1 3.04Å; G269-T279 VanDerWaalsContact C-CG2 3.49Å; L274-T279 HydrophobicContact CB-CG2 4.46Å; L274-T279 HydrophobicContact CD1-CG2 4.49Å; T277-T279 PolarHBondContact O-N 2.91Å; T279-L384 HydrophobicContact CG2-CD2 3.72Å; T279-A387 WeakPolarHBondContact O-CB 3.49Å
280	T	90.6	Very high	89.6	Confident	13 Å²	13	41.9 Å²	41.9	8%	0.08	20%	0.197	C	C	.	.	S	Bend	trans	-110.5	11.2	-173	62.4	0	0	0	0	114.6	C264 D267 M282 F365	C264-T280 HydrophobicContact CB-CG2 3.9Å; C264-T280 PolarHBondContact N-OG1 3.22Å; D267-T280 HydrophobicContact CB-CG2 4.21Å; D267-T280 WeakPolarHBondContact OD2-CB 3.29Å; D267-T280 WeakPolarHBondContact OD2-CG2 3.45Å; D267-T280 PolarHBondContact OD2-N 3.24Å; D267-T280 PolarHBondContact OD2-OG1 2.95Å; T280-M282 PolarHBondContact O-N 3.08Å; T280-F365 HydrophobicContact CG2-CE1 3.89Å; T280-F365 HydrophobicContact CG2-CZ 3.63Å
281	F	93.9	Very high	89.9	Confident	7 Å²	7	44 Å²	44	3%	0.031	21%	0.214	C	C	.	.			trans	-72.3	117.5	-178.6	175.1	-103.3	0	0	0	112.3	I204 T216 W223 L224 A261 V263 W278 K283 F391	I204-F281 HydrophobicContact CD1-CE2 3.79Å; T216-F281 HydrophobicContact CG2-CD2 4.17Å; T216-F281 HydrophobicContact CG2-CE2 4.18Å; T216-F281 HydrophobicContact CG2-CG 4.42Å; T216-F281 HydrophobicContact CG2-CZ 4.44Å; W223-F281 HydrophobicContact CB-CE1 4.37Å; W223-F281 AromaticContact CD2-CD1 3.99Å; W223-F281 HydrophobicContact CD2-CD1 3.99Å; W223-F281 HydrophobicContact CD2-CE1 4.21Å; W223-F281 AromaticContact CE3-CD1 3.5Å; W223-F281 HydrophobicContact CE3-CD1 3.5Å; W223-F281 VanDerWaalsContact CE3-CD1 3.5Å; W223-F281 AromaticContact CE3-CE1 3.89Å; W223-F281 HydrophobicContact CE3-CE1 3.89Å; W223-F281 HydrophobicContact CE3-CG 4.15Å; W223-F281 HydrophobicContact CG-CE1 4.43Å; W223-F281 HydrophobicContact CH2-CB 4.41Å; W223-F281 HydrophobicContact CH2-CD1 4.47Å; W223-F281 HydrophobicContact CZ3-CB 3.98Å; W223-F281 AromaticContact CZ3-CD1 3.78Å; W223-F281 HydrophobicContact CZ3-CD1 3.78Å; W223-F281 HydrophobicContact CZ3-CG 4.05Å; L224-F281 HydrophobicContact CD2-CZ 4.47Å; A261-F281 HydrophobicContact CB-CE2 3.78Å; A261-F281 HydrophobicContact CB-CZ 4.38Å; V263-F281 HydrophobicContact CG1-CB 4.25Å; V263-F281 HydrophobicContact CG1-CD2 4.03Å; W278-F281 HydrophobicContact CB-CB 3.69Å; W278-F281 HydrophobicContact CG-CB 4.35Å; F281-K283 HydrophobicContact CZ-CB 4.44Å; F281-K283 HydrophobicContact CZ-CD 4.37Å; F281-F391 HydrophobicContact CD1-CB 4.09Å; F281-F391 HydrophobicContact CE1-CB 4.4Å
282	M	93.9	Very high	90.5	Very high	23 Å²	23	40 Å²	40	11%	0.113	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	141.5	175.8	-58.5	175.1	179.7	0	0	109.9	A261 R262 T280 F341 F345 F365 F391 M393	A261-M282 CarbonylContact C-O 3.55Å; A261-M282 WeakPolarHBondContact CA-O 3.06Å; A261-M282 VanDerWaalsContact CB-O 3.31Å; A261-M282 WeakPolarHBondContact CB-O 3.37Å; R262-M282 HydrophobicContact CG-CB 4.38Å; R262-M282 PolarHBondContact N-O 2.87Å; R262-M282 PolarHBondContact O-N 2.92Å; T280-M282 PolarHBondContact O-N 3.08Å; M282-F341 HydrophobicContact CB-CD1 3.77Å; M282-F341 HydrophobicContact CB-CE1 3.81Å; M282-F341 WeakPolarHBondContact O-CE1 3.39Å; M282-F345 HydrophobicContact CE-CZ 3.99Å; M282-F345 HydrophobicContact CG-CE1 4.37Å; M282-F345 HydrophobicContact SD-CZ 4.23Å; M282-F365 HydrophobicContact CE-CD1 4.31Å; M282-F391 CarbonylContact C-O 3.59Å; M282-F391 WeakPolarHBondContact CA-O 3.4Å; M282-M393 HydrophobicContact CB-SD 4.37Å
283	K	96.6	Very high	91	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	139.9	173.5	67.4	178.2	177.7	-178.8	0	112.7	K222 W223 F243 E245 V260 A261 F281 F391 L392 M393	K222-K283 VanDerWaalsContact O-CE 3.31Å; K222-K283 WeakPolarHBondContact O-CE 3.25Å; K222-K283 PolarHBondContact O-NZ 3.48Å; W223-K283 WeakPolarHBondContact O-CE 3.42Å; W223-K283 PolarHBondContact O-NZ 3.18Å; F243-K283 HydrophobicContact CZ-CD 4.18Å; E245-K283 WeakPolarHBondContact OE1-CE 3.45Å; E245-K283 IonicContact OE1-NZ 3.45Å; E245-K283 PolarHBondContact OE1-NZ 2.79Å; E245-K283 IonicContact OE2-NZ 3.48Å; E245-K283 PolarHBondContact OE2-NZ 2.7Å; V260-K283 CarbonylContact O-C 3.56Å; V260-K283 VanDerWaalsContact O-CA 3.31Å; V260-K283 WeakPolarHBondContact O-CA 3.46Å; A261-K283 HydrophobicContact CB-CB 3.85Å; F281-K283 HydrophobicContact CZ-CB 4.44Å; F281-K283 HydrophobicContact CZ-CD 4.37Å; K283-F391 WeakPolarHBondContact CG-O 3.35Å; K283-F391 PolarHBondContact N-O 3Å; K283-L392 HydrophobicContact CG-CD1 4.08Å; K283-L392 WeakPolarHBondContact O-CA 3.24Å; K283-M393 PolarHBondContact O-N 3.01Å
284	A	97.2	Very high	91.5	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	154.5	176.5	0	0	0	0	0	110.7	R259 V260 A340 F341 M393 V397	R259-A284 WeakPolarHBondContact CA-O 3.07Å; V260-A284 HydrophobicContact CG1-CB 4.25Å; V260-A284 PolarHBondContact N-O 3.12Å; V260-A284 VanDerWaalsContact N-O 3.1Å; V260-A284 PolarHBondContact O-N 3.47Å; A284-A340 HydrophobicContact CB-CB 4.42Å; A284-F341 HydrophobicContact CB-CD1 4.42Å; A284-F341 HydrophobicContact CB-CE1 4Å; A284-F341 HydrophobicContact CB-CZ 4.26Å; A284-M393 HydrophobicContact CB-CB 3.97Å; A284-M393 HydrophobicContact CB-CG 3.81Å; A284-V397 HydrophobicContact CB-CG2 4Å
285	R	97.2	Very high	91.9	Very high	39 Å²	39	47.5 Å²	47.5	15%	0.147	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	137.4	173	-177.3	179.6	175.6	-163.3	-2	110	Y257 N299 V396 V397	Y257-R285 HydrophobicContact CD2-CG 4.43Å; Y257-R285 VanDerWaalsContact CE1-CZ 3.5Å; Y257-R285 HydrophobicContact CG-CG 4.5Å; R285-N299 PolarHBondContact NH2-OD1 2.89Å; R285-V396 HydrophobicContact CB-CG1 4.03Å; R285-V396 HydrophobicContact CB-CG2 4.25Å; R285-V396 HydrophobicContact CG-CG1 4Å; R285-V396 WeakPolarHBondContact O-CG1 2.94Å; R285-V397 PolarHBondContact O-N 3.15Å
286	L	97.6	Very high	92.4	Very high	6 Å²	6	45.1 Å²	45.1	3%	0.031	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	132.5	167.1	-63.8	167.9	0	0	0	109.5	F242 S258 V260 L301 F317 F332 V397	F242-L286 HydrophobicContact CD1-CD1 3.9Å; F242-L286 HydrophobicContact CE1-CD1 4.07Å; F242-L286 HydrophobicContact CE1-CD2 4.45Å; S258-L286 PolarHBondContact O-N 3.44Å; V260-L286 HydrophobicContact CB-CD1 4.48Å; V260-L286 HydrophobicContact CB-CD2 4.1Å; V260-L286 HydrophobicContact CB-CG 4.36Å; V260-L286 HydrophobicContact CG1-CD2 3.8Å; V260-L286 HydrophobicContact CG1-CG 4.28Å; L286-L301 HydrophobicContact CD1-CD2 4.18Å; L286-F317 HydrophobicContact CB-CE1 4.17Å; L286-F317 HydrophobicContact CB-CZ 4.25Å; L286-F317 HydrophobicContact CD1-CE1 4.48Å; L286-F317 HydrophobicContact CD1-CZ 4.32Å; L286-F332 HydrophobicContact CB-CE1 4.49Å; L286-F332 HydrophobicContact CB-CZ 4.21Å; L286-F332 HydrophobicContact CD2-CD1 4.28Å; L286-F332 HydrophobicContact CD2-CD2 4.38Å; L286-F332 HydrophobicContact CD2-CE1 4.26Å; L286-F332 HydrophobicContact CD2-CE2 4.38Å; L286-F332 HydrophobicContact CD2-CG 4.34Å; L286-F332 HydrophobicContact CD2-CZ 4.32Å; L286-V397 HydrophobicContact CD2-CB 4.02Å; L286-V397 HydrophobicContact CD2-CG1 4.14Å; L286-V397 HydrophobicContact CD2-CG2 4.31Å
287	N	96.4	Very high	92.6	Very high	15 Å²	15	44.7 Å²	44.7	8%	0.08	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-96.9	131.6	170.4	-172.1	27.7	0	0	0	111.7	S289 Y297 F332 V396 V397 Q398 P399	N287-S289 PolarHBondContact ND2-OG 3.49Å; N287-S289 VanDerWaalsContact ND2-OG 3.17Å; N287-S289 PolarHBondContact OD1-OG 2.92Å; N287-Y297 WeakPolarHBondContact OD1-CD1 2.99Å; N287-F332 WeakPolarHBondContact O-CE1 3.31Å; N287-F332 VanDerWaalsContact O-CZ 3.23Å; N287-F332 WeakPolarHBondContact O-CZ 3.47Å; N287-V396 HydrophobicContact CB-CG1 3.77Å; N287-V397 PolarHBondContact N-O 3.33Å; N287-Q398 PolarHBondContact ND2-OE1 3.04Å; N287-P399 WeakPolarHBondContact O-CD 3.1Å
288	C	96.3	Very high	92.7	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.014	23%	0.23	C	C	.	.			trans	-139.8	108.7	162.4	-169.6	0	0	0	0	107.8	Y298 F317 C330	C288-Y298 PolarHBondContact O-N 3.05Å; C288-F317 HydrophobicContact CB-CB 4.14Å; C288-F317 HydrophobicContact CB-CD1 3.96Å; C288-F317 HydrophobicContact CB-CD2 3.56Å; C288-F317 HydrophobicContact CB-CE1 4.23Å; C288-F317 HydrophobicContact CB-CE2 3.89Å; C288-F317 HydrophobicContact CB-CG 3.62Å; C288-F317 HydrophobicContact CB-CZ 4.2Å; C288-F317 VanDerWaalsContact SG-CD2 3.55Å; C288-C330 WeakPolarHBondContact CA-SG 3.4Å; C288-C330 HydrophobicContact CB-CB 3.85Å; C288-C330 WeakPolarHBondContact CB-SG 3.11Å; C288-C330 WeakPolarHBondContact SG-CB 3.49Å; C288-C330 CovalentContact SG-SG 2.05Å; C288-C330 PolarHBondContact SG-SG 2.98Å
289	S	94.7	Very high	92.8	Very high	11 Å²	11	45.8 Å²	45.8	8%	0.077	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	136.9	-168.8	57.2	0	0	0	0	111.8	N287 F296 P404	N287-S289 PolarHBondContact ND2-OG 3.49Å; N287-S289 VanDerWaalsContact ND2-OG 3.17Å; N287-S289 PolarHBondContact OD1-OG 2.92Å; S289-F296 CarbonylContact C-O 3.55Å; S289-F296 WeakPolarHBondContact CA-O 3.38Å; S289-P404 WeakPolarHBondContact O-CD 3.37Å
290	R	91.6	Very high	93.1	Very high	77 Å²	77	45.1 Å²	45.1	29%	0.291	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	133.9	169.1	-178.9	166	66.6	-164.2	-0.2	109.6	F296 Y298 D403 D409	R290-F296 HydrophobicContact CB-CB 4.37Å; R290-F296 PolarHBondContact N-O 3.48Å; R290-F296 PolarHBondContact O-N 2.04Å; R290-Y298 HydrophobicContact CB-CE2 4.15Å; R290-D403 WeakPolarHBondContact CA-OD1 3.41Å; R290-D409 IonicContact CZ-OD2 3.58Å; R290-D409 IonicContact NH1-OD1 2.68Å; R290-D409 PolarHBondContact NH1-OD1 2.81Å; R290-D409 IonicContact NH1-OD2 3.13Å; R290-D409 PolarHBondContact NH1-OD2 2.82Å; R290-D409 IonicContact NH2-OD1 2.7Å; R290-D409 IonicContact NH2-OD2 2.72Å
291	A	89.3	Confident	93.5	Very high	55 Å²	55	44.5 Å²	44.5	46%	0.455	23%	0.233	S	C	.	.			trans	-69.5	149.4	-176.7	0	0	0	0	0	112.7	D403	A291-D403 PolarHBondContact N-OD1 2.81Å
292	G	86.4	Confident	93.6	Very high	51 Å²	51	46.1 Å²	46.1	53%	0.526	24%	0.241	S	C	.	.	S	Bend	trans	169.6	176.3	-179.7	0	0	0	0	0	111	I294	G292-I294 PolarHBondContact O-N 3.1Å
293	E	84.9	Confident	93.7	Very high	205 Å²	205	45.6 Å²	45.6	96%	0.958	24%	0.239	S	C	*	.	S	Bend	trans	-58.6	-37.7	175.8	-62.5	-177.9	164.6	0	0	111.9
294	I	86.8	Confident	93.8	Very high	154 Å²	154	46.2 Å²	46.2	79%	0.79	24%	0.243	S	C	*	.	S	Bend	trans	-116.6	111.1	164.9	-57.9	177.2	0	0	0	106.6	G292	G292-I294 PolarHBondContact O-N 3.1Å
295	P	90.8	Very high	93.7	Very high	52 Å²	52	47.4 Å²	47.4	34%	0.338	25%	0.248	S	C	.	.			trans	-62.7	136.3	-179.6	-24.6	34.3	0	0	0	112.5	Y297	P295-Y297 HydrophobicContact CB-CE2 3.94Å; P295-Y297 VanDerWaalsContact O-CD2 3.25Å; P295-Y297 WeakPolarHBondContact O-CD2 3.01Å; P295-Y297 WeakPolarHBondContact O-CE2 3.46Å
296	F	93.1	Very high	93.7	Very high	79 Å²	79	47.9 Å²	47.9	35%	0.346	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	113.1	178.8	-175	-86.1	0	0	0	110.2	S289 R290 Y298 T319 A326	S289-F296 CarbonylContact C-O 3.55Å; S289-F296 WeakPolarHBondContact CA-O 3.38Å; R290-F296 HydrophobicContact CB-CB 4.37Å; R290-F296 PolarHBondContact N-O 3.48Å; R290-F296 PolarHBondContact O-N 2.04Å; F296-Y298 HydrophobicContact CD1-CD2 4.33Å; F296-Y298 HydrophobicContact CD1-CE1 4.17Å; F296-Y298 AromaticContact CD1-CE2 3.78Å; F296-Y298 HydrophobicContact CD1-CE2 3.78Å; F296-Y298 AromaticContact CD1-CZ 3.69Å; F296-Y298 HydrophobicContact CE1-CD1 4.25Å; F296-Y298 AromaticContact CE1-CE1 3.76Å; F296-Y298 HydrophobicContact CE1-CE1 3.76Å; F296-Y298 HydrophobicContact CE1-CE2 4.23Å; F296-Y298 AromaticContact CE1-CZ 3.74Å; F296-T319 HydrophobicContact CE1-CG2 3.74Å; F296-T319 HydrophobicContact CZ-CG2 3.66Å; F296-A326 HydrophobicContact CE1-CB 4.36Å; F296-A326 HydrophobicContact CZ-CB 4.49Å
297	Y	92.9	Very high	93.5	Very high	98 Å²	98	47.7 Å²	47.7	38%	0.384	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	128.8	-171.7	-64.6	-88.4	0	0	0	113.6	N287 P295 N299	N287-Y297 WeakPolarHBondContact OD1-CD1 2.99Å; P295-Y297 HydrophobicContact CB-CE2 3.94Å; P295-Y297 VanDerWaalsContact O-CD2 3.25Å; P295-Y297 WeakPolarHBondContact O-CD2 3.01Å; P295-Y297 WeakPolarHBondContact O-CE2 3.46Å; Y297-N299 WeakPolarHBondContact CB-ND2 3.23Å
298	Y	95.9	Very high	93.2	Very high	1 Å²	1	50.3 Å²	50.3	0%	0.004	27%	0.267	C	S	.	.			trans	-95.7	89.5	168.7	-55.1	-95.5	0	0	0	107.7	C288 R290 F296 F317 T318 T319 A326 S327 A328 P404	C288-Y298 PolarHBondContact O-N 3.05Å; R290-Y298 HydrophobicContact CB-CE2 4.15Å; F296-Y298 HydrophobicContact CD1-CD2 4.33Å; F296-Y298 HydrophobicContact CD1-CE1 4.17Å; F296-Y298 AromaticContact CD1-CE2 3.78Å; F296-Y298 HydrophobicContact CD1-CE2 3.78Å; F296-Y298 AromaticContact CD1-CZ 3.69Å; F296-Y298 HydrophobicContact CE1-CD1 4.25Å; F296-Y298 AromaticContact CE1-CE1 3.76Å; F296-Y298 HydrophobicContact CE1-CE1 3.76Å; F296-Y298 HydrophobicContact CE1-CE2 4.23Å; F296-Y298 AromaticContact CE1-CZ 3.74Å; Y298-F317 WeakPolarHBondContact O-CB 3.32Å; Y298-F317 WeakPolarHBondContact O-CD1 3.04Å; Y298-T318 CarbonylContact C-O 3.6Å; Y298-T319 HydrophobicContact CD1-CG2 4.43Å; Y298-A326 HydrophobicContact CE1-CB 3.86Å; Y298-S327 VanDerWaalsContact CE1-C 3.47Å; Y298-S327 WeakPolarHBondContact CE1-O 3.33Å; Y298-A328 HydrophobicContact CD1-CB 3.77Å; Y298-A328 HydrophobicContact CD2-CB 3.48Å; Y298-A328 VanDerWaalsContact CD2-CB 3.48Å; Y298-A328 HydrophobicContact CE1-CB 3.94Å; Y298-A328 HydrophobicContact CE2-CB 3.67Å; Y298-A328 HydrophobicContact CG-CB 3.54Å; Y298-P404 HydrophobicContact CE2-CG 4.42Å
299	N	94	Very high	92.8	Very high	46 Å²	46	56.5 Å²	56.5	25%	0.246	30%	0.296	C	S	.	.			trans	-86.7	-13.4	-167.2	-71.2	-59	0	0	0	115.1	V256 Y257 S258 R285 Y297 T318	V256-N299 VanDerWaalsContact O-CB 3.28Å; V256-N299 WeakPolarHBondContact O-CB 3.46Å; Y257-N299 HydrophobicContact CD1-CB 4.39Å; S258-N299 PolarHBondContact N-O 2.87Å; S258-N299 VanDerWaalsContact N-O 3.15Å; S258-N299 PolarHBondContact OG-O 2.04Å; R285-N299 PolarHBondContact NH2-OD1 2.89Å; Y297-N299 WeakPolarHBondContact CB-ND2 3.23Å; N299-T318 PolarHBondContact N-O 2.94Å
300	E	95.9	Very high	92.5	Very high	13 Å²	13	59.7 Å²	59.7	6%	0.061	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	100.8	-175	-71	-160.5	-139.5	0	0	113.6	R244 V256 F317 T318 N320	R244-E300 IonicContact CZ-OE2 2.8Å; R244-E300 IonicContact NE-OE2 3.52Å; R244-E300 PolarHBondContact NE-OE2 2.82Å; R244-E300 IonicContact NH2-OE2 2.74Å; R244-E300 PolarHBondContact NH2-OE2 2.81Å; V256-E300 HydrophobicContact CB-CG 4.14Å; V256-E300 HydrophobicContact CG1-CG 3.88Å; E300-F317 CarbonylContact O-C 3.54Å; E300-F317 WeakPolarHBondContact O-CA 3.48Å; E300-T318 PolarHBondContact N-O 2.69Å; E300-T318 PolarHBondContact O-N 3.27Å; E300-T318 PolarHBondContact O-OG1 3.33Å; E300-N320 WeakPolarHBondContact OE1-CA 3.45Å; E300-N320 PolarHBondContact OE1-ND2 3.1Å
301	L	97.6	Very high	92.6	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	126.9	173.1	-178.7	70.8	0	0	0	111.5	I230 F242 R244 S258 L286 T304 V316 F317	I230-L301 HydrophobicContact CD1-CD2 4.47Å; I230-L301 HydrophobicContact CD1-CG 4.42Å; I230-L301 VanDerWaalsContact CD1-O 3.24Å; I230-L301 WeakPolarHBondContact CD1-O 3.34Å; I230-L301 HydrophobicContact CG1-CG 4.3Å; F242-L301 HydrophobicContact CB-CD2 4Å; F242-L301 HydrophobicContact CD1-CD2 4.25Å; R244-L301 WeakPolarHBondContact CD-O 3.26Å; R244-L301 PolarHBondContact NH1-O 2.75Å; S258-L301 VanDerWaalsContact OG-CB 3.22Å; S258-L301 WeakPolarHBondContact OG-CB 3.46Å; S258-L301 PolarHBondContact OG-N 2.96Å; L286-L301 HydrophobicContact CD1-CD2 4.18Å; L301-T304 HydrophobicContact CD1-CG2 3.73Å; L301-T304 HydrophobicContact CD2-CG2 3.89Å; L301-T304 HydrophobicContact CG-CG2 4.23Å; L301-V316 CarbonylContact C-O 3.34Å; L301-V316 WeakPolarHBondContact CA-O 3.38Å; L301-F317 HydrophobicContact CB-CD1 4.14Å; L301-F317 HydrophobicContact CB-CE1 4.02Å; L301-F317 HydrophobicContact CD1-CD1 4.27Å; L301-F317 HydrophobicContact CD1-CD2 4.41Å; L301-F317 HydrophobicContact CD1-CE1 3.85Å; L301-F317 HydrophobicContact CD1-CE2 3.99Å; L301-F317 HydrophobicContact CD1-CZ 3.69Å; L301-F317 HydrophobicContact CG-CE1 4.49Å
302	Q	96	Very high	92.9	Very high	41 Å²	41	57.7 Å²	57.7	19%	0.192	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	-33.5	180	-54.7	-59.7	-18.5	0	0	113.7	V316 T318	Q302-V316 HydrophobicContact CB-CG1 4.2Å; Q302-V316 PolarHBondContact N-O 2.78Å; Q302-T318 HydrophobicContact CG-CG2 3.68Å; Q302-T318 PolarHBondContact NE2-OG1 2.95Å
303	S	96.6	Very high	93.4	Very high	12 Å²	12	55.2 Å²	55.2	8%	0.084	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	147.8	-176.9	-164.7	0	0	0	0	110.1	G315 V316 L416	S303-G315 WeakPolarHBondContact O-CA 3.22Å; S303-V316 PolarHBondContact O-N 3.05Å; S303-L416 PolarHBondContact OG-N 3.45Å
304	T	97.5	Very high	94	Very high	13 Å²	13	45.6 Å²	45.6	8%	0.08	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	157.1	167.9	52.2	0	0	0	0	111.1	I230 A231 Y233 F242 L301 I313 Y314	I230-T304 HydrophobicContact CG2-CG2 4.47Å; A231-T304 WeakPolarHBondContact CB-OG1 3.33Å; Y233-T304 WeakPolarHBondContact OH-CB 3.28Å; Y233-T304 PolarHBondContact OH-O 3.09Å; Y233-T304 VanDerWaalsContact OH-O 3.05Å; Y233-T304 PolarHBondContact OH-OG1 3.2Å; F242-T304 HydrophobicContact CB-CG2 4.16Å; F242-T304 HydrophobicContact CD1-CG2 3.94Å; F242-T304 HydrophobicContact CG-CG2 4.11Å; L301-T304 HydrophobicContact CD1-CG2 3.73Å; L301-T304 HydrophobicContact CD2-CG2 3.89Å; L301-T304 HydrophobicContact CG-CG2 4.23Å; T304-I313 HydrophobicContact CG2-CG2 4.37Å; T304-Y314 CarbonylContact C-O 3.58Å; T304-Y314 WeakPolarHBondContact CA-O 3.26Å; T304-Y314 WeakPolarHBondContact CB-O 3.41Å
305	F	96.9	Very high	94.5	Very high	25 Å²	25	38.3 Å²	38.3	11%	0.11	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	127.7	172.8	-174.8	-96.5	0	0	0	108.9	Y233 L307 I313 Y314 V417 V418 I475	Y233-F305 PolarHBondContact OH-N 3.17Å; F305-L307 HydrophobicContact CE1-CD1 4.22Å; F305-I313 CarbonylContact O-C 3.59Å; F305-I313 WeakPolarHBondContact O-CA 3.5Å; F305-Y314 PolarHBondContact N-O 2.85Å; F305-Y314 PolarHBondContact O-N 3.29Å; F305-V417 HydrophobicContact CD2-CB 3.97Å; F305-V417 HydrophobicContact CD2-CG1 3.92Å; F305-V417 HydrophobicContact CE2-CB 3.91Å; F305-V417 HydrophobicContact CE2-CG1 4Å; F305-V418 HydrophobicContact CD1-CB 3.77Å; F305-V418 HydrophobicContact CD1-CG2 3.83Å; F305-V418 HydrophobicContact CE1-CB 3.83Å; F305-V418 HydrophobicContact CE1-CG2 4.41Å; F305-V418 VanDerWaalsContact CE1-O 3.26Å; F305-V418 WeakPolarHBondContact CE1-O 3.36Å; F305-V418 HydrophobicContact CG-CG2 4.41Å; F305-V418 WeakPolarHBondContact CZ-O 3.4Å; F305-I475 HydrophobicContact CE2-CG2 3.76Å; F305-I475 HydrophobicContact CZ-CG2 3.85Å
306	Y	96	Very high	94.8	Very high	50 Å²	50	35.8 Å²	35.8	20%	0.196	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	129.7	179.1	172.8	-128.2	0	0	0	109.8	Y233 I235 P308 L312 I313	Y233-Y306 HydrophobicContact CD1-CD1 4.46Å; I235-Y306 HydrophobicContact CD1-CD1 4.27Å; I235-Y306 HydrophobicContact CD1-CD2 4.23Å; I235-Y306 HydrophobicContact CD1-CE1 3.96Å; I235-Y306 HydrophobicContact CD1-CE2 3.91Å; I235-Y306 HydrophobicContact CD1-CG 4.4Å; I235-Y306 HydrophobicContact CG1-CE1 4.03Å; Y306-P308 HydrophobicContact CE1-CB 3.8Å; Y306-P308 WeakPolarHBondContact O-CD 3.48Å; Y306-L312 WeakPolarHBondContact CD2-O 3.36Å; Y306-I313 HydrophobicContact CD2-CD1 4.31Å; Y306-I313 HydrophobicContact CD2-CG1 3.62Å; Y306-I313 HydrophobicContact CE2-CG1 4.41Å; Y306-I313 HydrophobicContact CG-CG1 4.36Å
307	L	93.6	Very high	95	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.01	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	90.8	-177.9	-172.4	69.9	0	0	0	108.3	F305 E309 Q310 D311 L312 Y314 I420	F305-L307 HydrophobicContact CE1-CD1 4.22Å; L307-E309 WeakPolarHBondContact CD1-OE2 3.41Å; L307-E309 PolarHBondContact O-N 2.93Å; L307-Q310 PolarHBondContact O-N 3.3Å; L307-D311 PolarHBondContact O-N 2.89Å; L307-L312 HydrophobicContact CB-CB 4.41Å; L307-L312 PolarHBondContact N-O 2.92Å; L307-L312 PolarHBondContact O-N 2.97Å; L307-Y314 HydrophobicContact CD2-CE2 4.28Å; L307-I420 HydrophobicContact CD1-CD1 3.96Å; L307-I420 HydrophobicContact CD1-CG1 4.12Å; L307-I420 HydrophobicContact CD2-CD1 4.04Å; L307-I420 HydrophobicContact CD2-CG1 4.19Å; L307-I420 HydrophobicContact CG-CD1 4.25Å
308	P	90.3	Very high	95.2	Very high	70 Å²	70	27.5 Å²	27.5	46%	0.455	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-18.7	-170.2	27	-34.9	0	0	0	113.9	Y306 Q310	Y306-P308 HydrophobicContact CE1-CB 3.8Å; Y306-P308 WeakPolarHBondContact O-CD 3.48Å; P308-Q310 PolarHBondContact O-N 2.92Å
309	E	88.3	Confident	95.1	Very high	131 Å²	131	28 Å²	28	61%	0.612	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-15.2	178.7	-60.8	71.4	-156.1	0	0	113	L307 I420	L307-E309 WeakPolarHBondContact CD1-OE2 3.41Å; L307-E309 PolarHBondContact O-N 2.93Å; E309-I420 HydrophobicContact CB-CD1 4.3Å
310	Q	88.9	Confident	94.9	Very high	78 Å²	78	28.6 Å²	28.6	36%	0.364	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-140.2	9.7	-175.5	-60	-173.8	23.3	0	0	114.2	L307 P308 L312 H429	L307-Q310 PolarHBondContact O-N 3.3Å; P308-Q310 PolarHBondContact O-N 2.92Å; Q310-L312 HydrophobicContact CB-CD1 4.05Å; Q310-L312 HydrophobicContact CB-CG 4.02Å; Q310-L312 PolarHBondContact O-N 2.86Å; Q310-H429 PolarHBondContact NE2-CE1 2.8Å; Q310-H429 VanDerWaalsContact NE2-CE1 3.3Å; Q310-H429 PolarHBondContact NE2-NE2 3.1Å; Q310-H429 PolarHBondContact OE1-CE1 2.62Å
311	D	93.8	Very high	94.3	Very high	76 Å²	76	32.6 Å²	32.6	41%	0.406	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	35.1	-173.9	-73	-46.6	0	0	0	113.7	L307 L334	L307-D311 PolarHBondContact O-N 2.89Å; D311-L334 HydrophobicContact CB-CB 3.95Å; D311-L334 PolarHBondContact O-N 3.32Å
312	L	94.8	Very high	93.7	Very high	14 Å²	14	40.1 Å²	40.1	7%	0.073	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	134	-178.1	-72.1	179	0	0	0	112.2	Y306 L307 Q310 Y314 N333 V400	Y306-L312 WeakPolarHBondContact CD2-O 3.36Å; L307-L312 HydrophobicContact CB-CB 4.41Å; L307-L312 PolarHBondContact N-O 2.92Å; L307-L312 PolarHBondContact O-N 2.97Å; Q310-L312 HydrophobicContact CB-CD1 4.05Å; Q310-L312 HydrophobicContact CB-CG 4.02Å; Q310-L312 PolarHBondContact O-N 2.86Å; L312-Y314 HydrophobicContact CB-CE2 4.32Å; L312-Y314 HydrophobicContact CD1-CE2 4.29Å; L312-N333 HydrophobicContact CD2-CB 4.16Å; L312-V400 HydrophobicContact CD2-CG2 3.87Å
313	I	97.1	Very high	93.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	110.2	169.6	-61.8	175	0	0	0	108.4	Y233 I235 F242 T304 F305 Y306 A331 F332 I337	Y233-I313 HydrophobicContact CD2-CD1 4.5Å; I235-I313 HydrophobicContact CD1-CD1 4.38Å; F242-I313 HydrophobicContact CE1-CD1 4.49Å; F242-I313 HydrophobicContact CE1-CG2 4.07Å; F242-I313 HydrophobicContact CE2-CD1 3.85Å; F242-I313 HydrophobicContact CZ-CD1 3.5Å; F242-I313 VanDerWaalsContact CZ-CD1 3.5Å; F242-I313 HydrophobicContact CZ-CG2 4.01Å; T304-I313 HydrophobicContact CG2-CG2 4.37Å; F305-I313 CarbonylContact O-C 3.59Å; F305-I313 WeakPolarHBondContact O-CA 3.5Å; Y306-I313 HydrophobicContact CD2-CD1 4.31Å; Y306-I313 HydrophobicContact CD2-CG1 3.62Å; Y306-I313 HydrophobicContact CE2-CG1 4.41Å; Y306-I313 HydrophobicContact CG-CG1 4.36Å; I313-A331 CarbonylContact O-C 3.31Å; I313-A331 WeakPolarHBondContact O-CA 3.43Å; I313-F332 PolarHBondContact N-O 2.88Å; I313-F332 PolarHBondContact O-N 2.77Å; I313-I337 HydrophobicContact CD1-CD1 4.03Å
314	Y	97.5	Very high	92.7	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.008	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	144.4	169.8	-77.2	-100.3	0	0	0	110.3	T304 F305 L307 L312 V329 A331 V418 H429 M431 S445	T304-Y314 CarbonylContact C-O 3.58Å; T304-Y314 WeakPolarHBondContact CA-O 3.26Å; T304-Y314 WeakPolarHBondContact CB-O 3.41Å; F305-Y314 PolarHBondContact N-O 2.85Å; F305-Y314 PolarHBondContact O-N 3.29Å; L307-Y314 HydrophobicContact CD2-CE2 4.28Å; L312-Y314 HydrophobicContact CB-CE2 4.32Å; L312-Y314 HydrophobicContact CD1-CE2 4.29Å; Y314-V329 HydrophobicContact CD1-CG1 4.16Å; Y314-A331 HydrophobicContact CD1-CB 3.81Å; Y314-A331 HydrophobicContact CD2-CB 4.2Å; Y314-A331 HydrophobicContact CE1-CB 3.86Å; Y314-A331 HydrophobicContact CE2-CB 4.24Å; Y314-A331 HydrophobicContact CG-CB 3.98Å; Y314-V418 HydrophobicContact CD1-CG2 4.1Å; Y314-V418 HydrophobicContact CD2-CG2 4Å; Y314-V418 HydrophobicContact CE1-CG2 4.48Å; Y314-V418 HydrophobicContact CE2-CG1 4.33Å; Y314-V418 HydrophobicContact CE2-CG2 4.39Å; Y314-V418 HydrophobicContact CG-CG2 3.85Å; Y314-H429 AromaticContact CZ-ND1 3.98Å; Y314-H429 PolarHBondContact OH-ND1 3.17Å; Y314-M431 HydrophobicContact CD1-SD 3.9Å; Y314-M431 HydrophobicContact CE1-CG 4.44Å; Y314-M431 HydrophobicContact CE1-SD 3.77Å; Y314-S445 WeakPolarHBondContact CE1-OG 3.25Å; Y314-S445 PolarHBondContact OH-OG 3.29Å
315	G	97.3	Very high	92.4	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	135.6	179.3	0	0	0	0	0	112.7	S303 F317 V329 C330	S303-G315 WeakPolarHBondContact O-CA 3.22Å; G315-F317 VanDerWaalsContact O-CD2 3.3Å; G315-F317 WeakPolarHBondContact O-CD2 3.47Å; G315-F317 WeakPolarHBondContact O-CE2 3.49Å; G315-V329 WeakPolarHBondContact O-CA 3.42Å; G315-C330 PolarHBondContact N-O 2.02Å; G315-C330 PolarHBondContact O-N 3.37Å
316	V	97.7	Very high	92.2	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	122	171.9	175.5	0	0	0	0	109.1	L301 Q302 S303 V329 F413 L416	L301-V316 CarbonylContact C-O 3.34Å; L301-V316 WeakPolarHBondContact CA-O 3.38Å; Q302-V316 HydrophobicContact CB-CG1 4.2Å; Q302-V316 PolarHBondContact N-O 2.78Å; S303-V316 PolarHBondContact O-N 3.05Å; V316-V329 HydrophobicContact CG2-CG2 4.42Å; V316-F413 HydrophobicContact CG1-CB 3.37Å; V316-F413 HydrophobicContact CG1-CD2 4.33Å; V316-F413 HydrophobicContact CG1-CG 4.39Å; V316-L416 HydrophobicContact CG2-CB 3.34Å; V316-L416 HydrophobicContact CG2-CD2 3.8Å; V316-L416 HydrophobicContact CG2-CG 4.19Å
317	F	97.4	Very high	92.2	Very high	1 Å²	1	44.2 Å²	44.2	0%	0.004	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	142.9	178.8	-60.6	-100.5	0	0	0	110.7	L286 C288 Y298 E300 L301 G315 S327 A328 C330 F332	L286-F317 HydrophobicContact CB-CE1 4.17Å; L286-F317 HydrophobicContact CB-CZ 4.25Å; L286-F317 HydrophobicContact CD1-CE1 4.48Å; L286-F317 HydrophobicContact CD1-CZ 4.32Å; C288-F317 HydrophobicContact CB-CB 4.14Å; C288-F317 HydrophobicContact CB-CD1 3.96Å; C288-F317 HydrophobicContact CB-CD2 3.56Å; C288-F317 HydrophobicContact CB-CE1 4.23Å; C288-F317 HydrophobicContact CB-CE2 3.89Å; C288-F317 HydrophobicContact CB-CG 3.62Å; C288-F317 HydrophobicContact CB-CZ 4.2Å; C288-F317 VanDerWaalsContact SG-CD2 3.55Å; Y298-F317 WeakPolarHBondContact O-CB 3.32Å; Y298-F317 WeakPolarHBondContact O-CD1 3.04Å; E300-F317 CarbonylContact O-C 3.54Å; E300-F317 WeakPolarHBondContact O-CA 3.48Å; L301-F317 HydrophobicContact CB-CD1 4.14Å; L301-F317 HydrophobicContact CB-CE1 4.02Å; L301-F317 HydrophobicContact CD1-CD1 4.27Å; L301-F317 HydrophobicContact CD1-CD2 4.41Å; L301-F317 HydrophobicContact CD1-CE1 3.85Å; L301-F317 HydrophobicContact CD1-CE2 3.99Å; L301-F317 HydrophobicContact CD1-CZ 3.69Å; L301-F317 HydrophobicContact CG-CE1 4.49Å; G315-F317 VanDerWaalsContact O-CD2 3.3Å; G315-F317 WeakPolarHBondContact O-CD2 3.47Å; G315-F317 WeakPolarHBondContact O-CE2 3.49Å; F317-S327 CarbonylContact O-C 3.56Å; F317-S327 VanDerWaalsContact O-CA 3.32Å; F317-S327 WeakPolarHBondContact O-CA 3.4Å; F317-A328 PolarHBondContact N-O 2.93Å; F317-A328 PolarHBondContact O-N 2.91Å; F317-C330 HydrophobicContact CD2-CB 4.29Å; F317-C330 HydrophobicContact CE2-CB 4Å; F317-F332 AromaticContact CE2-CE2 3.64Å; F317-F332 HydrophobicContact CE2-CE2 3.64Å; F317-F332 AromaticContact CE2-CZ 3.9Å; F317-F332 HydrophobicContact CE2-CZ 3.9Å; F317-F332 AromaticContact CZ-CE2 3.52Å; F317-F332 HydrophobicContact CZ-CE2 3.52Å; F317-F332 AromaticContact CZ-CZ 3.62Å; F317-F332 HydrophobicContact CZ-CZ 3.62Å
318	T	96.6	Very high	92.3	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.012	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	164	173.6	65.9	0	0	0	0	111.6	Y298 N299 E300 Q302 A326 R412	Y298-T318 CarbonylContact C-O 3.6Å; N299-T318 PolarHBondContact N-O 2.94Å; E300-T318 PolarHBondContact N-O 2.69Å; E300-T318 PolarHBondContact O-N 3.27Å; E300-T318 PolarHBondContact O-OG1 3.33Å; Q302-T318 HydrophobicContact CG-CG2 3.68Å; Q302-T318 PolarHBondContact NE2-OG1 2.95Å; T318-A326 CarbonylContact C-O 3.56Å; T318-A326 WeakPolarHBondContact CA-O 3.02Å; T318-R412 HydrophobicContact CG2-CB 4.12Å; T318-R412 HydrophobicContact CG2-CG 4.39Å
319	T	94.4	Very high	92.6	Very high	10 Å²	10	40.8 Å²	40.8	6%	0.061	22%	0.221	C	C	.	.			trans	-66.5	167.7	156.4	54.3	0	0	0	0	111.1	F296 Y298 I324 A326	F296-T319 HydrophobicContact CE1-CG2 3.74Å; F296-T319 HydrophobicContact CZ-CG2 3.66Å; Y298-T319 HydrophobicContact CD1-CG2 4.43Å; T319-I324 WeakPolarHBondContact CB-O 3.38Å; T319-I324 PolarHBondContact OG1-O 2.92Å; T319-A326 HydrophobicContact CG2-CB 3.91Å; T319-A326 PolarHBondContact N-O 2.91Å; T319-A326 PolarHBondContact OG1-N 3.2Å; T319-A326 PolarHBondContact OG1-O 3.37Å
320	N	89.5	Confident	93	Very high	59 Å²	59	34.6 Å²	34.6	32%	0.316	19%	0.193	S	C	.	.			trans	-63.9	154	174.4	-177	-99.1	0	0	0	111.9	E300 N322 S323 R412	E300-N320 WeakPolarHBondContact OE1-CA 3.45Å; E300-N320 PolarHBondContact OE1-ND2 3.1Å; N320-N322 VanDerWaalsContact C-N 3.28Å; N320-N322 PolarHBondContact O-N 3.2Å; N320-N322 WeakPolarHBondContact OD1-CB 3.04Å; N320-N322 PolarHBondContact OD1-N 2.87Å; N320-S323 PolarHBondContact O-N 3.06Å; N320-S323 VanDerWaalsContact O-N 3.1Å; N320-R412 PolarHBondContact O-NH2 2.74Å
321	V	83.4	Confident	93.3	Very high	98 Å²	98	30.9 Å²	30.9	59%	0.594	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-38.7	-179.7	-175.2	0	0	0	0	112	S323 R412	V321-S323 VanDerWaalsContact C-N 3.27Å; V321-S323 PolarHBondContact O-N 2.74Å; V321-R412 PolarHBondContact O-NH2 2.99Å
322	N	84.4	Confident	93.5	Very high	157 Å²	157	27.3 Å²	27.3	84%	0.84	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	1.9	-179.7	-60.4	-23.3	0	0	0	113.6	N320	N320-N322 VanDerWaalsContact C-N 3.28Å; N320-N322 PolarHBondContact O-N 3.2Å; N320-N322 WeakPolarHBondContact OD1-CB 3.04Å; N320-N322 PolarHBondContact OD1-N 2.87Å
323	S	86	Confident	93.5	Very high	66 Å²	66	29.1 Å²	29.1	46%	0.462	17%	0.166	S	C	.	.	S	Bend	trans	-103.8	171.3	176.2	-57.7	0	0	0	0	111.3	N320 V321 A325 R412	N320-S323 PolarHBondContact O-N 3.06Å; N320-S323 VanDerWaalsContact O-N 3.1Å; V321-S323 VanDerWaalsContact C-N 3.27Å; V321-S323 PolarHBondContact O-N 2.74Å; S323-A325 PolarHBondContact O-N 2.81Å; S323-R412 PolarHBondContact O-NH2 2.87Å; S323-R412 VanDerWaalsContact O-NH2 3.09Å
324	I	86	Confident	93.4	Very high	141 Å²	141	30.1 Å²	30.1	72%	0.723	17%	0.171	S	C	*	.	P	Polyproline II helix	trans	-48.9	124.4	168.9	-60.8	171.2	0	0	0	108.6	T319 A326	T319-I324 WeakPolarHBondContact CB-O 3.38Å; T319-I324 PolarHBondContact OG1-O 2.92Å; I324-A326 PolarHBondContact O-N 2.97Å
325	A	90.2	Very high	93.2	Very high	19 Å²	19	33.6 Å²	33.6	16%	0.157	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-62.5	119.4	178	0	0	0	0	0	109.5	S323 S410 R412	S323-A325 PolarHBondContact O-N 2.81Å; A325-S410 WeakPolarHBondContact O-CA 3.27Å; A325-S410 PolarHBondContact O-N 2.93Å; A325-R412 HydrophobicContact CB-CG 4.19Å
326	A	93.4	Very high	93.2	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.008	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	150.6	171.5	0	0	0	0	0	110	F296 Y298 T318 T319 I324 Q408	F296-A326 HydrophobicContact CE1-CB 4.36Å; F296-A326 HydrophobicContact CZ-CB 4.49Å; Y298-A326 HydrophobicContact CE1-CB 3.86Å; T318-A326 CarbonylContact C-O 3.56Å; T318-A326 WeakPolarHBondContact CA-O 3.02Å; T319-A326 HydrophobicContact CG2-CB 3.91Å; T319-A326 PolarHBondContact N-O 2.91Å; T319-A326 PolarHBondContact OG1-N 3.2Å; T319-A326 PolarHBondContact OG1-O 3.37Å; I324-A326 PolarHBondContact O-N 2.97Å; A326-Q408 CarbonylContact C-O 3.56Å; A326-Q408 VanDerWaalsContact CA-O 3.3Å; A326-Q408 WeakPolarHBondContact CA-O 3.28Å
327	S	95.8	Very high	93.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	153.6	-176.4	-55.8	0	0	0	0	112.5	Y298 F317 T407 Q408 I411 R412 F413	Y298-S327 VanDerWaalsContact CE1-C 3.47Å; Y298-S327 WeakPolarHBondContact CE1-O 3.33Å; F317-S327 CarbonylContact O-C 3.56Å; F317-S327 VanDerWaalsContact O-CA 3.32Å; F317-S327 WeakPolarHBondContact O-CA 3.4Å; S327-T407 CarbonylContact O-C 3.57Å; S327-T407 VanDerWaalsContact O-CA 3.27Å; S327-T407 WeakPolarHBondContact O-CA 3.45Å; S327-Q408 PolarHBondContact N-O 2.99Å; S327-Q408 PolarHBondContact O-N 2.86Å; S327-I411 PolarHBondContact OG-O 3.44Å; S327-R412 VanDerWaalsContact OG-CA 3.23Å; S327-R412 WeakPolarHBondContact OG-CA 3.35Å; S327-F413 VanDerWaalsContact CB-CG 3.42Å; S327-F413 PolarHBondContact OG-N 3.2Å
328	A	95.6	Very high	92.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	152.4	172.8	0	0	0	0	0	111.7	Y298 F317 P404 V406 T407	Y298-A328 HydrophobicContact CD1-CB 3.77Å; Y298-A328 HydrophobicContact CD2-CB 3.48Å; Y298-A328 VanDerWaalsContact CD2-CB 3.48Å; Y298-A328 HydrophobicContact CE1-CB 3.94Å; Y298-A328 HydrophobicContact CE2-CB 3.67Å; Y298-A328 HydrophobicContact CG-CB 3.54Å; F317-A328 PolarHBondContact N-O 2.93Å; F317-A328 PolarHBondContact O-N 2.91Å; A328-P404 HydrophobicContact CB-CB 3.82Å; A328-P404 HydrophobicContact CB-CG 3.83Å; A328-V406 CarbonylContact C-O 3.57Å; A328-V406 VanDerWaalsContact CA-O 3.3Å; A328-V406 WeakPolarHBondContact CA-O 3.42Å; A328-T407 HydrophobicContact CB-CG2 4.28Å
329	V	96.9	Very high	92.7	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	117.9	165.9	-175.1	0	0	0	0	109.5	Y314 G315 V316 Y405 V406 F413 L416 M431 I433	Y314-V329 HydrophobicContact CD1-CG1 4.16Å; G315-V329 WeakPolarHBondContact O-CA 3.42Å; V316-V329 HydrophobicContact CG2-CG2 4.42Å; V329-Y405 PolarHBondContact O-N 3.44Å; V329-V406 HydrophobicContact CB-CB 4.5Å; V329-V406 PolarHBondContact N-O 2.91Å; V329-F413 HydrophobicContact CG2-CD2 4.06Å; V329-F413 HydrophobicContact CG2-CE2 4.06Å; V329-L416 HydrophobicContact CG1-CD2 3.68Å; V329-M431 HydrophobicContact CB-SD 4.35Å; V329-M431 HydrophobicContact CG1-CE 4.49Å; V329-M431 HydrophobicContact CG1-SD 3.66Å; V329-I433 HydrophobicContact CG2-CD1 3.84Å; V329-I433 HydrophobicContact CG2-CG1 4.27Å
330	C	96.1	Very high	92.7	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.007	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	152.4	173.9	-73.9	0	0	0	0	109.6	C288 G315 F317 F332 P399	C288-C330 WeakPolarHBondContact CA-SG 3.4Å; C288-C330 HydrophobicContact CB-CB 3.85Å; C288-C330 WeakPolarHBondContact CB-SG 3.11Å; C288-C330 WeakPolarHBondContact SG-CB 3.49Å; C288-C330 CovalentContact SG-SG 2.05Å; C288-C330 PolarHBondContact SG-SG 2.98Å; G315-C330 PolarHBondContact N-O 2.02Å; G315-C330 PolarHBondContact O-N 3.37Å; F317-C330 HydrophobicContact CD2-CB 4.29Å; F317-C330 HydrophobicContact CE2-CB 4Å; C330-F332 HydrophobicContact CB-CE2 4.11Å; C330-F332 HydrophobicContact CB-CZ 3.97Å; C330-P399 HydrophobicContact CB-CB 4.1Å
331	A	96	Very high	92.9	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	146.2	168.8	0	0	0	0	0	110.3	I313 Y314 P399 V400 Y405	I313-A331 CarbonylContact O-C 3.31Å; I313-A331 WeakPolarHBondContact O-CA 3.43Å; Y314-A331 HydrophobicContact CD1-CB 3.81Å; Y314-A331 HydrophobicContact CD2-CB 4.2Å; Y314-A331 HydrophobicContact CE1-CB 3.86Å; Y314-A331 HydrophobicContact CE2-CB 4.24Å; Y314-A331 HydrophobicContact CG-CB 3.98Å; A331-P399 CarbonylContact O-C 3.54Å; A331-P399 VanDerWaalsContact O-CA 3.28Å; A331-P399 WeakPolarHBondContact O-CA 3.21Å; A331-V400 PolarHBondContact O-N 3.5Å; A331-Y405 HydrophobicContact CB-CD2 4.42Å; A331-Y405 HydrophobicContact CB-CE2 3.66Å
332	F	96.7	Very high	93.3	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.009	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	136.2	-178.8	-53.7	-85.4	0	0	0	108.9	L286 N287 I313 F317 C330 I337 V397 P399	L286-F332 HydrophobicContact CB-CE1 4.49Å; L286-F332 HydrophobicContact CB-CZ 4.21Å; L286-F332 HydrophobicContact CD2-CD1 4.28Å; L286-F332 HydrophobicContact CD2-CD2 4.38Å; L286-F332 HydrophobicContact CD2-CE1 4.26Å; L286-F332 HydrophobicContact CD2-CE2 4.38Å; L286-F332 HydrophobicContact CD2-CG 4.34Å; L286-F332 HydrophobicContact CD2-CZ 4.32Å; N287-F332 WeakPolarHBondContact O-CE1 3.31Å; N287-F332 VanDerWaalsContact O-CZ 3.23Å; N287-F332 WeakPolarHBondContact O-CZ 3.47Å; I313-F332 PolarHBondContact N-O 2.88Å; I313-F332 PolarHBondContact O-N 2.77Å; F317-F332 AromaticContact CE2-CE2 3.64Å; F317-F332 HydrophobicContact CE2-CE2 3.64Å; F317-F332 AromaticContact CE2-CZ 3.9Å; F317-F332 HydrophobicContact CE2-CZ 3.9Å; F317-F332 AromaticContact CZ-CE2 3.52Å; F317-F332 HydrophobicContact CZ-CE2 3.52Å; F317-F332 AromaticContact CZ-CZ 3.62Å; F317-F332 HydrophobicContact CZ-CZ 3.62Å; C330-F332 HydrophobicContact CB-CE2 4.11Å; C330-F332 HydrophobicContact CB-CZ 3.97Å; F332-I337 HydrophobicContact CB-CD1 4.22Å; F332-I337 HydrophobicContact CB-CG1 4.43Å; F332-V397 HydrophobicContact CB-CG1 4.44Å; F332-V397 HydrophobicContact CD1-CG1 3.76Å; F332-V397 HydrophobicContact CE1-CG1 4.5Å; F332-V397 HydrophobicContact CG-CG1 4.4Å; F332-P399 HydrophobicContact CD1-CB 4.27Å; F332-P399 HydrophobicContact CE1-CB 3.94Å; F332-P399 HydrophobicContact CZ-CB 4.48Å
333	N	96.1	Very high	93.7	Very high	51 Å²	51	30.7 Å²	30.7	27%	0.273	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	140.2	171.6	-171.3	-67.1	0	0	0	109.6	L312 S335 A336 I337 V400	L312-N333 HydrophobicContact CD2-CB 4.16Å; N333-S335 PolarHBondContact O-N 2.03Å; N333-S335 VanDerWaalsContact OD1-CB 3.31Å; N333-S335 WeakPolarHBondContact OD1-CB 3.36Å; N333-S335 PolarHBondContact OD1-N 2.99Å; N333-S335 PolarHBondContact OD1-OG 3.48Å; N333-A336 WeakPolarHBondContact O-CB 3.49Å; N333-A336 PolarHBondContact O-N 2.86Å; N333-I337 PolarHBondContact O-N 3.48Å; N333-V400 HydrophobicContact CB-CG2 4.13Å
334	L	94.2	Very high	94.1	Very high	21 Å²	21	29.3 Å²	29.3	11%	0.11	17%	0.17	C	C	.	.	H	α-helix	trans	-57.5	-29.2	178.7	-169.2	66.3	0	0	0	113	I235 Y240 D311 I337 T338	I235-L334 HydrophobicContact CD1-CD1 4.41Å; I235-L334 HydrophobicContact CG2-CD2 3.69Å; Y240-L334 HydrophobicContact CE2-CD1 4.13Å; D311-L334 HydrophobicContact CB-CB 3.95Å; D311-L334 PolarHBondContact O-N 3.32Å; L334-I337 PolarHBondContact O-N 3.09Å; L334-T338 WeakPolarHBondContact O-CB 3.35Å; L334-T338 PolarHBondContact O-N 3.33Å; L334-T338 PolarHBondContact O-OG1 3Å
335	S	94.4	Very high	94.4	Very high	76 Å²	76	22.8 Å²	22.8	53%	0.531	14%	0.137	S	C	.	.	H	α-helix	trans	-64.4	-41.5	172.6	62.7	0	0	0	0	112.7	N333 T338 Q339	N333-S335 PolarHBondContact O-N 2.03Å; N333-S335 VanDerWaalsContact OD1-CB 3.31Å; N333-S335 WeakPolarHBondContact OD1-CB 3.36Å; N333-S335 PolarHBondContact OD1-N 2.99Å; N333-S335 PolarHBondContact OD1-OG 3.48Å; S335-T338 PolarHBondContact O-N 3.28Å; S335-Q339 WeakPolarHBondContact O-CB 3.4Å; S335-Q339 PolarHBondContact O-N 3.36Å
336	A	95.6	Very high	94.5	Very high	24 Å²	24	25.3 Å²	25.3	20%	0.198	14%	0.142	C	C	.	.	H	α-helix	trans	-69.2	-35.1	177.4	0	0	0	0	0	112.2	N333 A340	N333-A336 WeakPolarHBondContact O-CB 3.49Å; N333-A336 PolarHBondContact O-N 2.86Å; A336-A340 PolarHBondContact O-N 3.49Å; A336-A340 VanDerWaalsContact O-N 3.15Å
337	I	95.6	Very high	94.4	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61.8	-47.3	169.8	-67.9	169	0	0	0	110	Y240 F242 V260 I313 F332 N333 L334 Q339 A340 F341 V397	Y240-I337 HydrophobicContact CD1-CG2 4.44Å; Y240-I337 HydrophobicContact CE1-CG2 3.91Å; F242-I337 HydrophobicContact CZ-CD1 4.27Å; V260-I337 HydrophobicContact CG1-CG2 4.17Å; V260-I337 HydrophobicContact CG2-CG2 4.16Å; I313-I337 HydrophobicContact CD1-CD1 4.03Å; F332-I337 HydrophobicContact CB-CD1 4.22Å; F332-I337 HydrophobicContact CB-CG1 4.43Å; N333-I337 PolarHBondContact O-N 3.48Å; L334-I337 PolarHBondContact O-N 3.09Å; I337-Q339 PolarHBondContact O-N 3.07Å; I337-A340 PolarHBondContact O-N 3.41Å; I337-F341 HydrophobicContact CG2-CD2 3.82Å; I337-F341 HydrophobicContact CG2-CE2 3.53Å; I337-F341 WeakPolarHBondContact O-CD2 3.49Å; I337-F341 PolarHBondContact O-N 2.85Å; I337-V397 HydrophobicContact CB-CG1 4.49Å; I337-V397 HydrophobicContact CG1-CG1 3.65Å; I337-V397 HydrophobicContact CG1-CG2 4.41Å
338	T	92.7	Very high	94.1	Very high	46 Å²	46	29.1 Å²	29.1	28%	0.282	16%	0.157	S	C	.	.	H	α-helix	trans	-64.8	-39.5	179.6	-56.9	0	0	0	0	112.1	L334 S335 F341 N342	L334-T338 WeakPolarHBondContact O-CB 3.35Å; L334-T338 PolarHBondContact O-N 3.33Å; L334-T338 PolarHBondContact O-OG1 3Å; S335-T338 PolarHBondContact O-N 3.28Å; T338-F341 PolarHBondContact O-N 3.22Å; T338-N342 PolarHBondContact O-N 3.25Å; T338-N342 VanDerWaalsContact O-N 3.08Å
339	Q	93.3	Very high	93.6	Very high	141 Å²	141	35.6 Å²	35.6	66%	0.659	19%	0.188	S	C	*	.	H	α-helix	trans	-59.9	-47.8	175.5	-175.9	180	1.4	0	0	111.5	S335 I337 F341 N342 G343	S335-Q339 WeakPolarHBondContact O-CB 3.4Å; S335-Q339 PolarHBondContact O-N 3.36Å; I337-Q339 PolarHBondContact O-N 3.07Å; Q339-F341 VanDerWaalsContact C-N 3.27Å; Q339-F341 PolarHBondContact O-N 3.38Å; Q339-N342 PolarHBondContact O-N 3.39Å; Q339-G343 PolarHBondContact O-N 2.9Å
340	A	94.6	Very high	93	Very high	6 Å²	6	39.8 Å²	39.8	5%	0.05	21%	0.21	C	C	.	.	H	α-helix	trans	-62.2	-33.4	177.8	0	0	0	0	0	112.8	A284 A336 I337 N342 M393 D395 V397	A284-A340 HydrophobicContact CB-CB 4.42Å; A336-A340 PolarHBondContact O-N 3.49Å; A336-A340 VanDerWaalsContact O-N 3.15Å; I337-A340 PolarHBondContact O-N 3.41Å; A340-N342 VanDerWaalsContact C-N 3.33Å; A340-M393 WeakPolarHBondContact O-CE 3.49Å; A340-M393 WeakPolarHBondContact O-CG 3.39Å; A340-D395 HydrophobicContact CB-CB 4.35Å; A340-V397 HydrophobicContact CB-CG2 3.7Å
341	F	93.5	Very high	92.4	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-76.8	-13.5	173.3	-72.8	-58.5	0	0	0	114.8	Y240 V260 R262 M282 A284 I337 T338 Q339 M393	Y240-F341 HydrophobicContact CE1-CE2 4.09Å; V260-F341 HydrophobicContact CG1-CE2 4.25Å; V260-F341 HydrophobicContact CG1-CZ 4.13Å; V260-F341 HydrophobicContact CG2-CE2 4.35Å; V260-F341 HydrophobicContact CG2-CZ 4.41Å; R262-F341 HydrophobicContact CB-CE2 4.26Å; R262-F341 HydrophobicContact CB-CZ 4.31Å; R262-F341 HydrophobicContact CG-CD1 4.34Å; R262-F341 HydrophobicContact CG-CD2 4.2Å; R262-F341 HydrophobicContact CG-CE1 4.16Å; R262-F341 HydrophobicContact CG-CE2 4Å; R262-F341 HydrophobicContact CG-CG 4.37Å; R262-F341 HydrophobicContact CG-CZ 3.99Å; R262-F341 VanDerWaalsContact CZ-CB 3.43Å; M282-F341 HydrophobicContact CB-CD1 3.77Å; M282-F341 HydrophobicContact CB-CE1 3.81Å; M282-F341 WeakPolarHBondContact O-CE1 3.39Å; A284-F341 HydrophobicContact CB-CD1 4.42Å; A284-F341 HydrophobicContact CB-CE1 4Å; A284-F341 HydrophobicContact CB-CZ 4.26Å; I337-F341 HydrophobicContact CG2-CD2 3.82Å; I337-F341 HydrophobicContact CG2-CE2 3.53Å; I337-F341 WeakPolarHBondContact O-CD2 3.49Å; I337-F341 PolarHBondContact O-N 2.85Å; T338-F341 PolarHBondContact O-N 3.22Å; Q339-F341 VanDerWaalsContact C-N 3.27Å; Q339-F341 PolarHBondContact O-N 3.38Å; F341-M393 HydrophobicContact CD1-CG 3.66Å; F341-M393 HydrophobicContact CD1-SD 3.99Å; F341-M393 HydrophobicContact CE1-CG 4.15Å
342	N	91.9	Very high	91.8	Very high	36 Å²	36	57.1 Å²	57.1	19%	0.193	29%	0.29	C	S	.	.	H	α-helix	trans	-93.7	-19	172.4	-68.4	-9.5	0	0	0	112.1	T338 Q339 A340 N360 N364	T338-N342 PolarHBondContact O-N 3.25Å; T338-N342 VanDerWaalsContact O-N 3.08Å; Q339-N342 PolarHBondContact O-N 3.39Å; A340-N342 VanDerWaalsContact C-N 3.33Å; N342-N360 PolarHBondContact O-ND2 3.48Å; N342-N364 PolarHBondContact ND2-OD1 3.3Å
343	G	92.6	Very high	91.3	Very high	13 Å²	13	58.8 Å²	58.8	13%	0.134	30%	0.302	C	S	.	.	S	Bend	trans	-67.2	-178.5	174.9	0	0	0	0	0	114.8	Q339 M393	Q339-G343 PolarHBondContact O-N 2.9Å; G343-M393 WeakPolarHBondContact O-CE 3.4Å
344	P	94.3	Very high	90.9	Very high	37 Å²	37	59.2 Å²	59.2	24%	0.24	31%	0.313	C	S	.	.			trans	-64.6	152.3	179.8	26	-34.6	0	0	0	113.4	T358 N394	P344-T358 CarbonylContact C-O 3.54Å; P344-T358 WeakPolarHBondContact CA-O 3.41Å; P344-T358 WeakPolarHBondContact CB-O 3.08Å; P344-N394 HydrophobicContact CG-CB 4.34Å; P344-N394 WeakPolarHBondContact O-CB 3.41Å; P344-N394 PolarHBondContact O-N 3.28Å
345	F	93.8	Very high	90.6	Very high	5 Å²	5	59.2 Å²	59.2	2%	0.022	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	157.3	170.7	-70.9	-83.6	0	0	0	111.5	M282 P357 T358 N360 L390 L392 M393	M282-F345 HydrophobicContact CE-CZ 3.99Å; M282-F345 HydrophobicContact CG-CE1 4.37Å; M282-F345 HydrophobicContact SD-CZ 4.23Å; F345-P357 CarbonylContact O-C 3.52Å; F345-P357 WeakPolarHBondContact O-CA 3.33Å; F345-T358 PolarHBondContact N-O 3.06Å; F345-T358 PolarHBondContact O-N 3.06Å; F345-N360 HydrophobicContact CD2-CB 4.37Å; F345-N360 HydrophobicContact CE2-CB 4.17Å; F345-L390 HydrophobicContact CB-CB 4.31Å; F345-L390 HydrophobicContact CB-CD2 4Å; F345-L390 HydrophobicContact CD1-CB 3.84Å; F345-L390 WeakPolarHBondContact CD1-O 2.96Å; F345-L390 HydrophobicContact CD2-CB 4.04Å; F345-L390 HydrophobicContact CD2-CD1 4.22Å; F345-L390 HydrophobicContact CE1-CB 4.14Å; F345-L390 WeakPolarHBondContact CE1-O 3.21Å; F345-L390 HydrophobicContact CE2-CB 4.33Å; F345-L390 HydrophobicContact CG-CB 3.79Å; F345-L390 HydrophobicContact CG-CD2 4.38Å; F345-L390 HydrophobicContact CG-CG 4.46Å; F345-L390 HydrophobicContact CZ-CB 4.38Å; F345-L392 CarbonylContact C-O 3.55Å; F345-L392 WeakPolarHBondContact CA-O 3.47Å; F345-L392 WeakPolarHBondContact CD1-O 3.2Å; F345-M393 HydrophobicContact CD1-CE 3.92Å; F345-M393 HydrophobicContact CD1-SD 3.7Å; F345-M393 HydrophobicContact CD2-CE 4.4Å; F345-M393 HydrophobicContact CE1-CE 3.79Å; F345-M393 HydrophobicContact CE1-SD 3.38Å; F345-M393 WeakPolarHBondContact CE1-SD 3.12Å; F345-M393 HydrophobicContact CE2-CE 4.27Å; F345-M393 HydrophobicContact CG-CE 4.22Å; F345-M393 HydrophobicContact CZ-CE 3.97Å; F345-M393 HydrophobicContact CZ-SD 4.02Å
346	R	92.3	Very high	90.5	Very high	71 Å²	71	60.8 Å²	60.8	27%	0.268	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	102.9	171.2	-166.1	170.2	172	111.9	-10.6	108.3	E249 W355 L392 N394	E249-R346 PolarHBondContact O-NH2 3.37Å; R346-W355 HydrophobicContact CG-CB 4.02Å; R346-W355 HydrophobicContact CG-CE3 4.11Å; R346-W355 WeakPolarHBondContact O-CZ3 3.23Å; R346-L392 HydrophobicContact CB-CD2 4.23Å; R346-L392 HydrophobicContact CB-CG 4.19Å; R346-L392 PolarHBondContact N-O 3.03Å; R346-N394 HydrophobicContact CB-CB 3.91Å
347	Y	90.8	Very high	90.4	Very high	63 Å²	63	63.6 Å²	63.6	25%	0.247	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	153.4	-174.5	-178.4	-121.6	0	0	0	111.3	E349 W355 L356 T358 R389 L390	Y347-E349 HydrophobicContact CE1-CB 3.9Å; Y347-E349 HydrophobicContact CE1-CG 4.44Å; Y347-W355 CarbonylContact O-C 3.59Å; Y347-W355 WeakPolarHBondContact O-CA 3.46Å; Y347-L356 PolarHBondContact N-O 2.95Å; Y347-L356 PolarHBondContact O-N 3.28Å; Y347-T358 WeakPolarHBondContact CB-OG1 3.38Å; Y347-R389 HydrophobicContact CD2-CB 4.42Å; Y347-R389 HydrophobicContact CE2-CB 3.91Å; Y347-R389 HydrophobicContact CE2-CG 4.38Å; Y347-L390 HydrophobicContact CD2-CD2 4Å; Y347-L390 HydrophobicContact CG-CD2 4.12Å
348	Q	89.4	Confident	90.2	Very high	18 Å²	18	66 Å²	66	8%	0.084	34%	0.344	C	S	.	.			trans	-137.5	111.2	170.3	-178.7	-160.1	52.7	0	0	107.7	K222 N350 S353 W355	K222-Q348 PolarHBondContact NZ-O 3.12Å; Q348-N350 VanDerWaalsContact CD-O 3.25Å; Q348-N350 WeakPolarHBondContact CG-O 3.43Å; Q348-N350 PolarHBondContact NE2-O 3.35Å; Q348-S353 WeakPolarHBondContact CG-O 3.42Å; Q348-S353 VanDerWaalsContact CG-OG 3.31Å; Q348-S353 WeakPolarHBondContact CG-OG 3.25Å; Q348-S353 PolarHBondContact NE2-O 2.84Å; Q348-W355 HydrophobicContact CB-CD2 3.54Å; Q348-W355 HydrophobicContact CB-CE3 3.66Å; Q348-W355 HydrophobicContact CB-CG 4.07Å; Q348-W355 HydrophobicContact CB-CH2 4.21Å; Q348-W355 HydrophobicContact CB-CZ2 4.07Å; Q348-W355 HydrophobicContact CB-CZ3 4Å; Q348-W355 HydrophobicContact CG-CD2 4.38Å
349	E	84.6	Confident	89.9	Confident	137 Å²	137	71.2 Å²	71.2	64%	0.64	37%	0.369	S	S	*	.	S	Bend	trans	-62.9	-51.6	-177.4	-172.6	-171.1	-145.9	0	0	111.7	Y347 S353	Y347-E349 HydrophobicContact CE1-CB 3.9Å; Y347-E349 HydrophobicContact CE1-CG 4.44Å; E349-S353 PolarHBondContact N-OG 2.76Å
350	N	85.1	Confident	89.6	Confident	88 Å²	88	65.6 Å²	65.6	47%	0.471	34%	0.344	S	S	.	.	S	Bend	trans	-128	149.2	-177.2	-76.4	-68.3	0	0	0	111	Q348 R352 S353	Q348-N350 VanDerWaalsContact CD-O 3.25Å; Q348-N350 WeakPolarHBondContact CG-O 3.43Å; Q348-N350 PolarHBondContact NE2-O 3.35Å; N350-R352 PolarHBondContact O-N 3.01Å; N350-S353 PolarHBondContact N-OG 3.43Å; N350-S353 PolarHBondContact O-N 3.01Å; N350-S353 PolarHBondContact O-OG 2.81Å
351	P	82.7	Confident	89	Confident	114 Å²	114	68.5 Å²	68.5	74%	0.74	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-9.1	179.7	-25.8	35.2	0	0	0	116.3
352	R	83.3	Confident	88.2	Confident	251 Å²	251	71.7 Å²	71.7	95%	0.947	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-6.1	173.9	-62.9	-178.4	-179.5	170.3	-0.1	114	N350	N350-R352 PolarHBondContact O-N 3.01Å
353	S	86.8	Confident	87	Confident	36 Å²	36	73.9 Å²	73.9	25%	0.252	40%	0.395	S	S	.	.	S	Bend	trans	-83.2	151.3	175.5	65	0	0	0	0	110.6	Q348 E349 N350	Q348-S353 WeakPolarHBondContact CG-O 3.42Å; Q348-S353 VanDerWaalsContact CG-OG 3.31Å; Q348-S353 WeakPolarHBondContact CG-OG 3.25Å; Q348-S353 PolarHBondContact NE2-O 2.84Å; E349-S353 PolarHBondContact N-OG 2.76Å; N350-S353 PolarHBondContact N-OG 3.43Å; N350-S353 PolarHBondContact O-N 3.01Å; N350-S353 PolarHBondContact O-OG 2.81Å
354	A	86.9	Confident	85.9	Confident	60 Å²	60	78.4 Å²	78.4	50%	0.496	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-63.9	157.1	169.3	0	0	0	0	0	111.1
355	W	89.1	Confident	84.9	Confident	21 Å²	21	78.3 Å²	78.3	8%	0.08	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-80.1	120	170.6	-71.1	84.1	0	0	0	110.3	K222 V248 E249 R346 Y347 Q348 L392	K222-W355 HydrophobicContact CD-CH2 4.06Å; K222-W355 HydrophobicContact CG-CH2 4.39Å; V248-W355 HydrophobicContact CB-CH2 4.49Å; V248-W355 HydrophobicContact CB-CZ2 4.03Å; V248-W355 HydrophobicContact CG2-CH2 3.79Å; V248-W355 HydrophobicContact CG2-CZ2 3.79Å; V248-W355 VanDerWaalsContact O-CE2 3.31Å; V248-W355 WeakPolarHBondContact O-CZ2 3.02Å; V248-W355 PolarHBondContact O-NE1 2.92Å; E249-W355 HydrophobicContact CB-CD2 3.84Å; E249-W355 HydrophobicContact CB-CE3 4.25Å; E249-W355 HydrophobicContact CB-CG 3.99Å; R346-W355 HydrophobicContact CG-CB 4.02Å; R346-W355 HydrophobicContact CG-CE3 4.11Å; R346-W355 WeakPolarHBondContact O-CZ3 3.23Å; Y347-W355 CarbonylContact O-C 3.59Å; Y347-W355 WeakPolarHBondContact O-CA 3.46Å; Q348-W355 HydrophobicContact CB-CD2 3.54Å; Q348-W355 HydrophobicContact CB-CE3 3.66Å; Q348-W355 HydrophobicContact CB-CG 4.07Å; Q348-W355 HydrophobicContact CB-CH2 4.21Å; Q348-W355 HydrophobicContact CB-CZ2 4.07Å; Q348-W355 HydrophobicContact CB-CZ3 4Å; Q348-W355 HydrophobicContact CG-CD2 4.38Å; W355-L392 HydrophobicContact CE3-CD2 4.35Å; W355-L392 HydrophobicContact CZ3-CD2 3.98Å
356	L	91.3	Very high	83.7	Confident	109 Å²	109	83.5 Å²	83.5	57%	0.571	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	148.8	-173.6	-64	178.5	0	0	0	112.1	Y347	Y347-L356 PolarHBondContact N-O 2.95Å; Y347-L356 PolarHBondContact O-N 3.28Å
357	P	93.1	Very high	82.7	Confident	84 Å²	84	80.8 Å²	80.8	55%	0.545	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	136	172.2	29.6	-34.2	0	0	0	110.6	F345	F345-P357 CarbonylContact O-C 3.52Å; F345-P357 WeakPolarHBondContact O-CA 3.33Å
358	T	91.4	Very high	81.1	Confident	50 Å²	50	80 Å²	80	31%	0.307	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	136	176.7	-61.7	0	0	0	0	108.7	P344 F345 Y347 L390	P344-T358 CarbonylContact C-O 3.54Å; P344-T358 WeakPolarHBondContact CA-O 3.41Å; P344-T358 WeakPolarHBondContact CB-O 3.08Å; F345-T358 PolarHBondContact N-O 3.06Å; F345-T358 PolarHBondContact O-N 3.06Å; Y347-T358 WeakPolarHBondContact CB-OG1 3.38Å; T358-L390 HydrophobicContact CG2-CD2 4.43Å
359	L	87.8	Confident	79.1	Confident	155 Å²	155	83.5 Å²	83.5	81%	0.812	46%	0.462	S	S	*	.			trans	-59.3	143.3	-179.7	-66.5	173.1	0	0	0	111.1	P361	L359-P361 WeakPolarHBondContact O-CD 3.39Å
360	N	86.2	Confident	77.4	Confident	24 Å²	24	81.5 Å²	81.5	13%	0.128	46%	0.455	C	S	.	.			trans	-70.9	119.7	175.5	-174.6	-12.6	0	0	0	109.8	N342 F345 I362	N342-N360 PolarHBondContact O-ND2 3.48Å; F345-N360 HydrophobicContact CD2-CB 4.37Å; F345-N360 HydrophobicContact CE2-CB 4.17Å; N360-I362 VanDerWaalsContact C-N 3.27Å; N360-I362 PolarHBondContact O-N 3.42Å; N360-I362 PolarHBondContact OD1-N 2.81Å; N360-I362 PolarHBondContact OD1-O 3.08Å
361	P	81.4	Confident	75.1	Confident	67 Å²	67	84.5 Å²	84.5	44%	0.435	47%	0.471	S	S	.	.	S	Bend	trans	-72.2	-19.1	178.7	29.3	-34.9	0	0	0	113.2	L359 L390	L359-P361 WeakPolarHBondContact O-CD 3.39Å; P361-L390 HydrophobicContact CG-CD1 4.16Å
362	I	76.7	Confident	72.9	Confident	67 Å²	67	87.2 Å²	87.2	34%	0.344	48%	0.479	S	S	.	.	S	Bend	trans	-132.9	71.8	179.4	-45.9	179	0	0	0	109.3	N360 F365 I383	N360-I362 VanDerWaalsContact C-N 3.27Å; N360-I362 PolarHBondContact O-N 3.42Å; N360-I362 PolarHBondContact OD1-N 2.81Å; N360-I362 PolarHBondContact OD1-O 3.08Å; I362-F365 HydrophobicContact CB-CB 4.42Å; I362-F365 HydrophobicContact CG2-CB 3.96Å; I362-F365 HydrophobicContact CG2-CD2 4.03Å; I362-F365 HydrophobicContact CG2-CG 4.46Å; I362-F365 PolarHBondContact O-N 3.23Å; I362-I383 HydrophobicContact CD1-CG2 4.17Å
363	P	67.2	Low	70.7	Confident	82 Å²	82	82.9 Å²	82.9	53%	0.532	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	140.6	177	27.9	-34.5	0	0	0	110.6	F365	P363-F365 VanDerWaalsContact C-N 3.3Å; P363-F365 PolarHBondContact O-N 3.2Å
364	N	69.4	Low	68.3	Low	108 Å²	108	84 Å²	84	58%	0.578	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	28.7	-175.7	-50.9	-53.3	0	0	0	115.1	N342 Q366	N342-N364 PolarHBondContact ND2-OD1 3.3Å; N364-Q366 PolarHBondContact O-N 3.23Å
365	F	73.1	Confident	66.4	Low	34 Å²	34	86.9 Å²	86.9	15%	0.149	51%	0.506	C	S	.	.			trans	-49	123.5	174.1	175.5	-108.1	0	0	0	113.1	C264 T280 M282 I362 P363	C264-F365 VanDerWaalsContact SG-CE1 3.54Å; T280-F365 HydrophobicContact CG2-CE1 3.89Å; T280-F365 HydrophobicContact CG2-CZ 3.63Å; M282-F365 HydrophobicContact CE-CD1 4.31Å; I362-F365 HydrophobicContact CB-CB 4.42Å; I362-F365 HydrophobicContact CG2-CB 3.96Å; I362-F365 HydrophobicContact CG2-CD2 4.03Å; I362-F365 HydrophobicContact CG2-CG 4.46Å; I362-F365 PolarHBondContact O-N 3.23Å; P363-F365 VanDerWaalsContact C-N 3.3Å; P363-F365 PolarHBondContact O-N 3.2Å
366	Q	68.6	Low	64.7	Low	115 Å²	115	88.4 Å²	88.4	54%	0.537	52%	0.516	S	S	.	.			trans	-121.5	145.7	172.5	-63.8	-169.1	12.1	0	0	111	N364 G368 T369	N364-Q366 PolarHBondContact O-N 3.23Å; Q366-G368 PolarHBondContact O-N 2.92Å; Q366-T369 HydrophobicContact CB-CG2 4.07Å; Q366-T369 PolarHBondContact O-N 3.48Å; Q366-T369 PolarHBondContact O-OG1 2.84Å
367	C	71.6	Confident	62.7	Low	13 Å²	13	90.4 Å²	90.4	9%	0.088	52%	0.522	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	104.2	176.6	-52.3	0	0	0	0	110.8	L237 F238 C264 N266	L237-C367 HydrophobicContact CB-CB 3.81Å; L237-C367 HydrophobicContact CD1-CB 4.45Å; L237-C367 PolarHBondContact O-SG 3.27Å; F238-C367 WeakPolarHBondContact CD1-SG 3.39Å; F238-C367 WeakPolarHBondContact CE1-SG 3.01Å; F238-C367 WeakPolarHBondContact CZ-SG 3.46Å; C264-C367 WeakPolarHBondContact CA-SG 3.35Å; C264-C367 HydrophobicContact CB-CB 3.75Å; C264-C367 WeakPolarHBondContact CB-SG 3.24Å; C264-C367 WeakPolarHBondContact SG-CA 3Å; C264-C367 WeakPolarHBondContact SG-CB 3.38Å; C264-C367 CovalentContact SG-SG 2.04Å; C264-C367 PolarHBondContact SG-SG 3.05Å; N266-C367 WeakPolarHBondContact OD1-CB 3.35Å
368	G	58.2	Low	60.6	Low	48 Å²	48	92.8 Å²	92.8	50%	0.495	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	112.4	5.8	178.3	0	0	0	0	0	116.1	Q366 L370	Q366-G368 PolarHBondContact O-N 2.92Å; G368-L370 PolarHBondContact O-N 3.36Å
369	T	46.8	Very low	58.9	Low	90 Å²	90	92 Å²	92	55%	0.552	52%	0.524	S	S	*	.			trans	-85	25.6	169.3	58	0	0	0	0	113.3	Q366	Q366-T369 HydrophobicContact CB-CG2 4.07Å; Q366-T369 PolarHBondContact O-N 3.48Å; Q366-T369 PolarHBondContact O-OG1 2.84Å
370	L	48.5	Very low	57.9	Low	96 Å²	96	88.7 Å²	88.7	50%	0.503	51%	0.51	S	S	.	.	S	Bend	trans	-106.2	119	160.7	-66.2	173.3	0	0	0	105.3	G368 L379	G368-L370 PolarHBondContact O-N 3.36Å; L370-L379 HydrophobicContact CD1-CD2 4.09Å; L370-L379 HydrophobicContact CD1-CG 4.24Å
371	N	37.8	Very low	57	Low	151 Å²	151	93.4 Å²	93.4	81%	0.807	53%	0.531	S	S	*	.			trans	-53.6	139	-164.3	-64.2	-11.9	0	0	0	113.5	D373	N371-D373 PolarHBondContact O-N 3.36Å
372	D	36.4	Very low	56.7	Low	170 Å²	170	99 Å²	99	91%	0.909	54%	0.544	S	S	*	.	S	Bend	trans	-74.4	16.7	-167.3	-145.3	15.7	0	0	0	114.8
373	D	37.3	Very low	56.7	Low	160 Å²	160	98.3 Å²	98.3	86%	0.856	54%	0.54	S	S	*	.	S	Bend	trans	-110.4	71.8	-176.2	-78.4	-56.2	0	0	0	111.6	N371	N371-D373 PolarHBondContact O-N 3.36Å
374	G	34.9	Very low	57.3	Low	59 Å²	59	94.9 Å²	94.9	61%	0.608	52%	0.518	S	S	*	.	S	Bend	trans	133	157.2	159.2	0	0	0	0	0	117	N376	G374-N376 PolarHBondContact O-N 2.85Å
375	P	48.3	Very low	58	Low	121 Å²	121	92.7 Å²	92.7	79%	0.786	50%	0.504	S	S	*	.	S	Bend	trans	-77.5	83.1	-176.2	32.5	-36	0	0	0	112.9	E377	P375-E377 PolarHBondContact O-N 2.9Å
376	N	53.6	Low	58.6	Low	54 Å²	54	92.9 Å²	92.9	29%	0.289	51%	0.506	S	S	.	.	S	Bend	trans	59.4	35.2	155.6	-137.2	31.1	0	0	0	117.3	I268 G374	I268-N376 HydrophobicContact CD1-CB 4.16Å; G374-N376 PolarHBondContact O-N 2.85Å
377	E	47.8	Very low	59.3	Low	150 Å²	150	88.2 Å²	88.2	70%	0.701	49%	0.487	S	S	*	.			trans	-83.6	-17	172.7	-58.2	-147.7	117.4	0	0	113.9	R271 P375	R271-E377 IonicContact NH1-OE1 2.88Å; P375-E377 PolarHBondContact O-N 2.9Å
378	N	49	Very low	60	Low	135 Å²	135	91.8 Å²	91.8	72%	0.722	50%	0.503	S	S	*	.			trans	-100.6	6.5	-168.1	-68.8	-34.5	0	0	0	115.8	T380	N378-T380 PolarHBondContact O-N 2.92Å; N378-T380 VanDerWaalsContact O-N 3.13Å
379	L	57.3	Low	61.4	Low	33 Å²	33	95 Å²	95	17%	0.173	50%	0.5	C	S	.	.			trans	-78.9	91	166.6	-90	169.8	0	0	0	109.6	L370 I383	L370-L379 HydrophobicContact CD1-CD2 4.09Å; L370-L379 HydrophobicContact CD1-CG 4.24Å; L379-I383 HydrophobicContact CD2-CB 4.38Å; L379-I383 HydrophobicContact CD2-CG2 3.85Å
380	T	65	Low	63.4	Low	85 Å²	85	91.7 Å²	91.7	52%	0.521	48%	0.479	S	S	.	.			trans	-57.9	142.5	177.3	58.9	0	0	0	0	111.5	N378 R382 I383	N378-T380 PolarHBondContact O-N 2.92Å; N378-T380 VanDerWaalsContact O-N 3.13Å; T380-R382 PolarHBondContact O-N 2.76Å; T380-I383 WeakPolarHBondContact O-CB 3.32Å; T380-I383 PolarHBondContact O-N 2.7Å
381	E	68.3	Low	65.5	Low	123 Å²	123	87.6 Å²	87.6	58%	0.575	46%	0.457	S	S	*	.	H	α-helix	trans	-52.3	-36.5	-174.5	-165.4	-165.4	145.9	0	0	112.8	L273 I383 L384 Q385	L273-E381 HydrophobicContact CD1-CG 4.32Å; E381-I383 VanDerWaalsContact C-N 3.32Å; E381-I383 PolarHBondContact O-N 3.18Å; E381-L384 PolarHBondContact O-N 2.93Å; E381-L384 VanDerWaalsContact O-N 3.07Å; E381-Q385 WeakPolarHBondContact O-CG 3.46Å; E381-Q385 PolarHBondContact O-N 3.2Å; E381-Q385 PolarHBondContact OE1-NE2 3.25Å
382	R	74.6	Confident	68.2	Low	185 Å²	185	80.4 Å²	80.4	70%	0.698	42%	0.419	S	S	*	.	H	α-helix	trans	-55.4	-41.9	175.8	-174.6	174.3	-178.5	163.3	3.1	112.9	T380 L384 Q385 D386	T380-R382 PolarHBondContact O-N 2.76Å; R382-L384 VanDerWaalsContact C-N 3.3Å; R382-L384 PolarHBondContact O-N 3.47Å; R382-Q385 PolarHBondContact O-N 2.99Å; R382-D386 WeakPolarHBondContact O-CB 3.28Å; R382-D386 VanDerWaalsContact O-CG 3.27Å; R382-D386 PolarHBondContact O-N 2.78Å
383	I	77.1	Confident	71	Confident	52 Å²	52	72.6 Å²	72.6	27%	0.267	38%	0.377	S	S	.	.	H	α-helix	trans	-65.3	-35.7	178.5	-63.1	170.4	0	0	0	110.7	I362 L379 T380 E381 A387	I362-I383 HydrophobicContact CD1-CG2 4.17Å; L379-I383 HydrophobicContact CD2-CB 4.38Å; L379-I383 HydrophobicContact CD2-CG2 3.85Å; T380-I383 WeakPolarHBondContact O-CB 3.32Å; T380-I383 PolarHBondContact O-N 2.7Å; E381-I383 VanDerWaalsContact C-N 3.32Å; E381-I383 PolarHBondContact O-N 3.18Å; I383-A387 VanDerWaalsContact O-CB 3.29Å; I383-A387 WeakPolarHBondContact O-CB 3.36Å; I383-A387 PolarHBondContact O-N 2.82Å
384	L	80.6	Confident	73.8	Confident	11 Å²	11	67 Å²	67	6%	0.058	35%	0.347	C	S	.	.	H	α-helix	trans	-72.3	-38.5	175.9	-60.2	177.3	0	0	0	112	L273 T279 E381 R382 Q388	L273-L384 HydrophobicContact CB-CB 4.18Å; L273-L384 HydrophobicContact CB-CD1 4.48Å; L273-L384 HydrophobicContact CD1-CB 4.44Å; T279-L384 HydrophobicContact CG2-CD2 3.72Å; E381-L384 PolarHBondContact O-N 2.93Å; E381-L384 VanDerWaalsContact O-N 3.07Å; R382-L384 VanDerWaalsContact C-N 3.3Å; R382-L384 PolarHBondContact O-N 3.47Å; L384-Q388 PolarHBondContact O-N 3.43Å
385	Q	83.4	Confident	76.7	Confident	61 Å²	61	66.9 Å²	66.9	29%	0.285	33%	0.332	S	S	.	.	H	α-helix	trans	-64.6	-40.1	172.4	-66.7	-174.4	18.1	0	0	111.8	L273 E381 R382 R389	L273-Q385 HydrophobicContact CD1-CG 3.74Å; E381-Q385 WeakPolarHBondContact O-CG 3.46Å; E381-Q385 PolarHBondContact O-N 3.2Å; E381-Q385 PolarHBondContact OE1-NE2 3.25Å; R382-Q385 PolarHBondContact O-N 2.99Å; Q385-R389 WeakPolarHBondContact O-CD 3.42Å; Q385-R389 VanDerWaalsContact O-CG 3.28Å; Q385-R389 WeakPolarHBondContact O-CG 3.25Å; Q385-R389 PolarHBondContact O-N 2.9Å
386	D	85.1	Confident	78.9	Confident	38 Å²	38	63.4 Å²	63.4	20%	0.203	31%	0.309	C	S	.	.	H	α-helix	trans	-66.1	-47.7	175.5	-73.6	-24.8	0	0	0	110.3	R382 Q388 R389 L390	R382-D386 WeakPolarHBondContact O-CB 3.28Å; R382-D386 VanDerWaalsContact O-CG 3.27Å; R382-D386 PolarHBondContact O-N 2.78Å; D386-Q388 VanDerWaalsContact C-N 3.28Å; D386-Q388 PolarHBondContact O-N 2.94Å; D386-R389 CarbonylContact O-C 3.54Å; D386-R389 PolarHBondContact O-N 2.91Å; D386-L390 HydrophobicContact CB-CD1 4.21Å; D386-L390 VanDerWaalsContact O-CB 3.32Å; D386-L390 WeakPolarHBondContact O-CB 3.39Å; D386-L390 PolarHBondContact O-N 2.85Å
387	A	83.4	Confident	81	Confident	17 Å²	17	60.9 Å²	60.9	14%	0.14	30%	0.295	C	S	.	.	H	α-helix	trans	-58.4	-35.1	176.3	0	0	0	0	0	113.6	L274 T279 I383 R389	L274-A387 HydrophobicContact CD1-CB 4.02Å; T279-A387 WeakPolarHBondContact O-CB 3.49Å; I383-A387 VanDerWaalsContact O-CB 3.29Å; I383-A387 WeakPolarHBondContact O-CB 3.36Å; I383-A387 PolarHBondContact O-N 2.82Å; A387-R389 PolarHBondContact O-N 2.87Å
388	Q	85.9	Confident	83.3	Confident	88 Å²	88	58.3 Å²	58.3	41%	0.411	28%	0.283	S	S	.	.	H	α-helix	trans	-65.7	-24.3	175	-167.1	-179.1	25.1	0	0	112.9	L274 L384 D386 F391	L274-Q388 HydrophobicContact CD1-CB 4.41Å; L274-Q388 HydrophobicContact CD2-CB 4.34Å; L274-Q388 HydrophobicContact CD2-CG 4.26Å; L384-Q388 PolarHBondContact O-N 3.43Å; D386-Q388 VanDerWaalsContact C-N 3.28Å; D386-Q388 PolarHBondContact O-N 2.94Å; Q388-F391 WeakPolarHBondContact O-CE1 3.22Å
389	R	87.9	Confident	85.5	Confident	117 Å²	117	52.6 Å²	52.6	44%	0.442	25%	0.253	S	S	.	.	H	α-helix	trans	-110.7	-30.4	-170.3	-66.8	173.3	-172.8	-172.1	5.7	114.2	Y347 Q385 D386 A387 F391	Y347-R389 HydrophobicContact CD2-CB 4.42Å; Y347-R389 HydrophobicContact CE2-CB 3.91Å; Y347-R389 HydrophobicContact CE2-CG 4.38Å; Q385-R389 WeakPolarHBondContact O-CD 3.42Å; Q385-R389 VanDerWaalsContact O-CG 3.28Å; Q385-R389 WeakPolarHBondContact O-CG 3.25Å; Q385-R389 PolarHBondContact O-N 2.9Å; D386-R389 CarbonylContact O-C 3.54Å; D386-R389 PolarHBondContact O-N 2.91Å; A387-R389 PolarHBondContact O-N 2.87Å; R389-F391 WeakPolarHBondContact O-CE1 3.47Å
390	L	90.3	Very high	87.2	Confident	20 Å²	20	54.6 Å²	54.6	11%	0.105	27%	0.267	C	S	.	.			trans	-114.4	76.3	-169.5	-58.2	-176.2	0	0	0	110.3	F345 Y347 T358 P361 D386	F345-L390 HydrophobicContact CB-CB 4.31Å; F345-L390 HydrophobicContact CB-CD2 4Å; F345-L390 HydrophobicContact CD1-CB 3.84Å; F345-L390 WeakPolarHBondContact CD1-O 2.96Å; F345-L390 HydrophobicContact CD2-CB 4.04Å; F345-L390 HydrophobicContact CD2-CD1 4.22Å; F345-L390 HydrophobicContact CE1-CB 4.14Å; F345-L390 WeakPolarHBondContact CE1-O 3.21Å; F345-L390 HydrophobicContact CE2-CB 4.33Å; F345-L390 HydrophobicContact CG-CB 3.79Å; F345-L390 HydrophobicContact CG-CD2 4.38Å; F345-L390 HydrophobicContact CG-CG 4.46Å; F345-L390 HydrophobicContact CZ-CB 4.38Å; Y347-L390 HydrophobicContact CD2-CD2 4Å; Y347-L390 HydrophobicContact CG-CD2 4.12Å; T358-L390 HydrophobicContact CG2-CD2 4.43Å; P361-L390 HydrophobicContact CG-CD1 4.16Å; D386-L390 HydrophobicContact CB-CD1 4.21Å; D386-L390 VanDerWaalsContact O-CB 3.32Å; D386-L390 WeakPolarHBondContact O-CB 3.39Å; D386-L390 PolarHBondContact O-N 2.85Å
391	F	91.4	Very high	88.4	Confident	9 Å²	9	51.9 Å²	51.9	4%	0.039	25%	0.25	C	S	.	.			trans	-119.9	-12.4	-178.6	46.3	-97.9	0	0	0	113.2	K222 W223 F281 M282 K283 Q388 R389	K222-F391 HydrophobicContact CB-CE2 3.67Å; K222-F391 HydrophobicContact CB-CZ 3.46Å; K222-F391 VanDerWaalsContact CB-CZ 3.46Å; K222-F391 HydrophobicContact CD-CZ 4.17Å; K222-F391 HydrophobicContact CG-CZ 4.44Å; K222-F391 VanDerWaalsContact O-CE2 3.28Å; K222-F391 WeakPolarHBondContact O-CE2 3.12Å; W223-F391 AromaticContact CD1-CD1 3.66Å; W223-F391 AromaticContact CD1-CE1 3.72Å; W223-F391 AromaticContact CD1-CG 3.97Å; W223-F391 AromaticContact NE1-CD1 3.32Å; W223-F391 VanDerWaalsContact NE1-CD1 3.32Å; W223-F391 AromaticContact NE1-CE1 3.61Å; W223-F391 AromaticContact NE1-CG 3.93Å; F281-F391 HydrophobicContact CD1-CB 4.09Å; F281-F391 HydrophobicContact CE1-CB 4.4Å; M282-F391 CarbonylContact C-O 3.59Å; M282-F391 WeakPolarHBondContact CA-O 3.4Å; K283-F391 WeakPolarHBondContact CG-O 3.35Å; K283-F391 PolarHBondContact N-O 3Å; Q388-F391 WeakPolarHBondContact O-CE1 3.22Å; R389-F391 WeakPolarHBondContact O-CE1 3.47Å
392	L	94.9	Very high	89.4	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	123.5	178.6	176.5	63.9	0	0	0	109.6	E249 K283 F345 R346 W355	E249-L392 HydrophobicContact CB-CD2 3.91Å; E249-L392 HydrophobicContact CG-CD2 4.12Å; K283-L392 HydrophobicContact CG-CD1 4.08Å; K283-L392 WeakPolarHBondContact O-CA 3.24Å; F345-L392 CarbonylContact C-O 3.55Å; F345-L392 WeakPolarHBondContact CA-O 3.47Å; F345-L392 WeakPolarHBondContact CD1-O 3.2Å; R346-L392 HydrophobicContact CB-CD2 4.23Å; R346-L392 HydrophobicContact CB-CG 4.19Å; R346-L392 PolarHBondContact N-O 3.03Å; W355-L392 HydrophobicContact CE3-CD2 4.35Å; W355-L392 HydrophobicContact CZ3-CD2 3.98Å
393	M	95.7	Very high	90.1	Very high	5 Å²	5	44.7 Å²	44.7	3%	0.025	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	144.8	173.4	-49.7	-42.2	-59.3	0	0	110.7	M282 K283 A284 A340 F341 G343 F345	M282-M393 HydrophobicContact CB-SD 4.37Å; K283-M393 PolarHBondContact O-N 3.01Å; A284-M393 HydrophobicContact CB-CB 3.97Å; A284-M393 HydrophobicContact CB-CG 3.81Å; A340-M393 WeakPolarHBondContact O-CE 3.49Å; A340-M393 WeakPolarHBondContact O-CG 3.39Å; F341-M393 HydrophobicContact CD1-CG 3.66Å; F341-M393 HydrophobicContact CD1-SD 3.99Å; F341-M393 HydrophobicContact CE1-CG 4.15Å; G343-M393 WeakPolarHBondContact O-CE 3.4Å; F345-M393 HydrophobicContact CD1-CE 3.92Å; F345-M393 HydrophobicContact CD1-SD 3.7Å; F345-M393 HydrophobicContact CD2-CE 4.4Å; F345-M393 HydrophobicContact CE1-CE 3.79Å; F345-M393 HydrophobicContact CE1-SD 3.38Å; F345-M393 WeakPolarHBondContact CE1-SD 3.12Å; F345-M393 HydrophobicContact CE2-CE 4.27Å; F345-M393 HydrophobicContact CG-CE 4.22Å; F345-M393 HydrophobicContact CZ-CE 3.97Å; F345-M393 HydrophobicContact CZ-SD 4.02Å
394	N	94.9	Very high	90.8	Very high	42 Å²	42	42.2 Å²	42.2	23%	0.225	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	-37	167.9	177.4	79.2	0	0	0	111.4	P344 R346	P344-N394 HydrophobicContact CG-CB 4.34Å; P344-N394 WeakPolarHBondContact O-CB 3.41Å; P344-N394 PolarHBondContact O-N 3.28Å; R346-N394 HydrophobicContact CB-CB 3.91Å
395	D	95.4	Very high	91.4	Very high	57 Å²	57	42.4 Å²	42.4	31%	0.305	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	137.6	-177.1	-69.9	9	0	0	0	110.6	A340	A340-D395 HydrophobicContact CB-CB 4.35Å
396	V	95.8	Very high	91.8	Very high	48 Å²	48	39.5 Å²	39.5	29%	0.291	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	125.1	-175.8	-177.2	0	0	0	0	108.7	R285 N287 Q398	R285-V396 HydrophobicContact CB-CG1 4.03Å; R285-V396 HydrophobicContact CB-CG2 4.25Å; R285-V396 HydrophobicContact CG-CG1 4Å; R285-V396 WeakPolarHBondContact O-CG1 2.94Å; N287-V396 HydrophobicContact CB-CG1 3.77Å; V396-Q398 PolarHBondContact O-N 3.08Å; V396-Q398 VanDerWaalsContact O-N 3.16Å; V396-Q398 PolarHBondContact O-NE2 3.38Å
397	V	97.6	Very high	92.1	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	116.9	177.6	-174.8	0	0	0	0	109	V260 A284 R285 L286 N287 F332 I337 A340	V260-V397 HydrophobicContact CG1-CG2 3.98Å; A284-V397 HydrophobicContact CB-CG2 4Å; R285-V397 PolarHBondContact O-N 3.15Å; L286-V397 HydrophobicContact CD2-CB 4.02Å; L286-V397 HydrophobicContact CD2-CG1 4.14Å; L286-V397 HydrophobicContact CD2-CG2 4.31Å; N287-V397 PolarHBondContact N-O 3.33Å; F332-V397 HydrophobicContact CB-CG1 4.44Å; F332-V397 HydrophobicContact CD1-CG1 3.76Å; F332-V397 HydrophobicContact CE1-CG1 4.5Å; F332-V397 HydrophobicContact CG-CG1 4.4Å; I337-V397 HydrophobicContact CB-CG1 4.49Å; I337-V397 HydrophobicContact CG1-CG1 3.65Å; I337-V397 HydrophobicContact CG1-CG2 4.41Å; A340-V397 HydrophobicContact CB-CG2 3.7Å
398	Q	95.7	Very high	92.3	Very high	96 Å²	96	40 Å²	40	45%	0.449	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-87.7	145.4	177.6	-59.5	-51.2	-46.8	0	0	111.7	N287 V396	N287-Q398 PolarHBondContact ND2-OE1 3.04Å; V396-Q398 PolarHBondContact O-N 3.08Å; V396-Q398 VanDerWaalsContact O-N 3.16Å; V396-Q398 PolarHBondContact O-NE2 3.38Å
399	P	95.6	Very high	92.3	Very high	15 Å²	15	39.2 Å²	39.2	10%	0.097	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-70.8	158.7	172.6	28	-31.5	0	0	0	112.1	N287 C330 A331 F332 T401	N287-P399 WeakPolarHBondContact O-CD 3.1Å; C330-P399 HydrophobicContact CB-CB 4.1Å; A331-P399 CarbonylContact O-C 3.54Å; A331-P399 VanDerWaalsContact O-CA 3.28Å; A331-P399 WeakPolarHBondContact O-CA 3.21Å; F332-P399 HydrophobicContact CD1-CB 4.27Å; F332-P399 HydrophobicContact CE1-CB 3.94Å; F332-P399 HydrophobicContact CZ-CB 4.48Å; P399-T401 WeakPolarHBondContact CB-O 3.4Å; P399-T401 VanDerWaalsContact CG-O 3.23Å; P399-T401 WeakPolarHBondContact CG-O 3.49Å; P399-T401 PolarHBondContact O-N 2.81Å
400	V	93.2	Very high	92.2	Very high	75 Å²	75	37.4 Å²	37.4	46%	0.455	21%	0.211	S	C	.	.	S	Bend	trans	-59.3	-34.3	-180	174.1	0	0	0	0	112.1	L312 A331 N333	L312-V400 HydrophobicContact CD2-CG2 3.87Å; A331-V400 PolarHBondContact O-N 3.5Å; N333-V400 HydrophobicContact CB-CG2 4.13Å
401	T	90.5	Very high	92.1	Very high	28 Å²	28	38 Å²	38	17%	0.172	21%	0.214	C	C	.	.	S	Bend	trans	-112.1	137.6	168.1	54.6	0	0	0	0	109.1	P399 D403 Y405 T447	P399-T401 WeakPolarHBondContact CB-O 3.4Å; P399-T401 VanDerWaalsContact CG-O 3.23Å; P399-T401 WeakPolarHBondContact CG-O 3.49Å; P399-T401 PolarHBondContact O-N 2.81Å; T401-D403 WeakPolarHBondContact CB-O 3.12Å; T401-D403 PolarHBondContact O-N 3.22Å; T401-D403 PolarHBondContact OG1-O 3.26Å; T401-Y405 HydrophobicContact CG2-CE1 4.15Å; T401-T447 HydrophobicContact CG2-CG2 3.93Å
402	V	87.6	Confident	92.2	Very high	118 Å²	118	39.4 Å²	39.4	72%	0.715	22%	0.219	S	C	*	.	S	Bend	trans	-50.1	-20.8	175.8	175.3	0	0	0	0	113.7
403	D	89.5	Confident	92.2	Very high	40 Å²	40	39.5 Å²	39.5	21%	0.214	22%	0.219	C	C	.	.	S	Bend	trans	-144.5	132.8	-158.9	-140.1	-13.9	0	0	0	106.6	R290 A291 T401 R452	R290-D403 WeakPolarHBondContact CA-OD1 3.41Å; A291-D403 PolarHBondContact N-OD1 2.81Å; T401-D403 WeakPolarHBondContact CB-O 3.12Å; T401-D403 PolarHBondContact O-N 3.22Å; T401-D403 PolarHBondContact OG1-O 3.26Å; D403-R452 VanDerWaalsContact C-NH2 3.32Å; D403-R452 VanDerWaalsContact CB-NH2 3.35Å; D403-R452 IonicContact OD1-CZ 3.43Å; D403-R452 IonicContact OD1-NH1 2.75Å; D403-R452 PolarHBondContact OD1-NH1 3.33Å; D403-R452 IonicContact OD1-NH2 2.89Å; D403-R452 PolarHBondContact OD1-NH2 3.39Å; D403-R452 IonicContact OD2-CZ 3.84Å; D403-R452 IonicContact OD2-NH1 3.75Å; D403-R452 PolarHBondContact OD2-NH1 2.87Å; D403-R452 IonicContact OD2-NH2 3.84Å
404	P	93.3	Very high	92.2	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.225	C	C	.	.			trans	-67.6	150.7	-164.1	-21.8	33	0	0	0	114.1	S289 Y298 A328 T407 R452	S289-P404 WeakPolarHBondContact O-CD 3.37Å; Y298-P404 HydrophobicContact CE2-CG 4.42Å; A328-P404 HydrophobicContact CB-CB 3.82Å; A328-P404 HydrophobicContact CB-CG 3.83Å; P404-T407 HydrophobicContact CB-CG2 3.94Å; P404-T407 HydrophobicContact CG-CG2 4.11Å; P404-R452 VanDerWaalsContact CD-NH2 3.31Å; P404-R452 VanDerWaalsContact N-NH2 3.16Å; P404-R452 PolarHBondContact O-NE 3.07Å; P404-R452 PolarHBondContact O-NH2 2.89Å
405	Y	91.5	Very high	92.2	Very high	14 Å²	14	41.3 Å²	41.3	6%	0.055	23%	0.228	C	C	.	.	S	Bend	trans	-62.1	-44.4	-179.2	-70.8	-80.7	0	0	0	112.5	V329 A331 T401 S445 T446 T447 S453	V329-Y405 PolarHBondContact O-N 3.44Å; A331-Y405 HydrophobicContact CB-CD2 4.42Å; A331-Y405 HydrophobicContact CB-CE2 3.66Å; T401-Y405 HydrophobicContact CG2-CE1 4.15Å; Y405-S445 WeakPolarHBondContact CD1-OG 3.45Å; Y405-S445 WeakPolarHBondContact CE1-OG 3.02Å; Y405-T446 WeakPolarHBondContact CD1-O 3.4Å; Y405-T447 HydrophobicContact CE1-CG2 4.4Å; Y405-S453 PolarHBondContact O-N 3.49Å
406	V	91.9	Very high	92.2	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	134.3	178.5	170.4	0	0	0	0	108	A328 V329 F413 M431 I433 A443 Y455	A328-V406 CarbonylContact C-O 3.57Å; A328-V406 VanDerWaalsContact CA-O 3.3Å; A328-V406 WeakPolarHBondContact CA-O 3.42Å; V329-V406 HydrophobicContact CB-CB 4.5Å; V329-V406 PolarHBondContact N-O 2.91Å; V406-F413 HydrophobicContact CG1-CE2 4.08Å; V406-F413 HydrophobicContact CG1-CZ 4.09Å; V406-M431 HydrophobicContact CB-CE 4.12Å; V406-M431 HydrophobicContact CG2-CE 3.37Å; V406-I433 HydrophobicContact CG1-CD1 4.09Å; V406-A443 HydrophobicContact CG2-CB 3.84Å; V406-Y455 HydrophobicContact CG1-CD1 4.46Å; V406-Y455 HydrophobicContact CG1-CE1 3.49Å; V406-Y455 VanDerWaalsContact CG1-CE1 3.49Å; V406-Y455 VanDerWaalsContact CG1-OH 3.27Å; V406-Y455 WeakPolarHBondContact CG1-OH 3.28Å
407	T	91.5	Very high	92.3	Very high	21 Å²	21	36.6 Å²	36.6	13%	0.129	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	137.7	170.5	58.5	0	0	0	0	109.9	S327 A328 P404 S453 Y455	S327-T407 CarbonylContact O-C 3.57Å; S327-T407 VanDerWaalsContact O-CA 3.27Å; S327-T407 WeakPolarHBondContact O-CA 3.45Å; A328-T407 HydrophobicContact CB-CG2 4.28Å; P404-T407 HydrophobicContact CB-CG2 3.94Å; P404-T407 HydrophobicContact CG-CG2 4.11Å; T407-S453 PolarHBondContact N-OG 3.24Å; T407-S453 PolarHBondContact OG1-OG 3.33Å; T407-Y455 VanDerWaalsContact C-OH 3.31Å; T407-Y455 PolarHBondContact O-OH 2.85Å
408	Q	88.6	Confident	92.2	Very high	44 Å²	44	36.5 Å²	36.5	21%	0.206	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	128	166.6	-169.7	62.7	-66.3	0	0	109.6	A326 S327 I411 F413 Y455	A326-Q408 CarbonylContact C-O 3.56Å; A326-Q408 VanDerWaalsContact CA-O 3.3Å; A326-Q408 WeakPolarHBondContact CA-O 3.28Å; S327-Q408 PolarHBondContact N-O 2.99Å; S327-Q408 PolarHBondContact O-N 2.86Å; Q408-I411 HydrophobicContact CG-CB 3.83Å; Q408-I411 HydrophobicContact CG-CD1 4.09Å; Q408-I411 HydrophobicContact CG-CG1 4.06Å; Q408-F413 HydrophobicContact CB-CE1 3.64Å; Q408-F413 HydrophobicContact CB-CZ 3.52Å; Q408-F413 HydrophobicContact CG-CE1 4.33Å; Q408-Y455 WeakPolarHBondContact CB-OH 3.5Å
409	D	84.8	Confident	92.2	Very high	73 Å²	73	32.4 Å²	32.4	39%	0.39	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	143.4	169.7	-62.6	-39.6	0	0	0	107.6	R290	R290-D409 IonicContact CZ-OD2 3.58Å; R290-D409 IonicContact NH1-OD1 2.68Å; R290-D409 PolarHBondContact NH1-OD1 2.81Å; R290-D409 IonicContact NH1-OD2 3.13Å; R290-D409 PolarHBondContact NH1-OD2 2.82Å; R290-D409 IonicContact NH2-OD1 2.7Å; R290-D409 IonicContact NH2-OD2 2.72Å
410	S	86.4	Confident	92.1	Very high	79 Å²	79	33.9 Å²	33.9	55%	0.552	19%	0.188	S	C	*	.	S	Bend	trans	71	4	-173.6	94.1	0	0	0	0	120	A325	A325-S410 WeakPolarHBondContact O-CA 3.27Å; A325-S410 PolarHBondContact O-N 2.93Å
411	I	88.9	Confident	92	Very high	31 Å²	31	30.8 Å²	30.8	16%	0.159	17%	0.17	C	C	.	.			trans	-134.1	138.2	176.4	-55.4	179	0	0	0	110.5	S327 Q408 T435 Y437	S327-I411 PolarHBondContact OG-O 3.44Å; Q408-I411 HydrophobicContact CG-CB 3.83Å; Q408-I411 HydrophobicContact CG-CD1 4.09Å; Q408-I411 HydrophobicContact CG-CG1 4.06Å; I411-T435 HydrophobicContact CG2-CG2 4.04Å; I411-Y437 HydrophobicContact CG1-CE2 4.37Å; I411-Y437 HydrophobicContact CG2-CD2 4.18Å; I411-Y437 HydrophobicContact CG2-CE2 4.04Å
412	R	93.1	Very high	92	Very high	40 Å²	40	33.9 Å²	33.9	15%	0.151	18%	0.182	C	C	.	.			trans	-90.7	129.9	168.8	-56.6	-170.4	171.7	85	-0.2	112.7	T318 N320 V321 S323 A325 S327 T435 E436	T318-R412 HydrophobicContact CG2-CB 4.12Å; T318-R412 HydrophobicContact CG2-CG 4.39Å; N320-R412 PolarHBondContact O-NH2 2.74Å; V321-R412 PolarHBondContact O-NH2 2.99Å; S323-R412 PolarHBondContact O-NH2 2.87Å; S323-R412 VanDerWaalsContact O-NH2 3.09Å; A325-R412 HydrophobicContact CB-CG 4.19Å; S327-R412 VanDerWaalsContact OG-CA 3.23Å; S327-R412 WeakPolarHBondContact OG-CA 3.35Å; R412-T435 CarbonylContact O-C 3.59Å; R412-E436 WeakPolarHBondContact CA-OE1 3.19Å; R412-E436 HydrophobicContact CB-CB 4.45Å; R412-E436 VanDerWaalsContact CB-CD 3.48Å; R412-E436 HydrophobicContact CB-CG 4.33Å; R412-E436 VanDerWaalsContact CB-OE1 3.25Å; R412-E436 WeakPolarHBondContact CB-OE1 3.47Å; R412-E436 WeakPolarHBondContact CG-OE1 3.5Å; R412-E436 PolarHBondContact N-OE1 2.94Å; R412-E436 PolarHBondContact O-N 2.93Å
413	F	95.6	Very high	92	Very high	3 Å²	3	28.3 Å²	28.3	1%	0.013	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	143.6	170.7	-63	-16.5	0	0	0	110.6	V316 S327 V329 V406 Q408 I433 G434 L441 Y455	V316-F413 HydrophobicContact CG1-CB 3.37Å; V316-F413 HydrophobicContact CG1-CD2 4.33Å; V316-F413 HydrophobicContact CG1-CG 4.39Å; S327-F413 VanDerWaalsContact CB-CG 3.42Å; S327-F413 PolarHBondContact OG-N 3.2Å; V329-F413 HydrophobicContact CG2-CD2 4.06Å; V329-F413 HydrophobicContact CG2-CE2 4.06Å; V406-F413 HydrophobicContact CG1-CE2 4.08Å; V406-F413 HydrophobicContact CG1-CZ 4.09Å; Q408-F413 HydrophobicContact CB-CE1 3.64Å; Q408-F413 HydrophobicContact CB-CZ 3.52Å; Q408-F413 HydrophobicContact CG-CE1 4.33Å; F413-I433 HydrophobicContact CB-CG2 3.76Å; F413-I433 HydrophobicContact CD1-CG2 3.66Å; F413-I433 HydrophobicContact CD2-CG2 3.61Å; F413-I433 HydrophobicContact CE1-CG2 4.09Å; F413-I433 HydrophobicContact CE2-CD1 4.21Å; F413-I433 HydrophobicContact CE2-CG2 4.05Å; F413-I433 HydrophobicContact CG-CG2 3.39Å; F413-I433 HydrophobicContact CZ-CD1 4.48Å; F413-I433 HydrophobicContact CZ-CG2 4.26Å; F413-G434 CarbonylContact C-O 3.58Å; F413-G434 WeakPolarHBondContact CA-O 3.48Å; F413-L441 HydrophobicContact CD1-CD1 4.34Å; F413-L441 HydrophobicContact CE1-CD1 3.57Å; F413-L441 HydrophobicContact CZ-CD1 4.22Å; F413-Y455 HydrophobicContact CZ-CE1 4.39Å
414	S	93.9	Very high	91.8	Very high	21 Å²	21	29.5 Å²	29.5	15%	0.147	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	-43.2	-171.6	61.3	0	0	0	0	114	G434 T435	S414-G434 PolarHBondContact N-O 2.9Å; S414-G434 PolarHBondContact OG-O 3.01Å; S414-G434 VanDerWaalsContact OG-O 3.11Å; S414-T435 PolarHBondContact OG-O 3.16Å
415	K	95.6	Very high	91.4	Very high	63 Å²	63	35.6 Å²	35.6	27%	0.274	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	157.4	-177.3	-62	-64.1	167.7	-172.2	0	111.6	I433 G434 I470 K471 L473	K415-I433 CarbonylContact O-C 3.6Å; K415-I433 WeakPolarHBondContact O-CA 3.41Å; K415-G434 PolarHBondContact O-N 2.97Å; K415-I470 HydrophobicContact CG-CG2 4.18Å; K415-K471 WeakPolarHBondContact CE-O 3.33Å; K415-L473 HydrophobicContact CB-CB 3.72Å; K415-L473 HydrophobicContact CB-CD2 4.01Å; K415-L473 HydrophobicContact CG-CB 4.29Å
416	L	96.6	Very high	91.3	Very high	4 Å²	4	38.2 Å²	38.2	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	137.5	177.5	170.1	66	0	0	0	111.5	S303 V316 V329 V418 M431 Y432 I433	S303-L416 PolarHBondContact OG-N 3.45Å; V316-L416 HydrophobicContact CG2-CB 3.34Å; V316-L416 HydrophobicContact CG2-CD2 3.8Å; V316-L416 HydrophobicContact CG2-CG 4.19Å; V329-L416 HydrophobicContact CG1-CD2 3.68Å; L416-V418 HydrophobicContact CD1-CG2 4.05Å; L416-V418 HydrophobicContact CG-CG2 4.24Å; L416-M431 HydrophobicContact CD1-CB 3.84Å; L416-M431 HydrophobicContact CD1-CG 4.33Å; L416-Y432 WeakPolarHBondContact CA-O 3.24Å; L416-I433 HydrophobicContact CD1-CG1 3.84Å
417	V	97.1	Very high	91.3	Very high	2 Å²	2	43 Å²	43	1%	0.012	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	157.5	160.7	-62.1	0	0	0	0	109.9	F305 Y432 L473 I475 L482	F305-V417 HydrophobicContact CD2-CB 3.97Å; F305-V417 HydrophobicContact CD2-CG1 3.92Å; F305-V417 HydrophobicContact CE2-CB 3.91Å; F305-V417 HydrophobicContact CE2-CG1 4Å; V417-Y432 PolarHBondContact N-O 2.87Å; V417-Y432 VanDerWaalsContact N-O 3.13Å; V417-Y432 PolarHBondContact O-N 2.05Å; V417-L473 HydrophobicContact CG1-CB 4.48Å; V417-L473 HydrophobicContact CG1-CD2 4.44Å; V417-L473 HydrophobicContact CG1-CG 4.16Å; V417-L473 HydrophobicContact CG2-CD2 4.06Å; V417-L473 HydrophobicContact CG2-CG 4.1Å; V417-I475 HydrophobicContact CB-CB 4.07Å; V417-I475 HydrophobicContact CB-CG2 3.84Å; V417-I475 HydrophobicContact CG1-CB 4.48Å; V417-I475 HydrophobicContact CG1-CG2 4.21Å; V417-I475 HydrophobicContact CG2-CB 3.95Å; V417-I475 HydrophobicContact CG2-CG2 4.29Å; V417-L482 HydrophobicContact CG2-CD1 3.5Å; V417-L482 VanDerWaalsContact CG2-CD1 3.5Å
418	V	95.9	Very high	91.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	138.9	-176.4	-169.4	0	0	0	0	110.7	F305 Y314 L416 H429 V430 M431 H477	F305-V418 HydrophobicContact CD1-CB 3.77Å; F305-V418 HydrophobicContact CD1-CG2 3.83Å; F305-V418 HydrophobicContact CE1-CB 3.83Å; F305-V418 HydrophobicContact CE1-CG2 4.41Å; F305-V418 VanDerWaalsContact CE1-O 3.26Å; F305-V418 WeakPolarHBondContact CE1-O 3.36Å; F305-V418 HydrophobicContact CG-CG2 4.41Å; F305-V418 WeakPolarHBondContact CZ-O 3.4Å; Y314-V418 HydrophobicContact CD1-CG2 4.1Å; Y314-V418 HydrophobicContact CD2-CG2 4Å; Y314-V418 HydrophobicContact CE1-CG2 4.48Å; Y314-V418 HydrophobicContact CE2-CG1 4.33Å; Y314-V418 HydrophobicContact CE2-CG2 4.39Å; Y314-V418 HydrophobicContact CG-CG2 3.85Å; L416-V418 HydrophobicContact CD1-CG2 4.05Å; L416-V418 HydrophobicContact CG-CG2 4.24Å; V418-H429 HydrophobicContact CG1-CB 4.41Å; V418-V430 WeakPolarHBondContact CA-O 3.43Å; V418-M431 HydrophobicContact CG1-CG 4.25Å; V418-M431 HydrophobicContact CG2-CG 4.08Å; V418-H477 PolarHBondContact O-NE2 2.8Å
419	D	94.9	Very high	91.4	Very high	10 Å²	10	43.6 Å²	43.6	5%	0.053	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	155.4	172.4	-150.8	-21.8	0	0	0	111.2	V421 H429 V430 I475 H477 L495 Y514	D419-V421 HydrophobicContact CB-CG2 4.39Å; D419-H429 WeakPolarHBondContact O-CA 3.3Å; D419-V430 PolarHBondContact N-O 2.88Å; D419-V430 PolarHBondContact O-N 3.42Å; D419-I475 HydrophobicContact CB-CD1 3.67Å; D419-H477 IonicContact OD1-CD2 3.6Å; D419-H477 PolarHBondContact OD1-CD2 2.88Å; D419-H477 VanDerWaalsContact OD1-CD2 3.27Å; D419-L495 VanDerWaalsContact OD2-CD1 3.22Å; D419-L495 WeakPolarHBondContact OD2-CD1 3.16Å; D419-Y514 WeakPolarHBondContact CB-OH 3.41Å; D419-Y514 PolarHBondContact OD2-OH 2.86Å
420	I	92.8	Very high	91.9	Very high	46 Å²	46	40.1 Å²	40.1	24%	0.236	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	111.1	172.3	-53.8	173.8	0	0	0	107.9	L307 E309 L427	L307-I420 HydrophobicContact CD1-CD1 3.96Å; L307-I420 HydrophobicContact CD1-CG1 4.12Å; L307-I420 HydrophobicContact CD2-CD1 4.04Å; L307-I420 HydrophobicContact CD2-CG1 4.19Å; L307-I420 HydrophobicContact CG-CD1 4.25Å; E309-I420 HydrophobicContact CB-CD1 4.3Å; I420-L427 HydrophobicContact CG2-CB 4.33Å; I420-L427 HydrophobicContact CG2-CD2 4.05Å
421	V	91.7	Very high	92.4	Very high	10 Å²	10	36.3 Å²	36.3	6%	0.061	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130.2	-172	-169.7	0	0	0	0	110.5	D419 G423 L427 Y428 V430 P513 Y514	D419-V421 HydrophobicContact CB-CG2 4.39Å; V421-G423 PolarHBondContact O-N 3.07Å; V421-L427 CarbonylContact O-C 3.54Å; V421-L427 WeakPolarHBondContact O-CA 3.27Å; V421-Y428 PolarHBondContact N-O 2.94Å; V421-Y428 PolarHBondContact O-N 3.26Å; V421-V430 HydrophobicContact CB-CG2 4.41Å; V421-V430 HydrophobicContact CG2-CB 4.24Å; V421-V430 HydrophobicContact CG2-CG2 3.66Å; V421-P513 HydrophobicContact CB-CB 4.11Å; V421-P513 HydrophobicContact CG1-CB 3.98Å; V421-Y514 HydrophobicContact CG1-CD1 3.87Å; V421-Y514 HydrophobicContact CG1-CD2 4.2Å; V421-Y514 HydrophobicContact CG1-CE1 4.11Å; V421-Y514 HydrophobicContact CG1-CE2 4.42Å; V421-Y514 HydrophobicContact CG1-CG 3.94Å; V421-Y514 HydrophobicContact CG2-CD1 4.31Å; V421-Y514 HydrophobicContact CG2-CD2 4.2Å; V421-Y514 HydrophobicContact CG2-CE1 3.73Å; V421-Y514 HydrophobicContact CG2-CE2 3.61Å
422	Q	89.9	Confident	92.8	Very high	93 Å²	93	34.9 Å²	34.9	44%	0.435	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	105.4	171.5	-178.6	61.5	61.3	0	0	110	L427 I527	Q422-L427 HydrophobicContact CB-CD2 4.17Å; Q422-L427 VanDerWaalsContact OE1-CD2 3.24Å; Q422-I527 HydrophobicContact CG-CD1 4.46Å
423	G	87.6	Confident	92.9	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.167	C	C	.	.			trans	-80.3	-170.6	166.7	0	0	0	0	0	111.6	V421 D425 T426 Q538	V421-G423 PolarHBondContact O-N 3.07Å; G423-D425 PolarHBondContact O-N 3.47Å; G423-T426 PolarHBondContact N-O 2.88Å; G423-Q538 VanDerWaalsContact CA-OE1 3.24Å
424	K	86.6	Confident	93	Very high	65 Å²	65	32.9 Å²	32.9	28%	0.283	17%	0.166	S	C	.	.	S	Bend	trans	-58.4	-49.3	-178.5	-171.3	172	179.7	165.1	0	113.3	W536 Q538	K424-W536 HydrophobicContact CB-CE3 4.11Å; K424-W536 HydrophobicContact CB-CZ3 3.83Å; K424-W536 HydrophobicContact CD-CE3 4.47Å; K424-W536 WeakPolarHBondContact CE-O 3.47Å; K424-W536 HydrophobicContact CG-CE3 4.31Å; K424-W536 HydrophobicContact CG-CZ3 4.5Å; K424-W536 PolarHBondContact NZ-O 3.47Å; K424-Q538 HydrophobicContact CB-CB 4.33Å
425	D	85.1	Confident	92.9	Very high	129 Å²	129	31.9 Å²	31.9	69%	0.69	16%	0.159	S	C	*	.	S	Bend	trans	-116.5	-20.6	-168.4	-51	-71.7	0	0	0	113	G423	G423-D425 PolarHBondContact O-N 3.47Å
426	T	89.5	Confident	92.6	Very high	69 Å²	69	31.6 Å²	31.6	42%	0.423	16%	0.159	S	C	.	.	S	Bend	trans	-147.1	158.3	-175.6	57.1	0	0	0	0	112.9	G423 Y428	G423-T426 PolarHBondContact N-O 2.88Å; T426-Y428 WeakPolarHBondContact O-CD2 3.07Å; T426-Y428 VanDerWaalsContact OG1-CE2 3.28Å; T426-Y428 WeakPolarHBondContact OG1-CE2 3.09Å; T426-Y428 VanDerWaalsContact OG1-CZ 3.27Å; T426-Y428 PolarHBondContact OG1-OH 2.8Å
427	L	90.8	Very high	92.3	Very high	101 Å²	101	35.9 Å²	35.9	53%	0.529	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	143	164.1	-65.2	167.5	0	0	0	110.8	I420 V421 Q422	I420-L427 HydrophobicContact CG2-CB 4.33Å; I420-L427 HydrophobicContact CG2-CD2 4.05Å; V421-L427 CarbonylContact O-C 3.54Å; V421-L427 WeakPolarHBondContact O-CA 3.27Å; Q422-L427 HydrophobicContact CB-CD2 4.17Å; Q422-L427 VanDerWaalsContact OE1-CD2 3.24Å
428	Y	90.9	Very high	91.9	Very high	49 Å²	49	35.9 Å²	35.9	19%	0.192	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	137.1	178.1	-70.7	-80.6	0	0	0	110.8	V421 T426 L444 P513 I540	V421-Y428 PolarHBondContact N-O 2.94Å; V421-Y428 PolarHBondContact O-N 3.26Å; T426-Y428 WeakPolarHBondContact O-CD2 3.07Å; T426-Y428 VanDerWaalsContact OG1-CE2 3.28Å; T426-Y428 WeakPolarHBondContact OG1-CE2 3.09Å; T426-Y428 VanDerWaalsContact OG1-CZ 3.27Å; T426-Y428 PolarHBondContact OG1-OH 2.8Å; Y428-L444 HydrophobicContact CD1-CD1 3.95Å; Y428-L444 HydrophobicContact CD1-CD2 4.33Å; Y428-L444 HydrophobicContact CG-CD1 4.39Å; Y428-P513 HydrophobicContact CD2-CB 4.16Å; Y428-P513 HydrophobicContact CG-CB 4.2Å; Y428-P513 HydrophobicContact CG-CG 4.19Å; Y428-I540 HydrophobicContact CD2-CD1 4.2Å; Y428-I540 HydrophobicContact CE1-CB 4.44Å; Y428-I540 HydrophobicContact CE1-CD1 4.45Å; Y428-I540 HydrophobicContact CE1-CG2 4.45Å; Y428-I540 HydrophobicContact CE2-CD1 3.79Å
429	H	92.6	Very high	91.8	Very high	27 Å²	27	36.8 Å²	36.8	13%	0.125	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	118.9	174.9	-73.5	-156.1	0	0	0	109.4	Q310 Y314 V418 D419 S445	Q310-H429 PolarHBondContact NE2-CE1 2.8Å; Q310-H429 VanDerWaalsContact NE2-CE1 3.3Å; Q310-H429 PolarHBondContact NE2-NE2 3.1Å; Q310-H429 PolarHBondContact OE1-CE1 2.62Å; Y314-H429 AromaticContact CZ-ND1 3.98Å; Y314-H429 PolarHBondContact OH-ND1 3.17Å; V418-H429 HydrophobicContact CG1-CB 4.41Å; D419-H429 WeakPolarHBondContact O-CA 3.3Å; H429-S445 PolarHBondContact O-N 2.92Å
430	V	94.4	Very high	91.9	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	120.6	-179.3	-174.3	0	0	0	0	109.8	V418 D419 V421 Y432 K442 L456 P513 Y514	V418-V430 WeakPolarHBondContact CA-O 3.43Å; D419-V430 PolarHBondContact N-O 2.88Å; D419-V430 PolarHBondContact O-N 3.42Å; V421-V430 HydrophobicContact CB-CG2 4.41Å; V421-V430 HydrophobicContact CG2-CB 4.24Å; V421-V430 HydrophobicContact CG2-CG2 3.66Å; V430-Y432 HydrophobicContact CB-CE2 4.14Å; V430-Y432 HydrophobicContact CG1-CD2 4.38Å; V430-Y432 HydrophobicContact CG1-CE2 3.6Å; V430-K442 HydrophobicContact CG1-CD 4.33Å; V430-K442 HydrophobicContact CG1-CG 3.64Å; V430-L456 HydrophobicContact CG1-CD1 4.47Å; V430-P513 HydrophobicContact CG2-CB 4.13Å; V430-P513 HydrophobicContact CG2-CG 3.82Å; V430-Y514 HydrophobicContact CB-CE2 4.37Å; V430-Y514 HydrophobicContact CG1-CE2 4.31Å; V430-Y514 HydrophobicContact CG2-CE2 4.17Å
431	M	96.2	Very high	92	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	133.6	-178.9	-59.7	-172.3	-67.5	0	0	110.2	Y314 V329 V406 L416 V418 I433 K442 A443	Y314-M431 HydrophobicContact CD1-SD 3.9Å; Y314-M431 HydrophobicContact CE1-CG 4.44Å; Y314-M431 HydrophobicContact CE1-SD 3.77Å; V329-M431 HydrophobicContact CB-SD 4.35Å; V329-M431 HydrophobicContact CG1-CE 4.49Å; V329-M431 HydrophobicContact CG1-SD 3.66Å; V406-M431 HydrophobicContact CB-CE 4.12Å; V406-M431 HydrophobicContact CG2-CE 3.37Å; L416-M431 HydrophobicContact CD1-CB 3.84Å; L416-M431 HydrophobicContact CD1-CG 4.33Å; V418-M431 HydrophobicContact CG1-CG 4.25Å; V418-M431 HydrophobicContact CG2-CG 4.08Å; M431-I433 HydrophobicContact CB-CD1 4.46Å; M431-I433 HydrophobicContact CB-CG1 4.34Å; M431-K442 CarbonylContact O-C 3.58Å; M431-K442 WeakPolarHBondContact O-CA 3.31Å; M431-A443 PolarHBondContact N-O 3.41Å; M431-A443 PolarHBondContact O-N 2.88Å
432	Y	97.1	Very high	92.2	Very high	1 Å²	1	33.7 Å²	33.7	0%	0.004	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	107.7	173.9	-64.8	-96.1	0	0	0	108.3	L416 V417 V430 I440 K442 M459 L473 L482 L495 Y514	L416-Y432 WeakPolarHBondContact CA-O 3.24Å; V417-Y432 PolarHBondContact N-O 2.87Å; V417-Y432 VanDerWaalsContact N-O 3.13Å; V417-Y432 PolarHBondContact O-N 2.05Å; V430-Y432 HydrophobicContact CB-CE2 4.14Å; V430-Y432 HydrophobicContact CG1-CD2 4.38Å; V430-Y432 HydrophobicContact CG1-CE2 3.6Å; Y432-I440 HydrophobicContact CD1-CG2 4.46Å; Y432-K442 HydrophobicContact CD1-CB 4.34Å; Y432-K442 HydrophobicContact CD1-CG 4.23Å; Y432-K442 HydrophobicContact CE1-CB 4.16Å; Y432-K442 HydrophobicContact CE1-CD 3.74Å; Y432-K442 HydrophobicContact CE1-CG 3.67Å; Y432-K442 WeakPolarHBondContact OH-CE 3.33Å; Y432-M459 HydrophobicContact CD1-CE 4.1Å; Y432-M459 HydrophobicContact CE1-CE 4.25Å; Y432-L473 WeakPolarHBondContact O-CD2 3.46Å; Y432-L482 HydrophobicContact CD1-CD2 4.1Å; Y432-L482 HydrophobicContact CG-CD1 4.41Å; Y432-L482 HydrophobicContact CG-CD2 4.48Å; Y432-L495 HydrophobicContact CD1-CD2 4.13Å; Y432-L495 HydrophobicContact CD2-CD2 4.2Å; Y432-L495 HydrophobicContact CE1-CD2 3.65Å; Y432-L495 HydrophobicContact CE2-CD2 3.77Å; Y432-L495 HydrophobicContact CG-CD2 4.38Å; Y432-L495 VanDerWaalsContact CZ-CD2 3.47Å; Y432-L495 PolarHBondContact OH-O 2.87Å; Y432-Y514 WeakPolarHBondContact OH-CE2 2.92Å; Y432-Y514 PolarHBondContact OH-OH 3.19Å; Y432-Y514 VanDerWaalsContact OH-OH 3.05Å
433	I	97	Very high	92.4	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	115.7	-170.1	-57.1	160.1	0	0	0	108.8	V329 V406 F413 K415 L416 M431 I440 L441 A443	V329-I433 HydrophobicContact CG2-CD1 3.84Å; V329-I433 HydrophobicContact CG2-CG1 4.27Å; V406-I433 HydrophobicContact CG1-CD1 4.09Å; F413-I433 HydrophobicContact CB-CG2 3.76Å; F413-I433 HydrophobicContact CD1-CG2 3.66Å; F413-I433 HydrophobicContact CD2-CG2 3.61Å; F413-I433 HydrophobicContact CE1-CG2 4.09Å; F413-I433 HydrophobicContact CE2-CD1 4.21Å; F413-I433 HydrophobicContact CE2-CG2 4.05Å; F413-I433 HydrophobicContact CG-CG2 3.39Å; F413-I433 HydrophobicContact CZ-CD1 4.48Å; F413-I433 HydrophobicContact CZ-CG2 4.26Å; K415-I433 CarbonylContact O-C 3.6Å; K415-I433 WeakPolarHBondContact O-CA 3.41Å; L416-I433 HydrophobicContact CD1-CG1 3.84Å; M431-I433 HydrophobicContact CB-CD1 4.46Å; M431-I433 HydrophobicContact CB-CG1 4.34Å; I433-I440 CarbonylContact O-C 3.52Å; I433-I440 WeakPolarHBondContact O-CA 3.28Å; I433-L441 HydrophobicContact CB-CB 4.31Å; I433-L441 PolarHBondContact N-O 2.03Å; I433-L441 PolarHBondContact O-N 3.2Å; I433-A443 HydrophobicContact CD1-CB 4.3Å
434	G	96.2	Very high	92.5	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	144	170.2	0	0	0	0	0	111.5	F413 S414 K415	F413-G434 CarbonylContact C-O 3.58Å; F413-G434 WeakPolarHBondContact CA-O 3.48Å; S414-G434 PolarHBondContact N-O 2.9Å; S414-G434 PolarHBondContact OG-O 3.01Å; S414-G434 VanDerWaalsContact OG-O 3.11Å; K415-G434 PolarHBondContact O-N 2.97Å
435	T	93.5	Very high	92.6	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	173.3	174	65.6	0	0	0	0	112.2	I411 R412 S414 Y437 G438 T439 L441	I411-T435 HydrophobicContact CG2-CG2 4.04Å; R412-T435 CarbonylContact O-C 3.59Å; S414-T435 PolarHBondContact OG-O 3.16Å; T435-Y437 VanDerWaalsContact C-N 3.29Å; T435-Y437 PolarHBondContact OG1-N 3.38Å; T435-G438 PolarHBondContact OG1-N 2.88Å; T435-T439 VanDerWaalsContact CG2-OG1 3.25Å; T435-T439 WeakPolarHBondContact CG2-OG1 3.2Å; T435-T439 PolarHBondContact N-O 2.84Å; T435-T439 PolarHBondContact OG1-N 2.87Å; T435-T439 PolarHBondContact OG1-O 3.15Å; T435-T439 PolarHBondContact OG1-OG1 3.37Å; T435-L441 HydrophobicContact CG2-CD1 3.84Å; T435-L441 HydrophobicContact CG2-CG 4.16Å
436	E	89.1	Confident	92.4	Very high	57 Å²	57	22.1 Å²	22.1	27%	0.266	11%	0.111	S	C	.	.	S	Bend	trans	-70.9	-22.9	169.9	70	-165.7	135.8	0	0	113.2	R412	R412-E436 WeakPolarHBondContact CA-OE1 3.19Å; R412-E436 HydrophobicContact CB-CB 4.45Å; R412-E436 VanDerWaalsContact CB-CD 3.48Å; R412-E436 HydrophobicContact CB-CG 4.33Å; R412-E436 VanDerWaalsContact CB-OE1 3.25Å; R412-E436 WeakPolarHBondContact CB-OE1 3.47Å; R412-E436 WeakPolarHBondContact CG-OE1 3.5Å; R412-E436 PolarHBondContact N-OE1 2.94Å; R412-E436 PolarHBondContact O-N 2.93Å
437	Y	88.6	Confident	91.6	Very high	95 Å²	95	24 Å²	24	37%	0.373	12%	0.122	S	C	.	.	S	Bend	trans	-87.5	-9.1	-178.1	-56.6	-63.4	0	0	0	114.6	I411 T435 Q467	I411-Y437 HydrophobicContact CG1-CE2 4.37Å; I411-Y437 HydrophobicContact CG2-CD2 4.18Å; I411-Y437 HydrophobicContact CG2-CE2 4.04Å; T435-Y437 VanDerWaalsContact C-N 3.29Å; T435-Y437 PolarHBondContact OG1-N 3.38Å; Y437-Q467 WeakPolarHBondContact O-CA 3.22Å; Y437-Q467 WeakPolarHBondContact O-CB 3.34Å
438	G	90.6	Very high	91.1	Very high	2 Å²	2	22.6 Å²	22.6	2%	0.021	12%	0.116	C	C	.	.	S	Bend	trans	90.4	27.5	-177.2	0	0	0	0	0	114.8	T435 I461 E468	T435-G438 PolarHBondContact OG1-N 2.88Å; G438-I461 WeakPolarHBondContact O-CG1 3.46Å; G438-E468 WeakPolarHBondContact CA-O 3.39Å
439	T	93.8	Very high	90.2	Very high	19 Å²	19	31.4 Å²	31.4	12%	0.117	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	159.3	166.8	62.9	0	0	0	0	111.1	T435 E458 M459 Q460 I470	T435-T439 VanDerWaalsContact CG2-OG1 3.25Å; T435-T439 WeakPolarHBondContact CG2-OG1 3.2Å; T435-T439 PolarHBondContact N-O 2.84Å; T435-T439 PolarHBondContact OG1-N 2.87Å; T435-T439 PolarHBondContact OG1-O 3.15Å; T435-T439 PolarHBondContact OG1-OG1 3.37Å; T439-E458 WeakPolarHBondContact CB-OE1 3.43Å; T439-E458 HydrophobicContact CG2-CG 4.46Å; T439-E458 WeakPolarHBondContact CG2-OE1 3.16Å; T439-E458 PolarHBondContact OG1-OE1 3.05Å; T439-M459 WeakPolarHBondContact CA-O 3.4Å; T439-Q460 HydrophobicContact CG2-CG 4.17Å; T439-I470 WeakPolarHBondContact O-CD1 3.42Å
440	I	96.1	Very high	89.2	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	117.5	174.4	-58.6	-178.1	0	0	0	109.6	Y432 I433 M459 I461 I470 L473 L482 V484 I493	Y432-I440 HydrophobicContact CD1-CG2 4.46Å; I433-I440 CarbonylContact O-C 3.52Å; I433-I440 WeakPolarHBondContact O-CA 3.28Å; I440-M459 HydrophobicContact CB-CB 4.42Å; I440-M459 HydrophobicContact CB-CE 4.15Å; I440-M459 HydrophobicContact CG2-CE 3.8Å; I440-M459 PolarHBondContact N-O 3.21Å; I440-M459 PolarHBondContact O-N 3.24Å; I440-I461 HydrophobicContact CD1-CD1 4.02Å; I440-I461 HydrophobicContact CD1-CG2 4.26Å; I440-I461 HydrophobicContact CG1-CD1 4.19Å; I440-I461 HydrophobicContact CG1-CG2 4.45Å; I440-I470 HydrophobicContact CD1-CD1 4.15Å; I440-I470 HydrophobicContact CG1-CD1 3.58Å; I440-L473 HydrophobicContact CD1-CD1 4.07Å; I440-L482 HydrophobicContact CD1-CD2 3.81Å; I440-L482 HydrophobicContact CG2-CD2 4.21Å; I440-V484 HydrophobicContact CD1-CG1 4.22Å; I440-V484 HydrophobicContact CD1-CG2 3.67Å; I440-I493 HydrophobicContact CD1-CD1 4.49Å
441	L	94.8	Very high	88.2	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	120.7	175.2	-62	165.6	0	0	0	109.3	F413 I433 T435 Y455 E458	F413-L441 HydrophobicContact CD1-CD1 4.34Å; F413-L441 HydrophobicContact CE1-CD1 3.57Å; F413-L441 HydrophobicContact CZ-CD1 4.22Å; I433-L441 HydrophobicContact CB-CB 4.31Å; I433-L441 PolarHBondContact N-O 2.03Å; I433-L441 PolarHBondContact O-N 3.2Å; T435-L441 HydrophobicContact CG2-CD1 3.84Å; T435-L441 HydrophobicContact CG2-CG 4.16Å; L441-Y455 HydrophobicContact CB-CD1 4.13Å; L441-Y455 HydrophobicContact CB-CE1 4.42Å; L441-Y455 HydrophobicContact CD1-CD1 4.38Å; L441-Y455 HydrophobicContact CD1-CE1 3.99Å; L441-Y455 HydrophobicContact CD2-CD1 4.29Å; L441-E458 HydrophobicContact CD2-CB 3.73Å; L441-E458 HydrophobicContact CD2-CG 3.69Å
442	K	95.1	Very high	87.4	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	124.4	168.6	-173.1	177.7	174.8	175.3	0	107.7	V430 M431 Y432 L456 E457 M459 L495 D512	V430-K442 HydrophobicContact CG1-CD 4.33Å; V430-K442 HydrophobicContact CG1-CG 3.64Å; M431-K442 CarbonylContact O-C 3.58Å; M431-K442 WeakPolarHBondContact O-CA 3.31Å; Y432-K442 HydrophobicContact CD1-CB 4.34Å; Y432-K442 HydrophobicContact CD1-CG 4.23Å; Y432-K442 HydrophobicContact CE1-CB 4.16Å; Y432-K442 HydrophobicContact CE1-CD 3.74Å; Y432-K442 HydrophobicContact CE1-CG 3.67Å; Y432-K442 WeakPolarHBondContact OH-CE 3.33Å; K442-L456 HydrophobicContact CG-CB 4.34Å; K442-L456 HydrophobicContact CG-CD1 4.28Å; K442-L456 PolarHBondContact O-N 3.45Å; K442-E457 HydrophobicContact CB-CG 3.52Å; K442-E457 HydrophobicContact CD-CG 3.78Å; K442-E457 WeakPolarHBondContact CD-OE1 3.35Å; K442-E457 HydrophobicContact CG-CG 4.23Å; K442-E457 PolarHBondContact N-O 3.13Å; K442-E457 PolarHBondContact O-N 2.84Å; K442-M459 HydrophobicContact CB-CE 4.37Å; K442-L495 PolarHBondContact NZ-O 3.43Å; K442-D512 WeakPolarHBondContact CE-OD1 3.44Å; K442-D512 IonicContact NZ-OD1 2.77Å; K442-D512 PolarHBondContact NZ-OD1 2.96Å; K442-D512 IonicContact NZ-OD2 3.71Å; K442-D512 PolarHBondContact NZ-OD2 3.11Å
443	A	94	Very high	86.6	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	152.1	-174.3	0	0	0	0	0	112.7	V406 M431 I433 C454 Y455	V406-A443 HydrophobicContact CG2-CB 3.84Å; M431-A443 PolarHBondContact N-O 3.41Å; M431-A443 PolarHBondContact O-N 2.88Å; I433-A443 HydrophobicContact CD1-CB 4.3Å; A443-C454 WeakPolarHBondContact CA-O 3.36Å; A443-Y455 HydrophobicContact CB-CD1 3.98Å
444	L	91.5	Very high	86.1	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	125.9	178.8	-159.4	70.5	0	0	0	110.8	Y428 T446 L451 C454 P513 I540	Y428-L444 HydrophobicContact CD1-CD1 3.95Å; Y428-L444 HydrophobicContact CD1-CD2 4.33Å; Y428-L444 HydrophobicContact CG-CD1 4.39Å; L444-T446 HydrophobicContact CD2-CG2 4.04Å; L444-T446 HydrophobicContact CG-CG2 4.32Å; L444-L451 HydrophobicContact CD2-CD1 4.38Å; L444-C454 HydrophobicContact CB-CB 4.35Å; L444-C454 PolarHBondContact N-O 2.89Å; L444-P513 HydrophobicContact CD1-CG 3.75Å; L444-I540 HydrophobicContact CD2-CG2 4.21Å
445	S	87.9	Confident	85.8	Confident	12 Å²	12	40.8 Å²	40.8	8%	0.084	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	109.5	165.4	178.7	0	0	0	0	108.4	Y314 Y405 H429	Y314-S445 WeakPolarHBondContact CE1-OG 3.25Å; Y314-S445 PolarHBondContact OH-OG 3.29Å; Y405-S445 WeakPolarHBondContact CD1-OG 3.45Å; Y405-S445 WeakPolarHBondContact CE1-OG 3.02Å; H429-S445 PolarHBondContact O-N 2.92Å
446	T	81.8	Confident	85.7	Confident	30 Å²	30	41 Å²	41	18%	0.184	20%	0.202	C	C	.	.			trans	-148.3	149.5	-178	-179	0	0	0	0	111.3	Y405 L444 N448 L451	Y405-T446 WeakPolarHBondContact CD1-O 3.4Å; L444-T446 HydrophobicContact CD2-CG2 4.04Å; L444-T446 HydrophobicContact CG-CG2 4.32Å; T446-N448 PolarHBondContact OG1-N 3.12Å; T446-L451 HydrophobicContact CG2-CB 3.55Å; T446-L451 WeakPolarHBondContact CG2-O 3.05Å
447	T	72.6	Confident	85.8	Confident	108 Å²	108	38.5 Å²	38.5	66%	0.663	19%	0.191	S	C	*	.			trans	-87.3	-10	175.8	55	0	0	0	0	112.7	T401 Y405 R449	T401-T447 HydrophobicContact CG2-CG2 3.93Å; Y405-T447 HydrophobicContact CE1-CG2 4.4Å; T447-R449 PolarHBondContact O-N 3.22Å
448	N	79.3	Confident	86	Confident	73 Å²	73	35.2 Å²	35.2	39%	0.39	18%	0.179	S	C	.	.			trans	-71.3	122.2	-179.8	-177.6	2.3	0	0	0	111.1	T446 S450 L451 R452	T446-N448 PolarHBondContact OG1-N 3.12Å; N448-S450 PolarHBondContact ND2-OG 3.18Å; N448-S450 PolarHBondContact O-N 3.05Å; N448-S450 PolarHBondContact OD1-N 2.85Å; N448-S450 VanDerWaalsContact OD1-N 3.15Å; N448-S450 PolarHBondContact OD1-OG 3.26Å; N448-L451 HydrophobicContact CB-CB 4.46Å; N448-L451 CarbonylContact O-C 3.48Å; N448-L451 PolarHBondContact O-N 3.26Å; N448-R452 PolarHBondContact O-N 2.69Å
449	R	73	Confident	86.1	Confident	233 Å²	233	35.2 Å²	35.2	88%	0.879	18%	0.178	S	C	*	.	G	3₁₀ helix	trans	-58.3	-28.6	-179.1	-64.7	-176.6	178.5	-170.8	-1	113.8	T447 L451	T447-R449 PolarHBondContact O-N 3.22Å; R449-L451 VanDerWaalsContact C-N 3.32Å
450	S	70.2	Confident	86.1	Confident	79 Å²	79	37.2 Å²	37.2	55%	0.552	19%	0.186	S	C	*	.	G	3₁₀ helix	trans	-77.2	-16.9	177.7	67.2	0	0	0	0	114.1	N448	N448-S450 PolarHBondContact ND2-OG 3.18Å; N448-S450 PolarHBondContact O-N 3.05Å; N448-S450 PolarHBondContact OD1-N 2.85Å; N448-S450 VanDerWaalsContact OD1-N 3.15Å; N448-S450 PolarHBondContact OD1-OG 3.26Å
451	L	74.9	Confident	86	Confident	9 Å²	9	37.4 Å²	37.4	5%	0.047	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-118.4	22	-176.9	-66.7	171.6	0	0	0	111.8	L444 T446 N448 R449 C454 I540 E542	L444-L451 HydrophobicContact CD2-CD1 4.38Å; T446-L451 HydrophobicContact CG2-CB 3.55Å; T446-L451 WeakPolarHBondContact CG2-O 3.05Å; N448-L451 HydrophobicContact CB-CB 4.46Å; N448-L451 CarbonylContact O-C 3.48Å; N448-L451 PolarHBondContact O-N 3.26Å; R449-L451 VanDerWaalsContact C-N 3.32Å; L451-C454 HydrophobicContact CB-CB 4.49Å; L451-C454 WeakPolarHBondContact O-CB 3.4Å; L451-I540 WeakPolarHBondContact CD1-O 3.33Å; L451-E542 VanDerWaalsContact CD2-C 3.43Å
452	R	77.6	Confident	85.7	Confident	80 Å²	80	38.1 Å²	38.1	30%	0.302	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	141.2	178.8	-172.3	175	169.8	-146.5	-8.5	110.8	D403 P404 N448 C454	D403-R452 VanDerWaalsContact C-NH2 3.32Å; D403-R452 VanDerWaalsContact CB-NH2 3.35Å; D403-R452 IonicContact OD1-CZ 3.43Å; D403-R452 IonicContact OD1-NH1 2.75Å; D403-R452 PolarHBondContact OD1-NH1 3.33Å; D403-R452 IonicContact OD1-NH2 2.89Å; D403-R452 PolarHBondContact OD1-NH2 3.39Å; D403-R452 IonicContact OD2-CZ 3.84Å; D403-R452 IonicContact OD2-NH1 3.75Å; D403-R452 PolarHBondContact OD2-NH1 2.87Å; D403-R452 IonicContact OD2-NH2 3.84Å; P404-R452 VanDerWaalsContact CD-NH2 3.31Å; P404-R452 VanDerWaalsContact N-NH2 3.16Å; P404-R452 PolarHBondContact O-NE 3.07Å; P404-R452 PolarHBondContact O-NH2 2.89Å; N448-R452 PolarHBondContact O-N 2.69Å; R452-C454 PolarHBondContact O-N 3.42Å
453	S	81.1	Confident	85.4	Confident	32 Å²	32	40.4 Å²	40.4	22%	0.224	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	54	35.5	-169	-60.5	0	0	0	0	113.1	Y405 T407 Y455	Y405-S453 PolarHBondContact O-N 3.49Å; T407-S453 PolarHBondContact N-OG 3.24Å; T407-S453 PolarHBondContact OG1-OG 3.33Å; S453-Y455 WeakPolarHBondContact O-CD2 3.44Å; S453-Y455 WeakPolarHBondContact O-CE2 3.25Å; S453-Y455 PolarHBondContact O-N 2.83Å
454	C	86.6	Confident	84.7	Confident	3 Å²	3	47.3 Å²	47.3	2%	0.02	24%	0.243	C	C	.	.			trans	-84.1	96.9	-177.7	-161.9	0	0	0	0	111.1	A443 L444 L451 R452 C543	A443-C454 WeakPolarHBondContact CA-O 3.36Å; L444-C454 HydrophobicContact CB-CB 4.35Å; L444-C454 PolarHBondContact N-O 2.89Å; L451-C454 HydrophobicContact CB-CB 4.49Å; L451-C454 WeakPolarHBondContact O-CB 3.4Å; R452-C454 PolarHBondContact O-N 3.42Å; C454-C543 VanDerWaalsContact CA-SG 3.57Å; C454-C543 HydrophobicContact CB-CB 4.32Å; C454-C543 WeakPolarHBondContact CB-SG 3.46Å; C454-C543 WeakPolarHBondContact SG-CA 3.09Å; C454-C543 WeakPolarHBondContact SG-CB 3.41Å; C454-C543 CovalentContact SG-SG 2.03Å; C454-C543 PolarHBondContact SG-SG 3.41Å
455	Y	90.1	Very high	84.2	Confident	23 Å²	23	51.4 Å²	51.4	9%	0.09	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	131.2	168.8	-51.7	-82.5	0	0	0	109.6	H45 V406 T407 Q408 F413 L441 A443 S453 P544	H45-Y455 VanDerWaalsContact CD2-CB 3.47Å; H45-Y455 WeakPolarHBondContact CD2-CB 3.33Å; H45-Y455 AromaticContact CD2-CD2 3.97Å; H45-Y455 AromaticContact CD2-CG 3.7Å; V406-Y455 HydrophobicContact CG1-CD1 4.46Å; V406-Y455 HydrophobicContact CG1-CE1 3.49Å; V406-Y455 VanDerWaalsContact CG1-CE1 3.49Å; V406-Y455 VanDerWaalsContact CG1-OH 3.27Å; V406-Y455 WeakPolarHBondContact CG1-OH 3.28Å; T407-Y455 VanDerWaalsContact C-OH 3.31Å; T407-Y455 PolarHBondContact O-OH 2.85Å; Q408-Y455 WeakPolarHBondContact CB-OH 3.5Å; F413-Y455 HydrophobicContact CZ-CE1 4.39Å; L441-Y455 HydrophobicContact CB-CD1 4.13Å; L441-Y455 HydrophobicContact CB-CE1 4.42Å; L441-Y455 HydrophobicContact CD1-CD1 4.38Å; L441-Y455 HydrophobicContact CD1-CE1 3.99Å; L441-Y455 HydrophobicContact CD2-CD1 4.29Å; A443-Y455 HydrophobicContact CB-CD1 3.98Å; S453-Y455 WeakPolarHBondContact O-CD2 3.44Å; S453-Y455 WeakPolarHBondContact O-CE2 3.25Å; S453-Y455 PolarHBondContact O-N 2.83Å; Y455-P544 WeakPolarHBondContact O-CG 3.45Å
456	L	91.3	Very high	84	Confident	5 Å²	5	56.2 Å²	56.2	3%	0.026	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-42.1	177.5	-61.9	175.6	0	0	0	110.9	P46 V430 K442 R511 P513 P544	P46-L456 WeakPolarHBondContact CD-O 3.41Å; P46-L456 WeakPolarHBondContact CG-O 3.36Å; V430-L456 HydrophobicContact CG1-CD1 4.47Å; K442-L456 HydrophobicContact CG-CB 4.34Å; K442-L456 HydrophobicContact CG-CD1 4.28Å; K442-L456 PolarHBondContact O-N 3.45Å; L456-R511 HydrophobicContact CD2-CB 4.3Å; L456-P513 VanDerWaalsContact CD1-CD 3.49Å; L456-P513 HydrophobicContact CD1-CG 4.3Å; L456-P544 WeakPolarHBondContact O-CG 3.45Å
457	E	91.1	Very high	84.3	Confident	4 Å²	4	61.6 Å²	61.6	2%	0.019	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	154.1	178	52.8	174.8	-163.7	0	0	111	P46 I48 K442 R497	P46-E457 CarbonylContact O-C 3.55Å; P46-E457 WeakPolarHBondContact O-CA 3.38Å; I48-E457 WeakPolarHBondContact CD1-OE2 3.26Å; K442-E457 HydrophobicContact CB-CG 3.52Å; K442-E457 HydrophobicContact CD-CG 3.78Å; K442-E457 WeakPolarHBondContact CD-OE1 3.35Å; K442-E457 HydrophobicContact CG-CG 4.23Å; K442-E457 PolarHBondContact N-O 3.13Å; K442-E457 PolarHBondContact O-N 2.84Å; E457-R497 IonicContact OE1-CZ 2.76Å; E457-R497 IonicContact OE1-NH1 2.75Å; E457-R497 IonicContact OE1-NH2 2.8Å; E457-R497 PolarHBondContact OE1-NH2 2.85Å; E457-R497 IonicContact OE2-CZ 3.47Å; E457-R497 IonicContact OE2-NH2 2.72Å; E457-R497 PolarHBondContact OE2-NH2 2.83Å
458	E	92.7	Very high	85	Confident	26 Å²	26	57.8 Å²	57.8	12%	0.121	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	125.8	160.8	-176.3	169.5	-151.3	0	0	109.9	H45 P46 T47 I48 T439 L441	H45-E458 IonicContact CE1-OE2 2.66Å; H45-E458 PolarHBondContact CE1-OE2 3.43Å; H45-E458 IonicContact NE2-OE2 3.11Å; P46-E458 PolarHBondContact O-N 2.82Å; T47-E458 CarbonylContact C-O 3.59Å; T47-E458 HydrophobicContact CG2-CB 4.13Å; I48-E458 PolarHBondContact N-O 2.8Å; T439-E458 WeakPolarHBondContact CB-OE1 3.43Å; T439-E458 HydrophobicContact CG2-CG 4.46Å; T439-E458 WeakPolarHBondContact CG2-OE1 3.16Å; T439-E458 PolarHBondContact OG1-OE1 3.05Å; L441-E458 HydrophobicContact CD2-CB 3.73Å; L441-E458 HydrophobicContact CD2-CG 3.69Å
459	M	93.6	Very high	85.6	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	119.2	175.1	-70.4	173.5	-84.4	0	0	110.7	L53 Y432 T439 I440 K442 I461 I493 R497	L53-M459 HydrophobicContact CD1-CG 4.25Å; L53-M459 HydrophobicContact CD1-SD 4.29Å; L53-M459 HydrophobicContact CD2-CB 4.05Å; L53-M459 HydrophobicContact CD2-CG 4.4Å; Y432-M459 HydrophobicContact CD1-CE 4.1Å; Y432-M459 HydrophobicContact CE1-CE 4.25Å; T439-M459 WeakPolarHBondContact CA-O 3.4Å; I440-M459 HydrophobicContact CB-CB 4.42Å; I440-M459 HydrophobicContact CB-CE 4.15Å; I440-M459 HydrophobicContact CG2-CE 3.8Å; I440-M459 PolarHBondContact N-O 3.21Å; I440-M459 PolarHBondContact O-N 3.24Å; K442-M459 HydrophobicContact CB-CE 4.37Å; M459-I461 HydrophobicContact CB-CG2 4.31Å; M459-I461 PolarHBondContact O-N 2.85Å; M459-I493 HydrophobicContact SD-CG2 4.3Å; M459-R497 PolarHBondContact SD-NH2 3.12Å
460	Q	93.3	Very high	86.6	Confident	61 Å²	61	46.7 Å²	46.7	29%	0.285	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	103.2	168.7	-65.1	178	-29.8	0	0	109.3	I48 F50 T439	I48-Q460 WeakPolarHBondContact O-CB 3.43Å; I48-Q460 PolarHBondContact O-N 2.97Å; F50-Q460 WeakPolarHBondContact CA-O 3.27Å; T439-Q460 HydrophobicContact CG2-CG 4.17Å
461	I	93.1	Very high	87.8	Confident	4 Å²	4	45.8 Å²	45.8	2%	0.021	25%	0.252	C	S	.	.			trans	-93.1	1.1	-175.7	60.1	161.2	0	0	0	113.7	L53 G438 I440 M459 I470 V484 L486 L491 I493	L53-I461 HydrophobicContact CD2-CG2 3.77Å; G438-I461 WeakPolarHBondContact O-CG1 3.46Å; I440-I461 HydrophobicContact CD1-CD1 4.02Å; I440-I461 HydrophobicContact CD1-CG2 4.26Å; I440-I461 HydrophobicContact CG1-CD1 4.19Å; I440-I461 HydrophobicContact CG1-CG2 4.45Å; M459-I461 HydrophobicContact CB-CG2 4.31Å; M459-I461 PolarHBondContact O-N 2.85Å; I461-I470 HydrophobicContact CD1-CD1 4.09Å; I461-I470 HydrophobicContact CD1-CG1 4.12Å; I461-V484 HydrophobicContact CD1-CG1 3.79Å; I461-L486 HydrophobicContact CD1-CD2 4.06Å; I461-L491 HydrophobicContact CB-CD1 4.01Å; I461-L491 HydrophobicContact CD1-CD1 4.38Å; I461-I493 HydrophobicContact CG2-CD1 3.5Å
462	L	89.7	Confident	88.7	Confident	17 Å²	17	46 Å²	46	9%	0.089	25%	0.254	C	S	.	.	S	Bend	trans	-123.4	151.5	178.6	-62.4	171.7	0	0	0	109.8	F50 Q466 E468 L486	F50-L462 WeakPolarHBondContact CB-O 3.42Å; L462-Q466 HydrophobicContact CB-CB 4.45Å; L462-E468 HydrophobicContact CD1-CB 4.47Å; L462-E468 HydrophobicContact CD1-CG 3.58Å; L462-E468 HydrophobicContact CD2-CG 3.85Å; L462-E468 HydrophobicContact CG-CG 4.38Å; L462-L486 HydrophobicContact CD2-CD1 3.95Å
463	P	87.6	Confident	89.6	Confident	47 Å²	47	42.9 Å²	42.9	31%	0.305	24%	0.243	S	C	.	.			trans	-62.5	154.6	173.1	-20.4	32.4	0	0	0	113.2	F50 G465 Q466	F50-P463 HydrophobicContact CD1-CB 4.4Å; F50-P463 HydrophobicContact CD1-CG 4.27Å; F50-P463 HydrophobicContact CE1-CG 3.95Å; F50-P463 HydrophobicContact CE2-CG 4.46Å; F50-P463 HydrophobicContact CZ-CG 4.06Å; P463-G465 PolarHBondContact O-N 2.65Å; P463-Q466 PolarHBondContact O-N 2.94Å
464	D	80.2	Confident	90.3	Very high	146 Å²	146	44.7 Å²	44.7	78%	0.781	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.1	130.8	176.9	-73.5	-46	0	0	0	112.5	Q466	D464-Q466 VanDerWaalsContact C-N 3.31Å; D464-Q466 PolarHBondContact O-N 3.43Å
465	G	79.8	Confident	90.7	Very high	86 Å²	86	45 Å²	45	89%	0.887	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.4	-5.7	-177.4	0	0	0	0	0	115.4	P463	P463-G465 PolarHBondContact O-N 2.65Å
466	Q	85.6	Confident	91	Very high	113 Å²	113	44.7 Å²	44.7	53%	0.528	25%	0.249	S	C	.	.			trans	-99.4	123.4	169.9	-62.9	-172.5	-1.6	0	0	110.5	L462 P463 D464	L462-Q466 HydrophobicContact CB-CB 4.45Å; P463-Q466 PolarHBondContact O-N 2.94Å; D464-Q466 VanDerWaalsContact C-N 3.31Å; D464-Q466 PolarHBondContact O-N 3.43Å
467	Q	86.3	Confident	91	Very high	143 Å²	143	48.4 Å²	48.4	67%	0.668	27%	0.266	S	S	*	.			trans	-128.6	115.6	174.7	-68.2	-176.5	-14.1	0	0	108.9	Y437	Y437-Q467 WeakPolarHBondContact O-CA 3.22Å; Y437-Q467 WeakPolarHBondContact O-CB 3.34Å
468	E	89.1	Confident	90.9	Very high	29 Å²	29	53.2 Å²	53.2	14%	0.136	30%	0.3	C	S	.	.			trans	-139.4	136.5	174.4	50.9	167.6	107.8	0	0	110.9	G438 L462 N487 N488	G438-E468 WeakPolarHBondContact CA-O 3.39Å; L462-E468 HydrophobicContact CD1-CB 4.47Å; L462-E468 HydrophobicContact CD1-CG 3.58Å; L462-E468 HydrophobicContact CD2-CG 3.85Å; L462-E468 HydrophobicContact CG-CG 4.38Å; E468-N487 WeakPolarHBondContact OE2-CA 3.41Å; E468-N487 WeakPolarHBondContact OE2-CB 3.37Å; E468-N487 PolarHBondContact OE2-N 2.83Å; E468-N488 PolarHBondContact OE1-ND2 2.97Å
469	P	91.2	Very high	90.7	Very high	68 Å²	68	54.8 Å²	54.8	44%	0.442	31%	0.309	S	S	.	.			trans	-73	135.1	-173.6	28.2	-35	0	0	0	111.8	K471	P469-K471 PolarHBondContact O-N 2.88Å; P469-K471 VanDerWaalsContact O-N 3.12Å
470	I	94.9	Very high	90.6	Very high	5 Å²	5	57.9 Å²	57.9	3%	0.026	32%	0.321	C	S	.	.			trans	-60.8	114.5	178.2	-66.9	159.7	0	0	0	109.9	K415 T439 I440 I461 S472 L473 V484 L486	K415-I470 HydrophobicContact CG-CG2 4.18Å; T439-I470 WeakPolarHBondContact O-CD1 3.42Å; I440-I470 HydrophobicContact CD1-CD1 4.15Å; I440-I470 HydrophobicContact CG1-CD1 3.58Å; I461-I470 HydrophobicContact CD1-CD1 4.09Å; I461-I470 HydrophobicContact CD1-CG1 4.12Å; I470-S472 VanDerWaalsContact CG2-O 3.29Å; I470-S472 WeakPolarHBondContact CG2-O 3.23Å; I470-L473 HydrophobicContact CG2-CB 4.43Å; I470-V484 HydrophobicContact CG1-CG1 4.11Å; I470-V484 HydrophobicContact CG2-CG1 3.77Å; I470-L486 HydrophobicContact CG1-CD2 4.32Å
471	K	93.4	Very high	90.7	Very high	60 Å²	60	55.1 Å²	55.1	26%	0.261	31%	0.309	S	S	.	.			trans	-75.4	-40	-177.4	-56	-60.2	-175.2	106.4	0	111.5	D67 K415 P469 G485 N487	D67-K471 IonicContact OD1-NZ 3.62Å; D67-K471 PolarHBondContact OD1-NZ 3.34Å; K415-K471 WeakPolarHBondContact CE-O 3.33Å; P469-K471 PolarHBondContact O-N 2.88Å; P469-K471 VanDerWaalsContact O-N 3.12Å; K471-G485 WeakPolarHBondContact CB-O 3.46Å; K471-G485 PolarHBondContact N-O 2.95Å; K471-N487 PolarHBondContact NZ-OD1 3.11Å
472	S	94.9	Very high	90.8	Very high	14 Å²	14	55 Å²	55	10%	0.098	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	144.6	-174.4	-134.6	0	0	0	0	110.5	S69 I470 G485	S69-S472 VanDerWaalsContact O-CB 3.26Å; S69-S472 WeakPolarHBondContact O-CB 3.14Å; S69-S472 PolarHBondContact O-OG 2.71Å; I470-S472 VanDerWaalsContact CG2-O 3.29Å; I470-S472 WeakPolarHBondContact CG2-O 3.23Å; S472-G485 PolarHBondContact N-O 2.84Å; S472-G485 PolarHBondContact O-N 2.93Å
473	L	96.6	Very high	91.2	Very high	13 Å²	13	54.2 Å²	54.2	7%	0.068	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	124	174.8	-166.7	65.6	0	0	0	107.8	K415 V417 Y432 I440 I470 L482 V484	K415-L473 HydrophobicContact CB-CB 3.72Å; K415-L473 HydrophobicContact CB-CD2 4.01Å; K415-L473 HydrophobicContact CG-CB 4.29Å; V417-L473 HydrophobicContact CG1-CB 4.48Å; V417-L473 HydrophobicContact CG1-CD2 4.44Å; V417-L473 HydrophobicContact CG1-CG 4.16Å; V417-L473 HydrophobicContact CG2-CD2 4.06Å; V417-L473 HydrophobicContact CG2-CG 4.1Å; Y432-L473 WeakPolarHBondContact O-CD2 3.46Å; I440-L473 HydrophobicContact CD1-CD1 4.07Å; I470-L473 HydrophobicContact CG2-CB 4.43Å; L473-L482 HydrophobicContact CD1-CD1 3.82Å; L473-L482 HydrophobicContact CD1-CD2 4.05Å; L473-L482 HydrophobicContact CD1-CG 3.84Å; L473-L482 HydrophobicContact CG-CD1 4.15Å; L473-V484 HydrophobicContact CD1-CB 4.48Å; L473-V484 HydrophobicContact CD1-CG1 4.33Å; L473-V484 HydrophobicContact CD1-CG2 3.94Å
474	Q	95.8	Very high	91.6	Very high	70 Å²	70	52 Å²	52	33%	0.327	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	150.7	-179.9	-70.5	-66	-4.1	0	0	109.8	L71 L73 F483	L71-Q474 HydrophobicContact CB-CG 3.84Å; L71-Q474 HydrophobicContact CD1-CG 4.43Å; L73-Q474 HydrophobicContact CD1-CB 4.09Å; L73-Q474 HydrophobicContact CG-CB 4.49Å; Q474-F483 HydrophobicContact CB-CB 4.36Å; Q474-F483 PolarHBondContact N-O 2.82Å; Q474-F483 PolarHBondContact O-N 2.86Å
475	I	95.7	Very high	92.4	Very high	10 Å²	10	45 Å²	45	5%	0.051	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	142.2	180	-175.3	166.4	0	0	0	110.3	L73 F305 V417 D419 L495	L73-I475 WeakPolarHBondContact CD1-O 3.41Å; F305-I475 HydrophobicContact CE2-CG2 3.76Å; F305-I475 HydrophobicContact CZ-CG2 3.85Å; V417-I475 HydrophobicContact CB-CB 4.07Å; V417-I475 HydrophobicContact CB-CG2 3.84Å; V417-I475 HydrophobicContact CG1-CB 4.48Å; V417-I475 HydrophobicContact CG1-CG2 4.21Å; V417-I475 HydrophobicContact CG2-CB 3.95Å; V417-I475 HydrophobicContact CG2-CG2 4.29Å; D419-I475 HydrophobicContact CB-CD1 3.67Å; I475-L495 HydrophobicContact CD1-CD1 3.75Å; I475-L495 HydrophobicContact CG1-CD1 4.02Å
476	L	94.6	Very high	93.1	Very high	17 Å²	17	41.5 Å²	41.5	9%	0.089	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	92.9	171.1	-178.4	59.9	0	0	0	109.1	L73 A75 L93 S478 D479 R480 S481 F483	L73-L476 HydrophobicContact CD1-CB 4.21Å; A75-L476 HydrophobicContact CB-CD1 4.07Å; L93-L476 HydrophobicContact CB-CD2 4.44Å; L93-L476 HydrophobicContact CD1-CD2 3.89Å; L93-L476 HydrophobicContact CD2-CD2 4.15Å; L93-L476 HydrophobicContact CG-CD2 4.38Å; L476-S478 VanDerWaalsContact C-N 3.26Å; L476-S478 WeakPolarHBondContact CD1-OG 3.3Å; L476-S478 PolarHBondContact O-N 2.85Å; L476-D479 HydrophobicContact CD2-CB 3.67Å; L476-D479 HydrophobicContact CG-CB 3.89Å; L476-D479 CarbonylContact O-C 3.6Å; L476-D479 PolarHBondContact O-N 3Å; L476-R480 PolarHBondContact O-N 3.36Å; L476-R480 VanDerWaalsContact O-N 3.12Å; L476-S481 PolarHBondContact N-O 2.76Å; L476-S481 PolarHBondContact O-N 2.79Å; L476-F483 HydrophobicContact CB-CD2 4.42Å; L476-F483 HydrophobicContact CB-CE2 3.88Å; L476-F483 HydrophobicContact CD2-CE2 4.12Å
477	H	91.6	Very high	93.5	Very high	83 Å²	83	38.5 Å²	38.5	38%	0.384	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-54.4	-39.8	-177	-53.5	76.5	0	0	0	112.7	V418 D419 D479 R480	V418-H477 PolarHBondContact O-NE2 2.8Å; D419-H477 IonicContact OD1-CD2 3.6Å; D419-H477 PolarHBondContact OD1-CD2 2.88Å; D419-H477 VanDerWaalsContact OD1-CD2 3.27Å; H477-D479 VanDerWaalsContact C-N 3.26Å; H477-D479 PolarHBondContact O-N 3.27Å; H477-R480 PolarHBondContact O-N 2.94Å
478	S	89	Confident	93.8	Very high	104 Å²	104	34.9 Å²	34.9	73%	0.727	19%	0.186	S	C	*	.	G	3₁₀ helix	trans	-69.6	-16.2	-177.2	64.6	0	0	0	0	115.5	L476	L476-S478 VanDerWaalsContact C-N 3.26Å; L476-S478 WeakPolarHBondContact CD1-OG 3.3Å; L476-S478 PolarHBondContact O-N 2.85Å
479	D	88.3	Confident	94.1	Very high	59 Å²	59	33.7 Å²	33.7	32%	0.316	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-123.9	13.8	-179.3	-170.5	57.3	0	0	0	110.2	L476 H477 S481 K492	L476-D479 HydrophobicContact CD2-CB 3.67Å; L476-D479 HydrophobicContact CG-CB 3.89Å; L476-D479 CarbonylContact O-C 3.6Å; L476-D479 PolarHBondContact O-N 3Å; H477-D479 VanDerWaalsContact C-N 3.26Å; H477-D479 PolarHBondContact O-N 3.27Å; D479-S481 WeakPolarHBondContact O-CB 3.41Å; D479-S481 PolarHBondContact O-N 3.21Å; D479-S481 PolarHBondContact O-OG 2.82Å; D479-S481 PolarHBondContact OD2-OG 2.55Å; D479-K492 WeakPolarHBondContact OD2-CE 3.32Å; D479-K492 IonicContact OD2-NZ 3.52Å; D479-K492 PolarHBondContact OD2-NZ 3.05Å
480	R	91.8	Very high	94.3	Very high	66 Å²	66	30.5 Å²	30.5	25%	0.249	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	31	56	-172.3	-70.6	-178.6	-174.4	134.1	18.6	113.2	L476 H477 L495 E496 Y514 E528	L476-R480 PolarHBondContact O-N 3.36Å; L476-R480 VanDerWaalsContact O-N 3.12Å; H477-R480 PolarHBondContact O-N 2.94Å; R480-L495 VanDerWaalsContact C-CD1 3.42Å; R480-L495 VanDerWaalsContact C-CG 3.43Å; R480-L495 HydrophobicContact CB-CB 4.36Å; R480-L495 HydrophobicContact CB-CD1 4.25Å; R480-L495 WeakPolarHBondContact O-CB 3.48Å; R480-L495 VanDerWaalsContact O-CG 3.25Å; R480-L495 WeakPolarHBondContact O-CG 3.17Å; R480-L495 PolarHBondContact O-N 3.05Å; R480-E496 HydrophobicContact CB-CG 4.42Å; R480-E496 WeakPolarHBondContact CD-OE2 3.23Å; R480-E496 IonicContact CZ-OE2 2.79Å; R480-E496 IonicContact NE-OE2 3.59Å; R480-E496 IonicContact NH1-OE2 2.69Å; R480-E496 PolarHBondContact NH1-OE2 3.48Å; R480-Y514 HydrophobicContact CG-CE1 4.42Å; R480-E528 IonicContact CZ-OE1 2.82Å; R480-E528 IonicContact CZ-OE2 2.91Å; R480-E528 IonicContact NH1-OE2 2.74Å; R480-E528 PolarHBondContact NH1-OE2 2.83Å; R480-E528 IonicContact NH2-OE1 3.34Å; R480-E528 PolarHBondContact NH2-OE1 3.34Å; R480-E528 IonicContact NH2-OE2 3.91Å; R480-E528 PolarHBondContact NH2-OE2 2.84Å
481	S	94.9	Very high	94.4	Very high	4 Å²	4	31.1 Å²	31.1	3%	0.028	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	135.7	-169.4	-76.3	0	0	0	0	113.5	L476 D479 K492	L476-S481 PolarHBondContact N-O 2.76Å; L476-S481 PolarHBondContact O-N 2.79Å; D479-S481 WeakPolarHBondContact O-CB 3.41Å; D479-S481 PolarHBondContact O-N 3.21Å; D479-S481 PolarHBondContact O-OG 2.82Å; D479-S481 PolarHBondContact OD2-OG 2.55Å; S481-K492 VanDerWaalsContact CB-CE 3.43Å; S481-K492 WeakPolarHBondContact OG-CE 3.4Å
482	L	96.6	Very high	94.5	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.01	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	131.8	175.3	-161.1	63.9	0	0	0	109.7	V417 Y432 I440 L473 V484 K492 I493 L495	V417-L482 HydrophobicContact CG2-CD1 3.5Å; V417-L482 VanDerWaalsContact CG2-CD1 3.5Å; Y432-L482 HydrophobicContact CD1-CD2 4.1Å; Y432-L482 HydrophobicContact CG-CD1 4.41Å; Y432-L482 HydrophobicContact CG-CD2 4.48Å; I440-L482 HydrophobicContact CD1-CD2 3.81Å; I440-L482 HydrophobicContact CG2-CD2 4.21Å; L473-L482 HydrophobicContact CD1-CD1 3.82Å; L473-L482 HydrophobicContact CD1-CD2 4.05Å; L473-L482 HydrophobicContact CD1-CG 3.84Å; L473-L482 HydrophobicContact CG-CD1 4.15Å; L482-V484 HydrophobicContact CD2-CG2 4.36Å; L482-V484 HydrophobicContact CG-CG2 4.27Å; L482-K492 CarbonylContact O-C 3.5Å; L482-K492 VanDerWaalsContact O-CA 3.31Å; L482-K492 WeakPolarHBondContact O-CA 3.39Å; L482-I493 HydrophobicContact CB-CB 4.37Å; L482-I493 WeakPolarHBondContact CB-O 3.36Å; L482-I493 PolarHBondContact N-O 3.19Å; L482-I493 PolarHBondContact O-N 3.47Å; L482-L495 HydrophobicContact CB-CD2 3.75Å; L482-L495 HydrophobicContact CD1-CD2 4.21Å; L482-L495 HydrophobicContact CG-CD2 4.42Å
483	F	97.1	Very high	94.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	122	173.6	-66.9	-89.4	0	0	0	109.6	L71 L73 L80 L93 V96 Q474 L476 L491 K492	L71-F483 HydrophobicContact CD1-CB 4.28Å; L73-F483 HydrophobicContact CD2-CD2 3.74Å; L73-F483 HydrophobicContact CD2-CE2 3.92Å; L73-F483 HydrophobicContact CD2-CG 4.19Å; L80-F483 HydrophobicContact CD2-CD1 3.82Å; L80-F483 HydrophobicContact CD2-CE1 4.28Å; L93-F483 HydrophobicContact CB-CZ 4.42Å; L93-F483 HydrophobicContact CD2-CE1 4.04Å; L93-F483 HydrophobicContact CD2-CE2 3.98Å; L93-F483 HydrophobicContact CD2-CZ 3.53Å; V96-F483 HydrophobicContact CG2-CE1 4.44Å; Q474-F483 HydrophobicContact CB-CB 4.36Å; Q474-F483 PolarHBondContact N-O 2.82Å; Q474-F483 PolarHBondContact O-N 2.86Å; L476-F483 HydrophobicContact CB-CD2 4.42Å; L476-F483 HydrophobicContact CB-CE2 3.88Å; L476-F483 HydrophobicContact CD2-CE2 4.12Å; F483-L491 WeakPolarHBondContact CA-O 3.38Å; F483-K492 HydrophobicContact CD1-CB 4.06Å; F483-K492 HydrophobicContact CD1-CG 4.35Å; F483-K492 HydrophobicContact CE1-CB 3.86Å; F483-K492 HydrophobicContact CE1-CD 3.93Å; F483-K492 HydrophobicContact CE1-CG 3.87Å; F483-K492 HydrophobicContact CZ-CD 3.92Å; F483-K492 HydrophobicContact CZ-CG 4.05Å
484	V	97.1	Very high	94.4	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	123.9	-172.7	-164.5	0	0	0	0	109.8	I440 I461 I470 L473 L482 L486 V490 L491 I493	I440-V484 HydrophobicContact CD1-CG1 4.22Å; I440-V484 HydrophobicContact CD1-CG2 3.67Å; I461-V484 HydrophobicContact CD1-CG1 3.79Å; I470-V484 HydrophobicContact CG1-CG1 4.11Å; I470-V484 HydrophobicContact CG2-CG1 3.77Å; L473-V484 HydrophobicContact CD1-CB 4.48Å; L473-V484 HydrophobicContact CD1-CG1 4.33Å; L473-V484 HydrophobicContact CD1-CG2 3.94Å; L482-V484 HydrophobicContact CD2-CG2 4.36Å; L482-V484 HydrophobicContact CG-CG2 4.27Å; V484-L486 HydrophobicContact CG1-CD2 4.23Å; V484-V490 CarbonylContact O-C 3.56Å; V484-V490 VanDerWaalsContact O-CA 3.3Å; V484-V490 WeakPolarHBondContact O-CA 3.44Å; V484-L491 HydrophobicContact CB-CB 4.28Å; V484-L491 PolarHBondContact N-O 3.37Å; V484-L491 PolarHBondContact O-N 2.04Å; V484-I493 HydrophobicContact CG2-CD1 3.94Å; V484-I493 HydrophobicContact CG2-CG1 4.42Å
485	G	96.3	Very high	94.3	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	121.8	174.7	0	0	0	0	0	111.1	F68 K471 S472	F68-G485 VanDerWaalsContact O-CA 3.26Å; F68-G485 WeakPolarHBondContact O-CA 3.31Å; K471-G485 WeakPolarHBondContact CB-O 3.46Å; K471-G485 PolarHBondContact N-O 2.95Å; S472-G485 PolarHBondContact N-O 2.84Å; S472-G485 PolarHBondContact O-N 2.93Å
486	L	95.1	Very high	94.1	Very high	12 Å²	12	28 Å²	28	6%	0.063	15%	0.15	C	C	.	.			trans	-111	-179.7	-179.7	-63	177.5	0	0	0	110.8	F68 I461 L462 I470 V484 N488 G489 L491	F68-L486 WeakPolarHBondContact CB-O 3.13Å; F68-L486 PolarHBondContact N-O 2.85Å; F68-L486 VanDerWaalsContact N-O 3.12Å; I461-L486 HydrophobicContact CD1-CD2 4.06Å; L462-L486 HydrophobicContact CD2-CD1 3.95Å; I470-L486 HydrophobicContact CG1-CD2 4.32Å; V484-L486 HydrophobicContact CG1-CD2 4.23Å; L486-N488 VanDerWaalsContact C-N 3.32Å; L486-G489 PolarHBondContact N-O 2.87Å; L486-L491 HydrophobicContact CD1-CD1 3.82Å; L486-L491 HydrophobicContact CD1-CG 3.94Å
487	N	93.4	Very high	94	Very high	50 Å²	50	27.5 Å²	27.5	27%	0.267	15%	0.147	S	C	.	.	S	Bend	trans	-68.4	-33.7	171.2	-166.9	74.5	0	0	0	111.9	H66 D67 E468 K471	H66-N487 CarbonylContact C-O 3.57Å; H66-N487 WeakPolarHBondContact CA-O 3.04Å; D67-N487 PolarHBondContact N-O 3.41Å; E468-N487 WeakPolarHBondContact OE2-CA 3.41Å; E468-N487 WeakPolarHBondContact OE2-CB 3.37Å; E468-N487 PolarHBondContact OE2-N 2.83Å; K471-N487 PolarHBondContact NZ-OD1 3.11Å
488	N	92.6	Very high	94	Very high	67 Å²	67	23.9 Å²	23.9	36%	0.358	13%	0.131	S	C	.	.	S	Bend	trans	-111	-3.9	-169	-60.1	-43.4	0	0	0	114.8	T61 H66 F68 E468 L486	T61-N488 WeakPolarHBondContact CG2-O 3.22Å; H66-N488 PolarHBondContact CE1-OD1 2.9Å; H66-N488 PolarHBondContact ND1-OD1 3.49Å; F68-N488 VanDerWaalsContact CE2-C 3.4Å; E468-N488 PolarHBondContact OE1-ND2 2.97Å; L486-N488 VanDerWaalsContact C-N 3.32Å
489	G	94.9	Very high	94.1	Very high	4 Å²	4	22.5 Å²	22.5	4%	0.041	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.1	-166.1	178.8	0	0	0	0	0	114.4	F60 F68 L486	F60-G489 CarbonylContact O-C 3.57Å; F60-G489 WeakPolarHBondContact O-CA 3.11Å; F68-G489 VanDerWaalsContact CD2-N 3.28Å; L486-G489 PolarHBondContact N-O 2.87Å
490	V	96.7	Very high	94.1	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	138.7	173.6	179.1	0	0	0	0	109.6	F60 F68 L71 L80 V82 V96 V484	F60-V490 PolarHBondContact N-O 3.36Å; F60-V490 PolarHBondContact O-N 2.94Å; F68-V490 HydrophobicContact CB-CG2 3.89Å; F68-V490 HydrophobicContact CD1-CG2 3.92Å; F68-V490 HydrophobicContact CG-CG2 4.2Å; L71-V490 HydrophobicContact CD2-CG1 4.28Å; L71-V490 HydrophobicContact CD2-CG2 3.91Å; L80-V490 HydrophobicContact CD2-CG1 4.04Å; V82-V490 HydrophobicContact CG1-CG2 4Å; V82-V490 HydrophobicContact CG2-CG2 4.25Å; V96-V490 HydrophobicContact CG1-CB 4.37Å; V96-V490 HydrophobicContact CG1-CG1 4.17Å; V484-V490 CarbonylContact O-C 3.56Å; V484-V490 VanDerWaalsContact O-CA 3.3Å; V484-V490 WeakPolarHBondContact O-CA 3.44Å
491	L	95.8	Very high	94	Very high	18 Å²	18	21.1 Å²	21.1	9%	0.094	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	143.3	173.2	-52.4	-178.1	0	0	0	110.4	V57 S58 N59 I461 F483 V484 L486 I493	V57-L491 HydrophobicContact CG1-CB 3.97Å; V57-L491 HydrophobicContact CG1-CD1 4.29Å; V57-L491 HydrophobicContact CG1-CD2 3.92Å; V57-L491 HydrophobicContact CG1-CG 4.28Å; S58-L491 CarbonylContact O-C 3.56Å; N59-L491 HydrophobicContact CB-CD2 3.53Å; I461-L491 HydrophobicContact CB-CD1 4.01Å; I461-L491 HydrophobicContact CD1-CD1 4.38Å; F483-L491 WeakPolarHBondContact CA-O 3.38Å; V484-L491 HydrophobicContact CB-CB 4.28Å; V484-L491 PolarHBondContact N-O 3.37Å; V484-L491 PolarHBondContact O-N 2.04Å; L486-L491 HydrophobicContact CD1-CD1 3.82Å; L486-L491 HydrophobicContact CD1-CG 3.94Å; L491-I493 HydrophobicContact CB-CG1 4.4Å
492	K	95.9	Very high	93.8	Very high	18 Å²	18	30.8 Å²	30.8	8%	0.078	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	132.1	159.2	176.3	-174.1	-178.9	177.2	0	109	V57 S58 L93 H94 V96 D479 S481 L482 F483	V57-K492 WeakPolarHBondContact CA-O 3.48Å; S58-K492 PolarHBondContact N-O 3.26Å; S58-K492 VanDerWaalsContact N-O 3.09Å; S58-K492 PolarHBondContact O-N 3.05Å; L93-K492 WeakPolarHBondContact O-CD 3.47Å; L93-K492 WeakPolarHBondContact O-CE 3.4Å; L93-K492 PolarHBondContact O-NZ 3.12Å; H94-K492 WeakPolarHBondContact O-CD 3.48Å; H94-K492 PolarHBondContact O-NZ 3Å; V96-K492 HydrophobicContact CG2-CB 3.33Å; V96-K492 HydrophobicContact CG2-CD 4.44Å; V96-K492 HydrophobicContact CG2-CG 4.48Å; D479-K492 WeakPolarHBondContact OD2-CE 3.32Å; D479-K492 IonicContact OD2-NZ 3.52Å; D479-K492 PolarHBondContact OD2-NZ 3.05Å; S481-K492 VanDerWaalsContact CB-CE 3.43Å; S481-K492 WeakPolarHBondContact OG-CE 3.4Å; L482-K492 CarbonylContact O-C 3.5Å; L482-K492 VanDerWaalsContact O-CA 3.31Å; L482-K492 WeakPolarHBondContact O-CA 3.39Å; F483-K492 HydrophobicContact CD1-CB 4.06Å; F483-K492 HydrophobicContact CD1-CG 4.35Å; F483-K492 HydrophobicContact CE1-CB 3.86Å; F483-K492 HydrophobicContact CE1-CD 3.93Å; F483-K492 HydrophobicContact CE1-CG 3.87Å; F483-K492 HydrophobicContact CZ-CD 3.92Å; F483-K492 HydrophobicContact CZ-CG 4.05Å
493	I	95.6	Very high	93.5	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	125.6	-179.4	-43.8	179.6	0	0	0	108.4	L53 V57 I440 M459 I461 L482 V484 L491	L53-I493 HydrophobicContact CD1-CG2 4.29Å; V57-I493 HydrophobicContact CG1-CG1 4.5Å; V57-I493 HydrophobicContact CG2-CG1 4.2Å; V57-I493 HydrophobicContact CG2-CG2 4.5Å; I440-I493 HydrophobicContact CD1-CD1 4.49Å; M459-I493 HydrophobicContact SD-CG2 4.3Å; I461-I493 HydrophobicContact CG2-CD1 3.5Å; L482-I493 HydrophobicContact CB-CB 4.37Å; L482-I493 WeakPolarHBondContact CB-O 3.36Å; L482-I493 PolarHBondContact N-O 3.19Å; L482-I493 PolarHBondContact O-N 3.47Å; V484-I493 HydrophobicContact CG2-CD1 3.94Å; V484-I493 HydrophobicContact CG2-CG1 4.42Å; L491-I493 HydrophobicContact CB-CG1 4.4Å
494	P	94.8	Very high	93.2	Very high	30 Å²	30	38 Å²	38	20%	0.195	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	137.5	174.5	29.1	-34.2	0	0	0	110.9	W56 R497	W56-P494 HydrophobicContact CB-CG 4.05Å; W56-P494 HydrophobicContact CE3-CG 4.32Å; W56-P494 WeakPolarHBondContact O-CD 3.44Å; P494-R497 HydrophobicContact CG-CG 3.99Å; P494-R497 PolarHBondContact O-NH1 2.93Å
495	L	93.4	Very high	92.7	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	22%	0.217	C	C	.	.	S	Bend	trans	-73.1	-32.4	-177.4	-60.4	173.9	0	0	0	112.2	D419 Y432 K442 I475 R480 L482 Y514	D419-L495 VanDerWaalsContact OD2-CD1 3.22Å; D419-L495 WeakPolarHBondContact OD2-CD1 3.16Å; Y432-L495 HydrophobicContact CD1-CD2 4.13Å; Y432-L495 HydrophobicContact CD2-CD2 4.2Å; Y432-L495 HydrophobicContact CE1-CD2 3.65Å; Y432-L495 HydrophobicContact CE2-CD2 3.77Å; Y432-L495 HydrophobicContact CG-CD2 4.38Å; Y432-L495 VanDerWaalsContact CZ-CD2 3.47Å; Y432-L495 PolarHBondContact OH-O 2.87Å; K442-L495 PolarHBondContact NZ-O 3.43Å; I475-L495 HydrophobicContact CD1-CD1 3.75Å; I475-L495 HydrophobicContact CG1-CD1 4.02Å; R480-L495 VanDerWaalsContact C-CD1 3.42Å; R480-L495 VanDerWaalsContact C-CG 3.43Å; R480-L495 HydrophobicContact CB-CB 4.36Å; R480-L495 HydrophobicContact CB-CD1 4.25Å; R480-L495 WeakPolarHBondContact O-CB 3.48Å; R480-L495 VanDerWaalsContact O-CG 3.25Å; R480-L495 WeakPolarHBondContact O-CG 3.17Å; R480-L495 PolarHBondContact O-N 3.05Å; L482-L495 HydrophobicContact CB-CD2 3.75Å; L482-L495 HydrophobicContact CD1-CD2 4.21Å; L482-L495 HydrophobicContact CG-CD2 4.42Å; L495-Y514 HydrophobicContact CB-CE1 4.03Å
496	E	91.1	Very high	92.3	Very high	52 Å²	52	44.7 Å²	44.7	24%	0.243	24%	0.236	C	C	.	.			trans	-99.4	132.4	171.6	56.1	-179.3	-136.3	0	0	110.4	R480 Y514 T526	R480-E496 HydrophobicContact CB-CG 4.42Å; R480-E496 WeakPolarHBondContact CD-OE2 3.23Å; R480-E496 IonicContact CZ-OE2 2.79Å; R480-E496 IonicContact NE-OE2 3.59Å; R480-E496 IonicContact NH1-OE2 2.69Å; R480-E496 PolarHBondContact NH1-OE2 3.48Å; E496-Y514 HydrophobicContact CB-CD1 3.89Å; E496-Y514 HydrophobicContact CB-CG 4.03Å; E496-T526 VanDerWaalsContact CD-CG2 3.49Å; E496-T526 WeakPolarHBondContact OE1-CG2 3.49Å; E496-T526 WeakPolarHBondContact OE2-CG2 3.24Å
497	R	92.3	Very high	92.1	Very high	7 Å²	7	44.3 Å²	44.3	3%	0.026	23%	0.234	C	C	.	.			trans	-139.9	34.8	176.2	-65.6	-174.5	-58	-74.5	-2.9	111.4	W56 E457 M459 P494 S499 M500	W56-R497 HydrophobicContact CD2-CG 4.24Å; W56-R497 HydrophobicContact CE3-CG 4.39Å; W56-R497 HydrophobicContact CG-CG 4.35Å; E457-R497 IonicContact OE1-CZ 2.76Å; E457-R497 IonicContact OE1-NH1 2.75Å; E457-R497 IonicContact OE1-NH2 2.8Å; E457-R497 PolarHBondContact OE1-NH2 2.85Å; E457-R497 IonicContact OE2-CZ 3.47Å; E457-R497 IonicContact OE2-NH2 2.72Å; E457-R497 PolarHBondContact OE2-NH2 2.83Å; M459-R497 PolarHBondContact SD-NH2 3.12Å; P494-R497 HydrophobicContact CG-CG 3.99Å; P494-R497 PolarHBondContact O-NH1 2.93Å; R497-S499 PolarHBondContact O-N 2.88Å; R497-S499 VanDerWaalsContact O-N 3.08Å; R497-M500 WeakPolarHBondContact O-CB 3.32Å; R497-M500 PolarHBondContact O-N 2.63Å
498	C	91.5	Very high	92	Very high	6 Å²	6	43.7 Å²	43.7	4%	0.041	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-54.7	-36	-168.2	-50.5	0	0	0	0	113.6	M500 Y501 C515 C524	C498-M500 PolarHBondContact O-N 2.89Å; C498-M500 VanDerWaalsContact O-N 3.1Å; C498-Y501 WeakPolarHBondContact O-CB 3.34Å; C498-Y501 WeakPolarHBondContact O-CD2 3.42Å; C498-Y501 PolarHBondContact O-N 2.99Å; C498-C515 WeakPolarHBondContact CA-SG 3.36Å; C498-C515 HydrophobicContact CB-CB 3.73Å; C498-C515 WeakPolarHBondContact CB-SG 3.5Å; C498-C515 WeakPolarHBondContact SG-CA 3.43Å; C498-C515 WeakPolarHBondContact SG-CB 3.47Å; C498-C515 CovalentContact SG-SG 2.04Å; C498-C515 PolarHBondContact SG-SG 3.04Å; C498-C524 HydrophobicContact CB-CB 4.47Å; C498-C524 VanDerWaalsContact O-CB 3.28Å; C498-C524 WeakPolarHBondContact O-CB 3.44Å
499	S	90.3	Very high	91.7	Very high	76 Å²	76	42.3 Å²	42.3	53%	0.531	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-63.7	-7.1	174.5	42.8	0	0	0	0	115.7	W56 R497 Y501	W56-S499 WeakPolarHBondContact CH2-OG 3.38Å; R497-S499 PolarHBondContact O-N 2.88Å; R497-S499 VanDerWaalsContact O-N 3.08Å; S499-Y501 VanDerWaalsContact C-N 3.33Å
500	M	89.3	Confident	91.4	Very high	59 Å²	59	42.5 Å²	42.5	29%	0.291	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-67.3	-35.6	165.7	-173.6	176.6	-178.6	0	0	111.3	I48 D52 R497 C498 R502	I48-M500 HydrophobicContact CD1-CE 4.19Å; I48-M500 HydrophobicContact CD1-SD 4.05Å; I48-M500 HydrophobicContact CG1-CE 4.35Å; I48-M500 HydrophobicContact CG2-CE 4.24Å; D52-M500 HydrophobicContact CB-CE 4.21Å; R497-M500 WeakPolarHBondContact O-CB 3.32Å; R497-M500 PolarHBondContact O-N 2.63Å; C498-M500 PolarHBondContact O-N 2.89Å; C498-M500 VanDerWaalsContact O-N 3.1Å; M500-R502 PolarHBondContact O-N 2.8Å
501	Y	90.3	Very high	91.1	Very high	36 Å²	36	44.3 Å²	44.3	14%	0.141	24%	0.24	C	C	.	.			trans	-83.9	110.3	179.8	-47.2	-56	0	0	0	110	C498 S499 E506 A510 C524	C498-Y501 WeakPolarHBondContact O-CB 3.34Å; C498-Y501 WeakPolarHBondContact O-CD2 3.42Å; C498-Y501 PolarHBondContact O-N 2.99Å; S499-Y501 VanDerWaalsContact C-N 3.33Å; Y501-E506 HydrophobicContact CD1-CB 4.25Å; Y501-E506 HydrophobicContact CG-CB 4.46Å; Y501-A510 HydrophobicContact CD1-CB 4.26Å; Y501-A510 HydrophobicContact CD2-CB 4.22Å; Y501-A510 HydrophobicContact CE1-CB 3.75Å; Y501-A510 HydrophobicContact CE2-CB 3.69Å; Y501-A510 HydrophobicContact CG-CB 4.49Å; Y501-A510 VanDerWaalsContact CZ-CB 3.44Å; Y501-C524 WeakPolarHBondContact O-CB 3.31Å
502	R	89.5	Confident	90.9	Very high	208 Å²	208	43.7 Å²	43.7	79%	0.785	24%	0.237	S	C	*	.			trans	-91.2	-26	-173.3	-61.9	-175.5	-178.9	-172.6	1.3	112.5	M500 E506	M500-R502 PolarHBondContact O-N 2.8Å; R502-E506 PolarHBondContact N-OE2 2.83Å
503	T	90.6	Very high	90.7	Very high	67 Å²	67	42.8 Å²	42.8	41%	0.411	23%	0.233	S	C	.	.	S	Bend	trans	-111.2	157.6	179.8	70.3	0	0	0	0	112.8	G505 E506 C507	T503-G505 PolarHBondContact O-N 2.81Å; T503-E506 WeakPolarHBondContact CB-OE1 3.42Å; T503-E506 VanDerWaalsContact CG2-OE1 3.25Å; T503-E506 WeakPolarHBondContact CG2-OE1 3.35Å; T503-E506 PolarHBondContact N-OE2 3.33Å; T503-E506 VanDerWaalsContact N-OE2 3.12Å; T503-E506 PolarHBondContact O-N 2.93Å; T503-E506 VanDerWaalsContact OG1-CG 3.31Å; T503-E506 WeakPolarHBondContact OG1-CG 3.3Å; T503-E506 PolarHBondContact OG1-N 2.73Å; T503-E506 PolarHBondContact OG1-OE1 2.55Å; T503-C507 WeakPolarHBondContact O-CB 3.46Å; T503-C507 PolarHBondContact O-N 2.89Å
504	E	90.4	Very high	90.6	Very high	87 Å²	87	43.1 Å²	43.1	41%	0.407	23%	0.234	S	C	.	.	H	α-helix	trans	-56.8	-40.1	174.2	-172.2	159.8	168	0	0	111.7	C507 L508 W517	E504-C507 PolarHBondContact O-N 3.3Å; E504-L508 HydrophobicContact CG-CD1 3.87Å; E504-L508 WeakPolarHBondContact O-CB 3.16Å; E504-L508 WeakPolarHBondContact O-CG 3.49Å; E504-L508 PolarHBondContact O-N 2.88Å; E504-W517 HydrophobicContact CB-CD2 3.88Å; E504-W517 HydrophobicContact CB-CE3 4.41Å; E504-W517 HydrophobicContact CB-CG 4.2Å; E504-W517 HydrophobicContact CB-CH2 4.41Å; E504-W517 HydrophobicContact CB-CZ2 3.85Å; E504-W517 VanDerWaalsContact CG-CD1 3.47Å; E504-W517 HydrophobicContact CG-CD2 4.06Å; E504-W517 HydrophobicContact CG-CG 3.83Å; E504-W517 PolarHBondContact OE2-NE1 3.12Å
505	G	87.9	Confident	90.6	Very high	56 Å²	56	41.8 Å²	41.8	58%	0.577	23%	0.226	S	C	*	.	H	α-helix	trans	-67.7	-38	177.3	0	0	0	0	0	113.8	T503 G509	T503-G505 PolarHBondContact O-N 2.81Å; G505-G509 VanDerWaalsContact O-CA 3.29Å; G505-G509 WeakPolarHBondContact O-CA 3.43Å; G505-G509 PolarHBondContact O-N 2.88Å
506	E	86.9	Confident	90.6	Very high	84 Å²	84	41.8 Å²	41.8	39%	0.393	23%	0.226	S	C	.	.	H	α-helix	trans	-66.5	-49.3	172	-73.1	147	-135.6	0	0	111.2	Y501 R502 T503 L508 G509 A510	Y501-E506 HydrophobicContact CD1-CB 4.25Å; Y501-E506 HydrophobicContact CG-CB 4.46Å; R502-E506 PolarHBondContact N-OE2 2.83Å; T503-E506 WeakPolarHBondContact CB-OE1 3.42Å; T503-E506 VanDerWaalsContact CG2-OE1 3.25Å; T503-E506 WeakPolarHBondContact CG2-OE1 3.35Å; T503-E506 PolarHBondContact N-OE2 3.33Å; T503-E506 VanDerWaalsContact N-OE2 3.12Å; T503-E506 PolarHBondContact O-N 2.93Å; T503-E506 VanDerWaalsContact OG1-CG 3.31Å; T503-E506 WeakPolarHBondContact OG1-CG 3.3Å; T503-E506 PolarHBondContact OG1-N 2.73Å; T503-E506 PolarHBondContact OG1-OE1 2.55Å; E506-L508 PolarHBondContact O-N 2.88Å; E506-G509 PolarHBondContact O-N 3.28Å; E506-A510 WeakPolarHBondContact O-CB 3.15Å; E506-A510 PolarHBondContact O-N 3.04Å
507	C	91.2	Very high	90.8	Very high	3 Å²	3	40 Å²	40	2%	0.02	22%	0.217	C	C	.	.	H	α-helix	trans	-62	-46.5	-175.5	-174.8	0	0	0	0	112	T503 E504 W517 C524	T503-C507 WeakPolarHBondContact O-CB 3.46Å; T503-C507 PolarHBondContact O-N 2.89Å; E504-C507 PolarHBondContact O-N 3.3Å; C507-W517 HydrophobicContact CB-CE3 3.93Å; C507-W517 PolarHBondContact SG-N 2.92Å; C507-C524 HydrophobicContact CB-CB 3.61Å; C507-C524 WeakPolarHBondContact CB-SG 3.42Å; C507-C524 VanDerWaalsContact SG-CA 3.59Å; C507-C524 WeakPolarHBondContact SG-CB 3.41Å; C507-C524 CovalentContact SG-SG 2.04Å; C507-C524 PolarHBondContact SG-SG 3.25Å
508	L	91	Very high	90.8	Very high	37 Å²	37	39.6 Å²	39.6	19%	0.194	22%	0.215	C	C	.	.	H	α-helix	trans	-77.7	-27.6	176.8	-61	177.1	0	0	0	112.4	E504 E506 R511 W517 T537	E504-L508 HydrophobicContact CG-CD1 3.87Å; E504-L508 WeakPolarHBondContact O-CB 3.16Å; E504-L508 WeakPolarHBondContact O-CG 3.49Å; E504-L508 PolarHBondContact O-N 2.88Å; E506-L508 PolarHBondContact O-N 2.88Å; L508-R511 WeakPolarHBondContact O-CD 3.08Å; L508-W517 HydrophobicContact CD2-CB 4.37Å; L508-T537 HydrophobicContact CD1-CG2 4.31Å; L508-T537 HydrophobicContact CD2-CG2 3.99Å; L508-T537 VanDerWaalsContact CD2-O 3.26Å; L508-T537 WeakPolarHBondContact CD2-O 3.05Å
509	G	87.3	Confident	90.8	Very high	38 Å²	38	41 Å²	41	39%	0.392	23%	0.225	S	C	.	.	H	α-helix	trans	-76.3	-22.8	177.6	0	0	0	0	0	114.3	G505 E506 R511 P544	G505-G509 VanDerWaalsContact O-CA 3.29Å; G505-G509 WeakPolarHBondContact O-CA 3.43Å; G505-G509 PolarHBondContact O-N 2.88Å; E506-G509 PolarHBondContact O-N 3.28Å; G509-R511 VanDerWaalsContact C-N 3.28Å; G509-R511 PolarHBondContact O-N 2.04Å; G509-P544 WeakPolarHBondContact O-CB 3.49Å
510	A	87.1	Confident	90.7	Very high	9 Å²	9	43.3 Å²	43.3	7%	0.074	23%	0.225	C	C	.	.	S	Bend	trans	-69.2	-23.6	174.1	0	0	0	0	0	113.4	Y501 E506 D512	Y501-A510 HydrophobicContact CD1-CB 4.26Å; Y501-A510 HydrophobicContact CD2-CB 4.22Å; Y501-A510 HydrophobicContact CE1-CB 3.75Å; Y501-A510 HydrophobicContact CE2-CB 3.69Å; Y501-A510 HydrophobicContact CG-CB 4.49Å; Y501-A510 VanDerWaalsContact CZ-CB 3.44Å; E506-A510 WeakPolarHBondContact O-CB 3.15Å; E506-A510 PolarHBondContact O-N 3.04Å; A510-D512 PolarHBondContact O-N 3.47Å; A510-D512 VanDerWaalsContact O-N 3.1Å
511	R	90.1	Very high	90.8	Very high	37 Å²	37	43.1 Å²	43.1	14%	0.14	22%	0.224	C	C	.	.			trans	56.5	20.8	-180	-52.4	-66.4	-166	-172.6	7.6	114.4	L456 L508 G509 P513 N539 I540 E542 P544	L456-R511 HydrophobicContact CD2-CB 4.3Å; L508-R511 WeakPolarHBondContact O-CD 3.08Å; G509-R511 VanDerWaalsContact C-N 3.28Å; G509-R511 PolarHBondContact O-N 2.04Å; R511-P513 WeakPolarHBondContact O-CD 3.06Å; R511-N539 WeakPolarHBondContact CD-O 3.29Å; R511-N539 PolarHBondContact NH1-ND2 3.04Å; R511-N539 PolarHBondContact NH1-O 3.04Å; R511-N539 PolarHBondContact NH1-OD1 3.09Å; R511-I540 WeakPolarHBondContact O-CG2 3.35Å; R511-E542 VanDerWaalsContact CD-O 3.24Å; R511-E542 WeakPolarHBondContact CD-O 3.29Å; R511-E542 VanDerWaalsContact CG-O 3.25Å; R511-E542 WeakPolarHBondContact CG-O 3.43Å; R511-E542 PolarHBondContact NE-O 3.18Å; R511-E542 IonicContact NH2-OE2 3.46Å; R511-E542 PolarHBondContact NH2-OE2 3.1Å; R511-P544 HydrophobicContact CB-CB 4.46Å; R511-P544 HydrophobicContact CB-CG 4.44Å; R511-P544 HydrophobicContact CG-CB 4.06Å; R511-P544 HydrophobicContact CG-CG 4.47Å
512	D	92	Very high	90.8	Very high	5 Å²	5	47.9 Å²	47.9	3%	0.027	25%	0.245	C	C	.	.			trans	-80.9	122.5	-170.5	-170.8	6.5	0	0	0	112.4	K442 A510 Y514 C515 Q538	K442-D512 WeakPolarHBondContact CE-OD1 3.44Å; K442-D512 IonicContact NZ-OD1 2.77Å; K442-D512 PolarHBondContact NZ-OD1 2.96Å; K442-D512 IonicContact NZ-OD2 3.71Å; K442-D512 PolarHBondContact NZ-OD2 3.11Å; A510-D512 PolarHBondContact O-N 3.47Å; A510-D512 VanDerWaalsContact O-N 3.1Å; D512-Y514 PolarHBondContact O-N 3.18Å; D512-Y514 VanDerWaalsContact O-N 3.1Å; D512-Y514 WeakPolarHBondContact OD1-CD2 3.5Å; D512-C515 HydrophobicContact CB-CB 4.24Å; D512-C515 PolarHBondContact O-N 2.94Å; D512-Q538 PolarHBondContact O-NE2 3.15Å
513	P	92.9	Very high	91	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-26.7	-179.5	-29.6	36.7	0	0	0	116.4	V421 Y428 V430 L444 L456 R511 C515 Q538 I540	V421-P513 HydrophobicContact CB-CB 4.11Å; V421-P513 HydrophobicContact CG1-CB 3.98Å; Y428-P513 HydrophobicContact CD2-CB 4.16Å; Y428-P513 HydrophobicContact CG-CB 4.2Å; Y428-P513 HydrophobicContact CG-CG 4.19Å; V430-P513 HydrophobicContact CG2-CB 4.13Å; V430-P513 HydrophobicContact CG2-CG 3.82Å; L444-P513 HydrophobicContact CD1-CG 3.75Å; L456-P513 VanDerWaalsContact CD1-CD 3.49Å; L456-P513 HydrophobicContact CD1-CG 4.3Å; R511-P513 WeakPolarHBondContact O-CD 3.06Å; P513-C515 VanDerWaalsContact C-N 3.28Å; P513-C515 PolarHBondContact O-N 3.17Å; P513-Q538 PolarHBondContact O-NE2 3Å; P513-I540 HydrophobicContact CB-CD1 4.03Å; P513-I540 HydrophobicContact CG-CD1 3.86Å
514	Y	93.3	Very high	91.2	Very high	7 Å²	7	40.7 Å²	40.7	3%	0.027	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-18.7	176.7	-62.1	-98.2	0	0	0	113	D419 V421 V430 Y432 R480 L495 E496 D512 T526	D419-Y514 WeakPolarHBondContact CB-OH 3.41Å; D419-Y514 PolarHBondContact OD2-OH 2.86Å; V421-Y514 HydrophobicContact CG1-CD1 3.87Å; V421-Y514 HydrophobicContact CG1-CD2 4.2Å; V421-Y514 HydrophobicContact CG1-CE1 4.11Å; V421-Y514 HydrophobicContact CG1-CE2 4.42Å; V421-Y514 HydrophobicContact CG1-CG 3.94Å; V421-Y514 HydrophobicContact CG2-CD1 4.31Å; V421-Y514 HydrophobicContact CG2-CD2 4.2Å; V421-Y514 HydrophobicContact CG2-CE1 3.73Å; V421-Y514 HydrophobicContact CG2-CE2 3.61Å; V430-Y514 HydrophobicContact CB-CE2 4.37Å; V430-Y514 HydrophobicContact CG1-CE2 4.31Å; V430-Y514 HydrophobicContact CG2-CE2 4.17Å; Y432-Y514 WeakPolarHBondContact OH-CE2 2.92Å; Y432-Y514 PolarHBondContact OH-OH 3.19Å; Y432-Y514 VanDerWaalsContact OH-OH 3.05Å; R480-Y514 HydrophobicContact CG-CE1 4.42Å; L495-Y514 HydrophobicContact CB-CE1 4.03Å; E496-Y514 HydrophobicContact CB-CD1 3.89Å; E496-Y514 HydrophobicContact CB-CG 4.03Å; D512-Y514 PolarHBondContact O-N 3.18Å; D512-Y514 VanDerWaalsContact O-N 3.1Å; D512-Y514 WeakPolarHBondContact OD1-CD2 3.5Å; Y514-T526 WeakPolarHBondContact O-CA 3.48Å
515	C	93.8	Very high	91.4	Very high	3 Å²	3	36.6 Å²	36.6	2%	0.02	19%	0.192	C	C	.	.			trans	-122.3	142.2	-161.8	-57.8	0	0	0	0	113.5	C498 D512 P513 Q538	C498-C515 WeakPolarHBondContact CA-SG 3.36Å; C498-C515 HydrophobicContact CB-CB 3.73Å; C498-C515 WeakPolarHBondContact CB-SG 3.5Å; C498-C515 WeakPolarHBondContact SG-CA 3.43Å; C498-C515 WeakPolarHBondContact SG-CB 3.47Å; C498-C515 CovalentContact SG-SG 2.04Å; C498-C515 PolarHBondContact SG-SG 3.04Å; D512-C515 HydrophobicContact CB-CB 4.24Å; D512-C515 PolarHBondContact O-N 2.94Å; P513-C515 VanDerWaalsContact C-N 3.28Å; P513-C515 PolarHBondContact O-N 3.17Å; C515-Q538 WeakPolarHBondContact O-CG 3.14Å; C515-Q538 PolarHBondContact O-NE2 2.86Å
516	G	93.4	Very high	91.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	159.5	173.8	0	0	0	0	0	112	T525 W536 T537	G516-T525 PolarHBondContact N-O 2.98Å; G516-T525 PolarHBondContact O-N 2.93Å; G516-T525 VanDerWaalsContact O-O 3.07Å; G516-T525 PolarHBondContact O-OG1 3.44Å; G516-T525 VanDerWaalsContact O-OG1 3.13Å; G516-W536 VanDerWaalsContact CA-CE2 3.48Å; G516-W536 VanDerWaalsContact CA-CZ2 3.45Å; G516-W536 VanDerWaalsContact N-CZ2 3.25Å; G516-W536 PolarHBondContact O-NE1 2.99Å; G516-T537 CarbonylContact C-O 3.57Å; G516-T537 VanDerWaalsContact CA-O 3.31Å; G516-T537 WeakPolarHBondContact CA-O 3.47Å
517	W	94.8	Very high	91.7	Very high	14 Å²	14	32.3 Å²	32.3	5%	0.053	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	113.1	-174.8	-174.6	-112.7	0	0	0	110.5	E504 C507 L508 S519 K522 R523 C524 W536 T537	E504-W517 HydrophobicContact CB-CD2 3.88Å; E504-W517 HydrophobicContact CB-CE3 4.41Å; E504-W517 HydrophobicContact CB-CG 4.2Å; E504-W517 HydrophobicContact CB-CH2 4.41Å; E504-W517 HydrophobicContact CB-CZ2 3.85Å; E504-W517 VanDerWaalsContact CG-CD1 3.47Å; E504-W517 HydrophobicContact CG-CD2 4.06Å; E504-W517 HydrophobicContact CG-CG 3.83Å; E504-W517 PolarHBondContact OE2-NE1 3.12Å; C507-W517 HydrophobicContact CB-CE3 3.93Å; C507-W517 PolarHBondContact SG-N 2.92Å; L508-W517 HydrophobicContact CD2-CB 4.37Å; W517-S519 PolarHBondContact O-N 3.12Å; W517-K522 WeakPolarHBondContact CH2-O 3.14Å; W517-R523 VanDerWaalsContact CE3-C 3.4Å; W517-R523 VanDerWaalsContact CZ3-C 3.45Å; W517-C524 HydrophobicContact CE3-CB 4.21Å; W517-W536 WeakPolarHBondContact O-CA 3.4Å; W517-T537 PolarHBondContact N-O 3.22Å; W517-T537 PolarHBondContact O-N 2.73Å
518	D	93.6	Very high	91.5	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	104.4	171	-176	-42.4	0	0	0	108.7	K520 Q521 K522 R523 T525 S530 S531	D518-K520 PolarHBondContact O-N 2.86Å; D518-K520 VanDerWaalsContact O-N 3.1Å; D518-K520 WeakPolarHBondContact OD1-CA 3.45Å; D518-K520 WeakPolarHBondContact OD1-CB 3.38Å; D518-K520 PolarHBondContact OD1-N 2.8Å; D518-Q521 HydrophobicContact CB-CB 4.02Å; D518-Q521 HydrophobicContact CB-CG 4.25Å; D518-Q521 PolarHBondContact O-N 3.05Å; D518-Q521 PolarHBondContact OD1-N 3.32Å; D518-Q521 PolarHBondContact OD2-NE2 2.94Å; D518-K522 PolarHBondContact O-N 3.41Å; D518-R523 PolarHBondContact N-O 3.25Å; D518-T525 HydrophobicContact CB-CG2 4.22Å; D518-S530 WeakPolarHBondContact OD2-CA 3.01Å; D518-S530 PolarHBondContact OD2-OG 2.92Å; D518-S531 PolarHBondContact OD2-N 3.11Å; D518-S531 PolarHBondContact OD2-OG 2.99Å
519	S	90.9	Very high	91.3	Very high	35 Å²	35	40.9 Å²	40.9	25%	0.245	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-13.7	-175.1	-57.3	0	0	0	0	113.9	W517 K522 L535	W517-S519 PolarHBondContact O-N 3.12Å; S519-K522 WeakPolarHBondContact O-CD 2.95Å; S519-K522 WeakPolarHBondContact O-CE 3.19Å; S519-K522 PolarHBondContact O-NZ 3.27Å; S519-L535 VanDerWaalsContact CB-O 3.28Å; S519-L535 WeakPolarHBondContact CB-O 3.48Å; S519-L535 PolarHBondContact N-O 2.8Å; S519-L535 PolarHBondContact OG-O 3.03Å
520	K	89.4	Confident	91.2	Very high	124 Å²	124	40.1 Å²	40.1	54%	0.539	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-37.7	177.4	164.1	-177	160.9	-151.3	0	111.5	D518 S531 L535	D518-K520 PolarHBondContact O-N 2.86Å; D518-K520 VanDerWaalsContact O-N 3.1Å; D518-K520 WeakPolarHBondContact OD1-CA 3.45Å; D518-K520 WeakPolarHBondContact OD1-CB 3.38Å; D518-K520 PolarHBondContact OD1-N 2.8Å; K520-S531 VanDerWaalsContact CD-OG 3.31Å; K520-S531 WeakPolarHBondContact CD-OG 3.28Å; K520-S531 VanDerWaalsContact CE-OG 3.24Å; K520-S531 WeakPolarHBondContact CE-OG 3.48Å; K520-S531 PolarHBondContact NZ-O 2.8Å; K520-S531 PolarHBondContact NZ-OG 3.45Å; K520-L535 HydrophobicContact CB-CD1 3.98Å; K520-L535 HydrophobicContact CD-CD1 4.43Å
521	Q	90.1	Very high	90.8	Very high	56 Å²	56	42.2 Å²	42.2	26%	0.262	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-16.4	174.4	-62.3	-175.9	55.1	0	0	113.6	D518 R523 D529 S531	D518-Q521 HydrophobicContact CB-CB 4.02Å; D518-Q521 HydrophobicContact CB-CG 4.25Å; D518-Q521 PolarHBondContact O-N 3.05Å; D518-Q521 PolarHBondContact OD1-N 3.32Å; D518-Q521 PolarHBondContact OD2-NE2 2.94Å; Q521-R523 VanDerWaalsContact C-N 3.25Å; Q521-R523 HydrophobicContact CB-CG 3.98Å; Q521-R523 PolarHBondContact O-N 2.86Å; Q521-R523 VanDerWaalsContact OE1-CZ 3.23Å; Q521-D529 PolarHBondContact NE2-O 3.18Å; Q521-S531 VanDerWaalsContact NE2-N 3.16Å
522	K	91.3	Very high	90.5	Very high	135 Å²	135	43.5 Å²	43.5	59%	0.587	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.6	36.9	-177.5	-60.3	-56.4	-170.9	-161.9	0	113.7	W517 D518 S519	W517-K522 WeakPolarHBondContact CH2-O 3.14Å; D518-K522 PolarHBondContact O-N 3.41Å; S519-K522 WeakPolarHBondContact O-CD 2.95Å; S519-K522 WeakPolarHBondContact O-CE 3.19Å; S519-K522 PolarHBondContact O-NZ 3.27Å
523	R	93.4	Very high	90	Very high	120 Å²	120	49 Å²	49	45%	0.453	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	157	174.9	68	-175.7	-177.5	132.9	7.5	110.5	W517 D518 Q521 T525	W517-R523 VanDerWaalsContact CE3-C 3.4Å; W517-R523 VanDerWaalsContact CZ3-C 3.45Å; D518-R523 PolarHBondContact N-O 3.25Å; Q521-R523 VanDerWaalsContact C-N 3.25Å; Q521-R523 HydrophobicContact CB-CG 3.98Å; Q521-R523 PolarHBondContact O-N 2.86Å; Q521-R523 VanDerWaalsContact OE1-CZ 3.23Å; R523-T525 HydrophobicContact CG-CG2 3.81Å
524	C	94.5	Very high	89.6	Confident	4 Å²	4	53.2 Å²	53.2	3%	0.027	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	138.3	169.4	-158.8	0	0	0	0	109.4	C498 Y501 C507 W517	C498-C524 HydrophobicContact CB-CB 4.47Å; C498-C524 VanDerWaalsContact O-CB 3.28Å; C498-C524 WeakPolarHBondContact O-CB 3.44Å; Y501-C524 WeakPolarHBondContact O-CB 3.31Å; C507-C524 HydrophobicContact CB-CB 3.61Å; C507-C524 WeakPolarHBondContact CB-SG 3.42Å; C507-C524 VanDerWaalsContact SG-CA 3.59Å; C507-C524 WeakPolarHBondContact SG-CB 3.41Å; C507-C524 CovalentContact SG-SG 2.04Å; C507-C524 PolarHBondContact SG-SG 3.25Å; W517-C524 HydrophobicContact CE3-CB 4.21Å
525	T	93.6	Very high	89.4	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.012	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	160.2	-168.7	47.8	0	0	0	0	110.9	G516 D518 R523 D529 W536	G516-T525 PolarHBondContact N-O 2.98Å; G516-T525 PolarHBondContact O-N 2.93Å; G516-T525 VanDerWaalsContact O-O 3.07Å; G516-T525 PolarHBondContact O-OG1 3.44Å; G516-T525 VanDerWaalsContact O-OG1 3.13Å; D518-T525 HydrophobicContact CB-CG2 4.22Å; R523-T525 HydrophobicContact CG-CG2 3.81Å; T525-D529 HydrophobicContact CG2-CB 4.24Å; T525-W536 PolarHBondContact OG1-NE1 2.8Å
526	T	92.3	Very high	89.3	Confident	8 Å²	8	56.2 Å²	56.2	5%	0.049	29%	0.285	C	S	.	.			trans	-70.8	169.5	161.3	66.8	0	0	0	0	110.4	E496 Y514 E528 D529 S530 W536	E496-T526 VanDerWaalsContact CD-CG2 3.49Å; E496-T526 WeakPolarHBondContact OE1-CG2 3.49Å; E496-T526 WeakPolarHBondContact OE2-CG2 3.24Å; Y514-T526 WeakPolarHBondContact O-CA 3.48Å; T526-E528 PolarHBondContact O-N 2.9Å; T526-E528 PolarHBondContact OG1-N 3.19Å; T526-D529 WeakPolarHBondContact OG1-CB 3.41Å; T526-D529 PolarHBondContact OG1-N 3.1Å; T526-S530 PolarHBondContact O-N 2.82Å; T526-W536 PolarHBondContact O-NE1 2.68Å
527	I	89.6	Confident	89.2	Confident	41 Å²	41	58.8 Å²	58.8	21%	0.21	30%	0.301	C	S	.	.	S	Bend	trans	-66.7	-28.2	174.1	-165.9	167.7	0	0	0	112.2	Q422 M533 W536	Q422-I527 HydrophobicContact CG-CD1 4.46Å; I527-M533 HydrophobicContact CD1-SD 4.43Å; I527-W536 HydrophobicContact CB-CH2 3.89Å; I527-W536 HydrophobicContact CB-CZ2 3.97Å; I527-W536 HydrophobicContact CB-CZ3 4.3Å; I527-W536 HydrophobicContact CD1-CZ3 4.24Å; I527-W536 HydrophobicContact CG1-CE3 4.44Å; I527-W536 HydrophobicContact CG1-CH2 4.36Å; I527-W536 HydrophobicContact CG1-CZ3 4.25Å
528	E	87.8	Confident	89.1	Confident	131 Å²	131	59.3 Å²	59.3	61%	0.612	30%	0.304	S	S	*	.	S	Bend	trans	-80.8	-34.5	179.6	-69.2	156	168.8	0	0	112.8	R480 T526 S530	R480-E528 IonicContact CZ-OE1 2.82Å; R480-E528 IonicContact CZ-OE2 2.91Å; R480-E528 IonicContact NH1-OE2 2.74Å; R480-E528 PolarHBondContact NH1-OE2 2.83Å; R480-E528 IonicContact NH2-OE1 3.34Å; R480-E528 PolarHBondContact NH2-OE1 3.34Å; R480-E528 IonicContact NH2-OE2 3.91Å; R480-E528 PolarHBondContact NH2-OE2 2.84Å; T526-E528 PolarHBondContact O-N 2.9Å; T526-E528 PolarHBondContact OG1-N 3.19Å; E528-S530 PolarHBondContact O-N 2.8Å
529	D	87.1	Confident	88.8	Confident	90 Å²	90	62.4 Å²	62.4	48%	0.481	32%	0.321	S	S	.	.	S	Bend	trans	-72.9	-9.7	173.2	-86.4	-20.6	0	0	0	113.2	Q521 T525 T526	Q521-D529 PolarHBondContact NE2-O 3.18Å; T525-D529 HydrophobicContact CG2-CB 4.24Å; T526-D529 WeakPolarHBondContact OG1-CB 3.41Å; T526-D529 PolarHBondContact OG1-N 3.1Å
530	S	85.3	Confident	88.5	Confident	22 Å²	22	61.1 Å²	61.1	15%	0.154	31%	0.311	C	S	.	.			trans	-72.9	135.4	-176.6	-173.4	0	0	0	0	112.3	D518 T526 E528 N532	D518-S530 WeakPolarHBondContact OD2-CA 3.01Å; D518-S530 PolarHBondContact OD2-OG 2.92Å; T526-S530 PolarHBondContact O-N 2.82Å; E528-S530 PolarHBondContact O-N 2.8Å; S530-N532 PolarHBondContact OG-N 3.46Å
531	S	78.2	Confident	88.1	Confident	52 Å²	52	59.5 Å²	59.5	36%	0.364	31%	0.312	S	S	.	.	S	Bend	trans	-89.1	-4	-178.2	75.9	0	0	0	0	113.5	D518 K520 Q521	D518-S531 PolarHBondContact OD2-N 3.11Å; D518-S531 PolarHBondContact OD2-OG 2.99Å; K520-S531 VanDerWaalsContact CD-OG 3.31Å; K520-S531 WeakPolarHBondContact CD-OG 3.28Å; K520-S531 VanDerWaalsContact CE-OG 3.24Å; K520-S531 WeakPolarHBondContact CE-OG 3.48Å; K520-S531 PolarHBondContact NZ-O 2.8Å; K520-S531 PolarHBondContact NZ-OG 3.45Å; Q521-S531 VanDerWaalsContact NE2-N 3.16Å
532	N	82.6	Confident	87.7	Confident	64 Å²	64	62.4 Å²	62.4	34%	0.342	33%	0.325	S	S	.	.			trans	-171.1	108.4	170	179.4	9	0	0	0	110.5	S530 S534 L535 W536	S530-N532 PolarHBondContact OG-N 3.46Å; N532-S534 PolarHBondContact ND2-OG 2.77Å; N532-S534 PolarHBondContact O-N 2.86Å; N532-S534 VanDerWaalsContact O-N 3.09Å; N532-S534 PolarHBondContact OD1-N 2.63Å; N532-S534 VanDerWaalsContact OD1-N 3.13Å; N532-S534 PolarHBondContact OD1-OG 3.49Å; N532-S534 VanDerWaalsContact OD1-OG 3.04Å; N532-L535 HydrophobicContact CB-CB 4.46Å; N532-L535 HydrophobicContact CB-CD1 4.4Å; N532-L535 PolarHBondContact O-N 2.91Å; N532-W536 PolarHBondContact O-N 2.87Å
533	M	82.9	Confident	87.4	Confident	120 Å²	120	57.5 Å²	57.5	59%	0.591	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-57.8	-24.4	-179	-167.1	172.8	72.8	0	0	114.6	I527 L535 W536	I527-M533 HydrophobicContact CD1-SD 4.43Å; M533-L535 VanDerWaalsContact C-N 3.3Å; M533-L535 PolarHBondContact O-N 2.84Å; M533-W536 PolarHBondContact O-N 2.8Å
534	S	84.6	Confident	86.9	Confident	89 Å²	89	52.3 Å²	52.3	62%	0.622	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-74.7	-18.8	175.3	71.3	0	0	0	0	113.9	N532	N532-S534 PolarHBondContact ND2-OG 2.77Å; N532-S534 PolarHBondContact O-N 2.86Å; N532-S534 VanDerWaalsContact O-N 3.09Å; N532-S534 PolarHBondContact OD1-N 2.63Å; N532-S534 VanDerWaalsContact OD1-N 3.13Å; N532-S534 PolarHBondContact OD1-OG 3.49Å; N532-S534 VanDerWaalsContact OD1-OG 3.04Å
535	L	87.6	Confident	85.8	Confident	73 Å²	73	55.8 Å²	55.8	38%	0.382	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-103.8	1.8	174.9	-61.2	177	0	0	0	112.8	S519 K520 N532 M533	S519-L535 VanDerWaalsContact CB-O 3.28Å; S519-L535 WeakPolarHBondContact CB-O 3.48Å; S519-L535 PolarHBondContact N-O 2.8Å; S519-L535 PolarHBondContact OG-O 3.03Å; K520-L535 HydrophobicContact CB-CD1 3.98Å; K520-L535 HydrophobicContact CD-CD1 4.43Å; N532-L535 HydrophobicContact CB-CB 4.46Å; N532-L535 HydrophobicContact CB-CD1 4.4Å; N532-L535 PolarHBondContact O-N 2.91Å; M533-L535 VanDerWaalsContact C-N 3.3Å; M533-L535 PolarHBondContact O-N 2.84Å
536	W	92.8	Very high	84.4	Confident	1 Å²	1	59 Å²	59	0%	0.004	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	123.8	172.7	-162.8	79	0	0	0	109.7	K424 G516 W517 T525 T526 I527 N532 M533 Q538	K424-W536 HydrophobicContact CB-CE3 4.11Å; K424-W536 HydrophobicContact CB-CZ3 3.83Å; K424-W536 HydrophobicContact CD-CE3 4.47Å; K424-W536 WeakPolarHBondContact CE-O 3.47Å; K424-W536 HydrophobicContact CG-CE3 4.31Å; K424-W536 HydrophobicContact CG-CZ3 4.5Å; K424-W536 PolarHBondContact NZ-O 3.47Å; G516-W536 VanDerWaalsContact CA-CE2 3.48Å; G516-W536 VanDerWaalsContact CA-CZ2 3.45Å; G516-W536 VanDerWaalsContact N-CZ2 3.25Å; G516-W536 PolarHBondContact O-NE1 2.99Å; W517-W536 WeakPolarHBondContact O-CA 3.4Å; T525-W536 PolarHBondContact OG1-NE1 2.8Å; T526-W536 PolarHBondContact O-NE1 2.68Å; I527-W536 HydrophobicContact CB-CH2 3.89Å; I527-W536 HydrophobicContact CB-CZ2 3.97Å; I527-W536 HydrophobicContact CB-CZ3 4.3Å; I527-W536 HydrophobicContact CD1-CZ3 4.24Å; I527-W536 HydrophobicContact CG1-CE3 4.44Å; I527-W536 HydrophobicContact CG1-CH2 4.36Å; I527-W536 HydrophobicContact CG1-CZ3 4.25Å; N532-W536 PolarHBondContact O-N 2.87Å; M533-W536 PolarHBondContact O-N 2.8Å; W536-Q538 HydrophobicContact CE3-CB 4.19Å; W536-Q538 HydrophobicContact CH2-CB 4.17Å; W536-Q538 HydrophobicContact CH2-CG 4.43Å; W536-Q538 HydrophobicContact CZ3-CB 3.73Å; W536-Q538 HydrophobicContact CZ3-CG 4.36Å
537	T	91.4	Very high	83	Confident	54 Å²	54	65.3 Å²	65.3	33%	0.331	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	130.2	-177.6	-58.6	0	0	0	0	110.2	L508 G516 W517	L508-T537 HydrophobicContact CD1-CG2 4.31Å; L508-T537 HydrophobicContact CD2-CG2 3.99Å; L508-T537 VanDerWaalsContact CD2-O 3.26Å; L508-T537 WeakPolarHBondContact CD2-O 3.05Å; G516-T537 CarbonylContact C-O 3.57Å; G516-T537 VanDerWaalsContact CA-O 3.31Å; G516-T537 WeakPolarHBondContact CA-O 3.47Å; W517-T537 PolarHBondContact N-O 3.22Å; W517-T537 PolarHBondContact O-N 2.73Å
538	Q	92.2	Very high	81.4	Confident	25 Å²	25	65 Å²	65	12%	0.117	36%	0.356	C	S	.	.			trans	-138.9	147.5	176.1	-176.6	178.7	63.5	0	0	107.6	G423 K424 D512 P513 C515 W536 I540	G423-Q538 VanDerWaalsContact CA-OE1 3.24Å; K424-Q538 HydrophobicContact CB-CB 4.33Å; D512-Q538 PolarHBondContact O-NE2 3.15Å; P513-Q538 PolarHBondContact O-NE2 3Å; C515-Q538 WeakPolarHBondContact O-CG 3.14Å; C515-Q538 PolarHBondContact O-NE2 2.86Å; W536-Q538 HydrophobicContact CE3-CB 4.19Å; W536-Q538 HydrophobicContact CH2-CB 4.17Å; W536-Q538 HydrophobicContact CH2-CG 4.43Å; W536-Q538 HydrophobicContact CZ3-CB 3.73Å; W536-Q538 HydrophobicContact CZ3-CG 4.36Å; Q538-I540 HydrophobicContact CG-CD1 4.04Å; Q538-I540 HydrophobicContact CG-CG1 3.97Å
539	N	87.1	Confident	80.1	Confident	65 Å²	65	62.9 Å²	62.9	35%	0.348	35%	0.352	S	S	.	.			trans	-150.2	114.6	177.6	178.1	-1.3	0	0	0	110.7	R511 T541	R511-N539 WeakPolarHBondContact CD-O 3.29Å; R511-N539 PolarHBondContact NH1-ND2 3.04Å; R511-N539 PolarHBondContact NH1-O 3.04Å; R511-N539 PolarHBondContact NH1-OD1 3.09Å; N539-T541 PolarHBondContact OD1-N 2.89Å; N539-T541 VanDerWaalsContact OD1-N 3.14Å; N539-T541 PolarHBondContact OD1-OG1 2.64Å; N539-T541 VanDerWaalsContact OD1-OG1 3.05Å
540	I	85.1	Confident	79.2	Confident	8 Å²	8	60.5 Å²	60.5	4%	0.041	34%	0.341	C	S	.	.			trans	-125.4	30.1	-175.4	-36.8	-176.1	0	0	0	110.6	Y428 L444 L451 R511 P513 Q538 E542	Y428-I540 HydrophobicContact CD2-CD1 4.2Å; Y428-I540 HydrophobicContact CE1-CB 4.44Å; Y428-I540 HydrophobicContact CE1-CD1 4.45Å; Y428-I540 HydrophobicContact CE1-CG2 4.45Å; Y428-I540 HydrophobicContact CE2-CD1 3.79Å; L444-I540 HydrophobicContact CD2-CG2 4.21Å; L451-I540 WeakPolarHBondContact CD1-O 3.33Å; R511-I540 WeakPolarHBondContact O-CG2 3.35Å; P513-I540 HydrophobicContact CB-CD1 4.03Å; P513-I540 HydrophobicContact CG-CD1 3.86Å; Q538-I540 HydrophobicContact CG-CD1 4.04Å; Q538-I540 HydrophobicContact CG-CG1 3.97Å; I540-E542 VanDerWaalsContact C-N 3.27Å; I540-E542 PolarHBondContact O-N 3.38Å
541	T	81.2	Confident	78.7	Confident	90 Å²	90	64.1 Å²	64.1	55%	0.552	36%	0.359	S	S	*	.	S	Bend	trans	-75.2	-17.9	178.2	60.7	0	0	0	0	113.3	N539	N539-T541 PolarHBondContact OD1-N 2.89Å; N539-T541 VanDerWaalsContact OD1-N 3.14Å; N539-T541 PolarHBondContact OD1-OG1 2.64Å; N539-T541 VanDerWaalsContact OD1-OG1 3.05Å
542	E	82.3	Confident	78.7	Confident	116 Å²	116	62.3 Å²	62.3	54%	0.542	35%	0.348	S	S	.	.	S	Bend	trans	-137.6	155.4	-177	-59.7	176.7	146	0	0	110.4	L451 R511 I540	L451-E542 VanDerWaalsContact CD2-C 3.43Å; R511-E542 VanDerWaalsContact CD-O 3.24Å; R511-E542 WeakPolarHBondContact CD-O 3.29Å; R511-E542 VanDerWaalsContact CG-O 3.25Å; R511-E542 WeakPolarHBondContact CG-O 3.43Å; R511-E542 PolarHBondContact NE-O 3.18Å; R511-E542 IonicContact NH2-OE2 3.46Å; R511-E542 PolarHBondContact NH2-OE2 3.1Å; I540-E542 VanDerWaalsContact C-N 3.27Å; I540-E542 PolarHBondContact O-N 3.38Å
543	C	83.8	Confident	78.6	Confident	33 Å²	33	67.7 Å²	67.7	22%	0.223	36%	0.364	C	S	.	.			trans	-71.1	153.4	173	-59.1	0	0	0	0	112.2	C454	C454-C543 VanDerWaalsContact CA-SG 3.57Å; C454-C543 HydrophobicContact CB-CB 4.32Å; C454-C543 WeakPolarHBondContact CB-SG 3.46Å; C454-C543 WeakPolarHBondContact SG-CA 3.09Å; C454-C543 WeakPolarHBondContact SG-CB 3.41Å; C454-C543 CovalentContact SG-SG 2.03Å; C454-C543 PolarHBondContact SG-SG 3.41Å
544	P	82.6	Confident	78.6	Confident	10 Å²	10	63.3 Å²	63.3	7%	0.065	34%	0.342	C	S	.	.			trans	-67	140.7	170.3	28.6	-30.2	0	0	0	109.2	P46 Y455 L456 G509 R511	P46-P544 HydrophobicContact CG-CB 4.35Å; P46-P544 HydrophobicContact CG-CG 4.42Å; Y455-P544 WeakPolarHBondContact O-CG 3.45Å; L456-P544 WeakPolarHBondContact O-CG 3.45Å; G509-P544 WeakPolarHBondContact O-CB 3.49Å; R511-P544 HydrophobicContact CB-CB 4.46Å; R511-P544 HydrophobicContact CB-CG 4.44Å; R511-P544 HydrophobicContact CG-CB 4.06Å; R511-P544 HydrophobicContact CG-CG 4.47Å
545	V	71.4	Confident	78.5	Confident	77 Å²	77	59.3 Å²	59.3	47%	0.467	32%	0.315	S	S	.	.			trans	-125.1	123.7	178.8	-177.1	0	0	0	0	108.4	N547	V545-N547 PolarHBondContact O-N 3.34Å
546	K	65.8	Low	78.4	Confident	71 Å²	71	61.2 Å²	61.2	31%	0.309	33%	0.332	S	S	.	.			trans	-67.7	119.2	173.7	-171	177.2	179.6	-175.2	0	109.2	E44 L548	E44-K546 HydrophobicContact CB-CB 4.09Å; E44-K546 HydrophobicContact CB-CD 3.87Å; E44-K546 WeakPolarHBondContact O-CB 2.99Å; E44-K546 PolarHBondContact O-N 3.34Å; E44-K546 WeakPolarHBondContact OE2-CD 3.39Å; E44-K546 IonicContact OE2-NZ 2.75Å; E44-K546 PolarHBondContact OE2-NZ 2.82Å; K546-L548 HydrophobicContact CD-CD2 4.32Å; K546-L548 HydrophobicContact CG-CD2 4.33Å; K546-L548 PolarHBondContact O-N 2.93Å
547	N	61	Low	78.1	Confident	140 Å²	140	64.6 Å²	64.6	75%	0.749	35%	0.345	S	S	*	.			trans	-68.7	93.9	176	-78.2	-31.3	0	0	0	110.2	V545 T549	V545-N547 PolarHBondContact O-N 3.34Å; N547-T549 PolarHBondContact O-N 3.36Å
548	L	57.4	Low	77.8	Confident	35 Å²	35	63.6 Å²	63.6	18%	0.183	34%	0.34	C	S	.	.			trans	-68.2	-11.6	-179.7	-59.8	177.6	0	0	0	113.6	Q39 K546 T550 C588	Q39-L548 WeakPolarHBondContact O-CD1 3.31Å; K546-L548 HydrophobicContact CD-CD2 4.32Å; K546-L548 HydrophobicContact CG-CD2 4.33Å; K546-L548 PolarHBondContact O-N 2.93Å; L548-T550 PolarHBondContact O-N 2.91Å; L548-T550 PolarHBondContact O-OG1 3.44Å; L548-C588 HydrophobicContact CB-CB 4.11Å; L548-C588 VanDerWaalsContact CB-SG 3.6Å
549	T	59.9	Low	77.4	Confident	85 Å²	85	67.2 Å²	67.2	52%	0.521	37%	0.366	S	S	.	.			trans	-56.3	95.9	174.4	50.7	0	0	0	0	111.5	N547 C588	N547-T549 PolarHBondContact O-N 3.36Å; T549-C588 WeakPolarHBondContact CG2-O 3.37Å
550	T	67.9	Low	77.2	Confident	41 Å²	41	68.6 Å²	68.6	25%	0.252	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-105.1	118.4	178.4	-53.2	0	0	0	0	108.8	L548 P584 P586 R587 G590	L548-T550 PolarHBondContact O-N 2.91Å; L548-T550 PolarHBondContact O-OG1 3.44Å; T550-P584 HydrophobicContact CG2-CB 3.99Å; T550-P584 HydrophobicContact CG2-CG 3.63Å; T550-P586 CarbonylContact O-C 3.52Å; T550-P586 VanDerWaalsContact O-CA 3.25Å; T550-P586 WeakPolarHBondContact O-CA 3.46Å; T550-R587 PolarHBondContact N-O 3.44Å; T550-R587 PolarHBondContact O-N 3.09Å; T550-G590 WeakPolarHBondContact O-CA 3.28Å
551	N	75.1	Confident	76.8	Confident	98 Å²	98	74.4 Å²	74.4	52%	0.524	39%	0.393	S	S	.	.			trans	-75.2	136.1	174	-68.3	-47.3	0	0	0	110.5	R591	N551-R591 PolarHBondContact OD1-N 2.85Å
552	G	78	Confident	76.2	Confident	14 Å²	14	76.4 Å²	76.4	14%	0.144	40%	0.4	C	S	.	.			trans	-71.6	134.6	178	0	0	0	0	0	112.2	P584 R591	G552-P584 WeakPolarHBondContact CA-O 3.1Å; G552-R591 PolarHBondContact N-O 3.43Å
553	R	81.8	Confident	75.6	Confident	177 Å²	177	72.7 Å²	72.7	67%	0.668	39%	0.386	S	S	*	.			trans	-125.1	138.4	170.8	168.8	-178.1	-80.7	175.8	-5.7	110	D582 S583 P584 C593	R553-D582 PolarHBondContact O-N 3.35Å; R553-S583 WeakPolarHBondContact CB-O 3.44Å; R553-S583 WeakPolarHBondContact CD-O 3.22Å; R553-S583 WeakPolarHBondContact CG-O 3.32Å; R553-S583 PolarHBondContact O-N 2.87Å; R553-P584 PolarHBondContact N-O 3.48Å; R553-C593 PolarHBondContact N-SG 3.44Å; R553-C593 VanDerWaalsContact N-SG 3.37Å
554	L	82.5	Confident	74.4	Confident	27 Å²	27	80.9 Å²	80.9	14%	0.141	42%	0.421	C	S	.	.			trans	-65.3	135.1	176.1	-63.7	174.7	0	0	0	110.3	R579 S580 C581 C593 E594 R597	L554-R579 VanDerWaalsContact CD1-CZ 3.45Å; L554-S580 WeakPolarHBondContact CA-O 3.48Å; L554-C581 HydrophobicContact CD2-CB 4.28Å; L554-C593 HydrophobicContact CD2-CB 3.44Å; L554-C593 VanDerWaalsContact CD2-CB 3.44Å; L554-C593 HydrophobicContact CG-CB 3.8Å; L554-E594 WeakPolarHBondContact CD1-O 3.47Å; L554-R597 HydrophobicContact CD2-CG 4.36Å
555	G	81.9	Confident	73.2	Confident	6 Å²	6	84.6 Å²	84.6	6%	0.062	44%	0.437	C	S	.	.			trans	-68.4	178.1	171.4	0	0	0	0	0	113.1	S580 S583	G555-S580 PolarHBondContact N-O 3.26Å; G555-S583 WeakPolarHBondContact CA-OG 3.25Å
556	P	85.9	Confident	72.2	Confident	112 Å²	112	86.8 Å²	86.8	73%	0.727	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-59.9	152.9	173.5	27.7	-34.8	0	0	0	111.3	R579	P556-R579 WeakPolarHBondContact O-CB 3.32Å
557	W	85.5	Confident	71.3	Confident	73 Å²	73	86.8 Å²	86.8	28%	0.277	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-67.3	142.6	170.6	-75	114.3	0	0	0	111.3	R577 R579 A596 E599	W557-R577 HydrophobicContact CD2-CG 4.25Å; W557-R577 HydrophobicContact CE3-CB 4.41Å; W557-R577 HydrophobicContact CE3-CG 3.77Å; W557-R577 HydrophobicContact CZ3-CG 4.14Å; W557-R579 HydrophobicContact CD2-CB 4.37Å; W557-R579 HydrophobicContact CD2-CG 4.07Å; W557-R579 HydrophobicContact CE3-CB 3.96Å; W557-R579 HydrophobicContact CE3-CG 3.71Å; W557-R579 HydrophobicContact CH2-CG 4.2Å; W557-R579 HydrophobicContact CZ3-CB 4.42Å; W557-R579 HydrophobicContact CZ3-CG 3.78Å; W557-A596 WeakPolarHBondContact CH2-O 3.39Å; W557-E599 HydrophobicContact CH2-CB 3.72Å; W557-E599 HydrophobicContact CZ2-CB 4.28Å; W557-E599 VanDerWaalsContact CZ2-OE2 3.28Å; W557-E599 WeakPolarHBondContact CZ2-OE2 3.47Å; W557-E599 HydrophobicContact CZ3-CB 4.04Å
558	S	85.6	Confident	70.9	Confident	32 Å²	32	83.6 Å²	83.6	22%	0.224	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-59.7	161.1	163	76.7	0	0	0	0	111	R577 S578	S558-R577 WeakPolarHBondContact OG-CA 3.36Å; S558-R577 WeakPolarHBondContact OG-CB 3.05Å; S558-S578 WeakPolarHBondContact CB-O 3.49Å; S558-S578 PolarHBondContact N-O 2.78Å; S558-S578 PolarHBondContact OG-N 2.89Å; S558-S578 PolarHBondContact OG-O 2.63Å
559	P	84.3	Confident	70.6	Confident	102 Å²	102	89.7 Å²	89.7	66%	0.662	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-52.5	154.9	157.6	-22.6	34.4	0	0	0	111.2
560	W	81.9	Confident	70	Confident	94 Å²	94	90.8 Å²	90.8	36%	0.356	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-70	135	168	-67.7	102.3	0	0	0	110	M575 C576 R577 E599 A601	W560-M575 HydrophobicContact CB-CE 3.73Å; W560-M575 HydrophobicContact CE3-CB 4.08Å; W560-M575 WeakPolarHBondContact CZ3-O 3.31Å; W560-C576 WeakPolarHBondContact CA-O 3.44Å; W560-R577 HydrophobicContact CD2-CB 4.11Å; W560-R577 HydrophobicContact CD2-CG 3.98Å; W560-R577 HydrophobicContact CE3-CB 3.96Å; W560-R577 HydrophobicContact CE3-CG 3.82Å; W560-R577 HydrophobicContact CH2-CG 4Å; W560-R577 HydrophobicContact CZ2-CG 4.14Å; W560-R577 VanDerWaalsContact CZ2-CZ 3.5Å; W560-R577 HydrophobicContact CZ3-CB 4.4Å; W560-R577 HydrophobicContact CZ3-CG 3.84Å; W560-E599 HydrophobicContact CH2-CB 4.29Å; W560-E599 HydrophobicContact CH2-CG 3.87Å; W560-A601 HydrophobicContact CH2-CB 4.18Å; W560-A601 HydrophobicContact CZ3-CB 4.18Å
561	Q	77.3	Confident	69.3	Low	130 Å²	130	96.4 Å²	96.4	61%	0.607	54%	0.538	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130	151.1	178.7	-61.4	-177.1	-67.2	0	0	109.9	M575 C576	Q561-M575 WeakPolarHBondContact O-CA 3.36Å; Q561-C576 PolarHBondContact N-O 3.15Å; Q561-C576 PolarHBondContact O-N 3.01Å
562	L	68.9	Low	68.4	Low	132 Å²	132	93.9 Å²	93.9	69%	0.691	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.6	138	171.5	-75.4	163.4	0	0	0	109.9	M575	L562-M575 HydrophobicContact CD2-SD 3.85Å; L562-M575 HydrophobicContact CG-SD 3.99Å
563	C	69.8	Low	67.6	Low	37 Å²	37	97.1 Å²	97.1	25%	0.25	56%	0.555	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.6	129.7	177.2	43.1	0	0	0	0	109.7	C574 C576	C563-C574 PolarHBondContact N-O 2.97Å; C563-C574 WeakPolarHBondContact O-CB 3.42Å; C563-C574 VanDerWaalsContact SG-C 3.58Å; C563-C574 VanDerWaalsContact SG-CB 3.59Å; C563-C574 PolarHBondContact SG-O 2.8Å; C563-C574 VanDerWaalsContact SG-O 3.37Å; C563-C576 HydrophobicContact CB-CB 3.83Å; C563-C576 WeakPolarHBondContact CB-SG 3.25Å; C563-C576 WeakPolarHBondContact SG-CB 3.43Å; C563-C576 PolarHBondContact SG-N 3.29Å; C563-C576 VanDerWaalsContact SG-N 3.41Å; C563-C576 CovalentContact SG-SG 2.04Å; C563-C576 PolarHBondContact SG-SG 3.11Å
564	E	58.8	Low	67.1	Low	205 Å²	205	89.3 Å²	89.3	96%	0.958	53%	0.527	S	S	*	.			trans	-79.3	145.4	178.3	-65.8	-173.4	131.4	0	0	111.1
565	H	55.6	Low	66.9	Low	89 Å²	89	90.8 Å²	90.8	41%	0.412	53%	0.534	S	S	.	.			trans	-138.3	119.2	177.5	179	75.8	0	0	0	110	D567	H565-D567 IonicContact CD2-OD2 2.77Å; H565-D567 IonicContact CE1-OD2 3.25Å; H565-D567 VanDerWaalsContact NE2-CG 3.32Å; H565-D567 IonicContact NE2-OD2 3.7Å; H565-D567 PolarHBondContact NE2-OD2 3.07Å; H565-D567 PolarHBondContact O-N 3.25Å
566	S	51.7	Low	66.9	Low	122 Å²	122	92 Å²	92	85%	0.853	54%	0.542	S	S	*	.			trans	-91.2	66.6	-172.3	63.4	0	0	0	0	112.9
567	D	46.6	Very low	66.9	Low	71 Å²	71	89.4 Å²	89.4	38%	0.38	52%	0.517	S	S	.	.			trans	-109.4	127.8	159	-88.6	-42.5	0	0	0	108	H565 R639	H565-D567 IonicContact CD2-OD2 2.77Å; H565-D567 IonicContact CE1-OD2 3.25Å; H565-D567 VanDerWaalsContact NE2-CG 3.32Å; H565-D567 IonicContact NE2-OD2 3.7Å; H565-D567 PolarHBondContact NE2-OD2 3.07Å; H565-D567 PolarHBondContact O-N 3.25Å; D567-R639 IonicContact OD2-CZ 3.55Å; D567-R639 IonicContact OD2-NH1 3.46Å; D567-R639 PolarHBondContact OD2-NH1 2.76Å; D567-R639 IonicContact OD2-NH2 2.76Å
568	G	52.5	Low	66.9	Low	73 Å²	73	88.8 Å²	88.8	75%	0.753	52%	0.524	S	S	*	.	S	Bend	trans	-64.2	144.5	178.8	0	0	0	0	0	113
569	D	51.2	Low	66.9	Low	163 Å²	163	90.2 Å²	90.2	87%	0.872	53%	0.525	S	S	*	.	S	Bend	trans	53.3	72.5	179.3	-72.1	-19.7	0	0	0	116.6
570	S	47.7	Very low	66.9	Low	108 Å²	108	88.4 Å²	88.4	76%	0.755	51%	0.514	S	S	*	.				-174.1	145.2	117.9	30.3	0	0	0	0	112.9	G572	S570-G572 PolarHBondContact O-N 3.37Å
571	T	53.3	Low	66.7	Low	160 Å²	160	85 Å²	85	98%	0.982	51%	0.505	S	S	*	.			trans	-79.7	82.7	-176.3	36	0	0	0	0	113.1
572	G	55.7	Low	66.9	Low	44 Å²	44	81.4 Å²	81.4	45%	0.454	49%	0.49	S	S	.	.			trans	-114.4	114.2	169.4	0	0	0	0	0	112.3	S570 C574	S570-G572 PolarHBondContact O-N 3.37Å; G572-C574 PolarHBondContact O-N 3.16Å; G572-C574 VanDerWaalsContact O-N 3.12Å
573	S	62.1	Low	67	Low	82 Å²	82	77.7 Å²	77.7	57%	0.573	48%	0.475	S	S	*	.			trans	-77.2	96.1	175.6	44.1	0	0	0	0	111.2	M575	S573-M575 PolarHBondContact O-N 3.25Å
574	C	70.8	Confident	67	Low	13 Å²	13	78.8 Å²	78.8	9%	0.088	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	133.6	177	-57.8	0	0	0	0	110.2	C563 G572 C603	C563-C574 PolarHBondContact N-O 2.97Å; C563-C574 WeakPolarHBondContact O-CB 3.42Å; C563-C574 VanDerWaalsContact SG-C 3.58Å; C563-C574 VanDerWaalsContact SG-CB 3.59Å; C563-C574 PolarHBondContact SG-O 2.8Å; C563-C574 VanDerWaalsContact SG-O 3.37Å; G572-C574 PolarHBondContact O-N 3.16Å; G572-C574 VanDerWaalsContact O-N 3.12Å; C574-C603 WeakPolarHBondContact SG-CB 3.35Å
575	M	78.2	Confident	67.8	Low	58 Å²	58	77.1 Å²	77.1	29%	0.286	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	125.6	173.4	-73	-74.1	-89.1	0	0	109	W560 Q561 L562 S573 V600 A601	W560-M575 HydrophobicContact CB-CE 3.73Å; W560-M575 HydrophobicContact CE3-CB 4.08Å; W560-M575 WeakPolarHBondContact CZ3-O 3.31Å; Q561-M575 WeakPolarHBondContact O-CA 3.36Å; L562-M575 HydrophobicContact CD2-SD 3.85Å; L562-M575 HydrophobicContact CG-SD 3.99Å; S573-M575 PolarHBondContact O-N 3.25Å; M575-V600 CarbonylContact O-C 3.58Å; M575-V600 VanDerWaalsContact O-CA 3.31Å; M575-V600 WeakPolarHBondContact O-CA 3.49Å; M575-A601 PolarHBondContact N-O 2.65Å; M575-A601 VanDerWaalsContact N-O 3.11Å; M575-A601 PolarHBondContact O-N 3.27Å
576	C	82.4	Confident	68.8	Low	32 Å²	32	75.1 Å²	75.1	22%	0.216	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	146.8	-177.4	-66.1	0	0	0	0	111.2	W560 Q561 C563 E599	W560-C576 WeakPolarHBondContact CA-O 3.44Å; Q561-C576 PolarHBondContact N-O 3.15Å; Q561-C576 PolarHBondContact O-N 3.01Å; C563-C576 HydrophobicContact CB-CB 3.83Å; C563-C576 WeakPolarHBondContact CB-SG 3.25Å; C563-C576 WeakPolarHBondContact SG-CB 3.43Å; C563-C576 PolarHBondContact SG-N 3.29Å; C563-C576 VanDerWaalsContact SG-N 3.41Å; C563-C576 CovalentContact SG-SG 2.04Å; C563-C576 PolarHBondContact SG-SG 3.11Å; C576-E599 CarbonylContact C-O 3.48Å; C576-E599 WeakPolarHBondContact CA-O 3.44Å
577	R	84.7	Confident	69.8	Low	58 Å²	58	75.6 Å²	75.6	22%	0.219	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	154.9	163.7	65	176.4	-178.7	-163.9	-8.5	111.3	W557 S558 W560 I598 E599	W557-R577 HydrophobicContact CD2-CG 4.25Å; W557-R577 HydrophobicContact CE3-CB 4.41Å; W557-R577 HydrophobicContact CE3-CG 3.77Å; W557-R577 HydrophobicContact CZ3-CG 4.14Å; S558-R577 WeakPolarHBondContact OG-CA 3.36Å; S558-R577 WeakPolarHBondContact OG-CB 3.05Å; W560-R577 HydrophobicContact CD2-CB 4.11Å; W560-R577 HydrophobicContact CD2-CG 3.98Å; W560-R577 HydrophobicContact CE3-CB 3.96Å; W560-R577 HydrophobicContact CE3-CG 3.82Å; W560-R577 HydrophobicContact CH2-CG 4Å; W560-R577 HydrophobicContact CZ2-CG 4.14Å; W560-R577 VanDerWaalsContact CZ2-CZ 3.5Å; W560-R577 HydrophobicContact CZ3-CB 4.4Å; W560-R577 HydrophobicContact CZ3-CG 3.84Å; R577-I598 CarbonylContact O-C 3.5Å; R577-I598 WeakPolarHBondContact O-CA 3.17Å; R577-E599 HydrophobicContact CG-CB 3.96Å; R577-E599 IonicContact CZ-OE1 2.85Å; R577-E599 IonicContact CZ-OE2 3.59Å; R577-E599 PolarHBondContact N-O 3.13Å; R577-E599 IonicContact NE-OE1 3.55Å; R577-E599 IonicContact NE-OE2 3.37Å; R577-E599 PolarHBondContact NE-OE2 2.77Å; R577-E599 IonicContact NH2-OE1 3.93Å; R577-E599 PolarHBondContact NH2-OE1 3.34Å; R577-E599 IonicContact NH2-OE2 2.82Å; R577-E599 PolarHBondContact NH2-OE2 3.39Å; R577-E599 PolarHBondContact O-N 2.66Å
578	S	86.4	Confident	70.8	Confident	59 Å²	59	73.9 Å²	73.9	41%	0.413	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	162.5	-175.9	69	0	0	0	0	113	S558 R597	S558-S578 WeakPolarHBondContact CB-O 3.49Å; S558-S578 PolarHBondContact N-O 2.78Å; S558-S578 PolarHBondContact OG-N 2.89Å; S558-S578 PolarHBondContact OG-O 2.63Å; S578-R597 CarbonylContact C-O 3.59Å; S578-R597 WeakPolarHBondContact CA-O 3.21Å
579	R	85.5	Confident	71.3	Confident	63 Å²	63	74.4 Å²	74.4	24%	0.238	44%	0.443	C	S	.	.			trans	-151.9	142.3	171.4	60.1	-174.2	171.2	168.2	-0.7	112.5	L554 P556 W557 A596 R597	L554-R579 VanDerWaalsContact CD1-CZ 3.45Å; P556-R579 WeakPolarHBondContact O-CB 3.32Å; W557-R579 HydrophobicContact CD2-CB 4.37Å; W557-R579 HydrophobicContact CD2-CG 4.07Å; W557-R579 HydrophobicContact CE3-CB 3.96Å; W557-R579 HydrophobicContact CE3-CG 3.71Å; W557-R579 HydrophobicContact CH2-CG 4.2Å; W557-R579 HydrophobicContact CZ3-CB 4.42Å; W557-R579 HydrophobicContact CZ3-CG 3.78Å; R579-A596 VanDerWaalsContact CZ-O 3.31Å; R579-A596 PolarHBondContact NE-O 2.79Å; R579-A596 PolarHBondContact NH2-O 2.84Å; R579-R597 PolarHBondContact N-O 2.68Å
580	S	82.9	Confident	72.2	Confident	64 Å²	64	67.3 Å²	67.3	45%	0.448	41%	0.408	S	S	.	.			trans	-88.5	161.9	-179.8	27.8	0	0	0	0	112.7	L554 G555 D582	L554-S580 WeakPolarHBondContact CA-O 3.48Å; G555-S580 PolarHBondContact N-O 3.26Å; S580-D582 WeakPolarHBondContact CB-OD2 3.5Å; S580-D582 PolarHBondContact O-N 3.01Å; S580-D582 PolarHBondContact OG-OD2 3.28Å
581	C	79.4	Confident	73.5	Confident	23 Å²	23	70.6 Å²	70.6	16%	0.155	40%	0.404	C	S	.	.	S	Bend	trans	-97.7	71.8	176	177.6	0	0	0	0	109.1	L554 C593	L554-C581 HydrophobicContact CD2-CB 4.28Å; C581-C593 WeakPolarHBondContact CA-SG 3.38Å; C581-C593 HydrophobicContact CB-CB 3.74Å; C581-C593 WeakPolarHBondContact CB-SG 3.33Å; C581-C593 WeakPolarHBondContact SG-CB 3.37Å; C581-C593 CovalentContact SG-SG 2.02Å; C581-C593 PolarHBondContact SG-SG 2.97Å
582	D	80.8	Confident	74.7	Confident	54 Å²	54	66.1 Å²	66.1	29%	0.289	38%	0.384	S	S	.	.			trans	-134.5	-5	-164.7	59	14	0	0	0	116.4	R553 S580 P584 R585	R553-D582 PolarHBondContact O-N 3.35Å; S580-D582 WeakPolarHBondContact CB-OD2 3.5Å; S580-D582 PolarHBondContact O-N 3.01Å; S580-D582 PolarHBondContact OG-OD2 3.28Å; D582-P584 VanDerWaalsContact C-CA 3.41Å; D582-P584 CarbonylContact O-C 3.59Å; D582-P584 VanDerWaalsContact O-CA 3.24Å; D582-P584 WeakPolarHBondContact O-CA 3.48Å; D582-R585 HydrophobicContact CB-CG 4.16Å; D582-R585 PolarHBondContact O-N 2.91Å
583	S	71.4	Confident	76	Confident	54 Å²	54	64.6 Å²	64.6	38%	0.378	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	57.2	-163.7	-63.6	0	0	0	0	114.1	R553 G555	R553-S583 WeakPolarHBondContact CB-O 3.44Å; R553-S583 WeakPolarHBondContact CD-O 3.22Å; R553-S583 WeakPolarHBondContact CG-O 3.32Å; R553-S583 PolarHBondContact O-N 2.87Å; G555-S583 WeakPolarHBondContact CA-OG 3.25Å
584	P	69.6	Low	76.8	Confident	60 Å²	60	68.1 Å²	68.1	39%	0.39	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	cis	-91.2	168.8	3.8	35.9	-36.7	0	0	0	113.8	T550 G552 R553 D582	T550-P584 HydrophobicContact CG2-CB 3.99Å; T550-P584 HydrophobicContact CG2-CG 3.63Å; G552-P584 WeakPolarHBondContact CA-O 3.1Å; R553-P584 PolarHBondContact N-O 3.48Å; D582-P584 VanDerWaalsContact C-CA 3.41Å; D582-P584 CarbonylContact O-C 3.59Å; D582-P584 VanDerWaalsContact O-CA 3.24Å; D582-P584 WeakPolarHBondContact O-CA 3.48Å
585	R	75.3	Confident	77.3	Confident	170 Å²	170	70 Å²	70	64%	0.642	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-66.3	141.9	167.6	-67.8	-175.6	-178.7	-166.8	-0	110.9	D582	D582-R585 HydrophobicContact CB-CG 4.16Å; D582-R585 PolarHBondContact O-N 2.91Å
586	P	77.4	Confident	77.2	Confident	47 Å²	47	70 Å²	70	31%	0.305	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-64.8	137.9	172.1	28	-33.3	0	0	0	110.4	T550	T550-P586 CarbonylContact O-C 3.52Å; T550-P586 VanDerWaalsContact O-CA 3.25Å; T550-P586 WeakPolarHBondContact O-CA 3.46Å
587	R	72.1	Confident	77.3	Confident	132 Å²	132	75 Å²	75	50%	0.498	42%	0.419	S	S	.	.	B	Isolated β-bridge	trans	-142.3	151.7	174.9	-77.7	-168.8	-81.7	-164.5	-3.8	111.7	T550 G589 G590	T550-R587 PolarHBondContact N-O 3.44Å; T550-R587 PolarHBondContact O-N 3.09Å; R587-G589 PolarHBondContact O-N 2.92Å; R587-G590 PolarHBondContact O-N 2.94Å; R587-G590 VanDerWaalsContact O-N 3.09Å
588	C	67.3	Low	77.1	Confident	34 Å²	34	77.7 Å²	77.7	23%	0.23	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	54.2	172.1	-50.2	0	0	0	0	114.2	C40 L548 T549 G590	C40-C588 WeakPolarHBondContact CA-SG 3.31Å; C40-C588 HydrophobicContact CB-CB 3.6Å; C40-C588 WeakPolarHBondContact CB-SG 3.41Å; C40-C588 WeakPolarHBondContact SG-CA 3.44Å; C40-C588 WeakPolarHBondContact SG-CB 3.44Å; C40-C588 PolarHBondContact SG-N 2.86Å; C40-C588 CovalentContact SG-SG 2.03Å; C40-C588 PolarHBondContact SG-SG 2.93Å; L548-C588 HydrophobicContact CB-CB 4.11Å; L548-C588 VanDerWaalsContact CB-SG 3.6Å; T549-C588 WeakPolarHBondContact CG2-O 3.37Å; C588-G590 PolarHBondContact O-N 2.83Å
589	G	62.4	Low	76.8	Confident	84 Å²	84	78.2 Å²	78.2	87%	0.866	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	2.6	179.8	0	0	0	0	0	115.3	R587	R587-G589 PolarHBondContact O-N 2.92Å
590	G	71.4	Confident	76.3	Confident	15 Å²	15	78.3 Å²	78.3	16%	0.155	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-61.4	149.6	170.8	0	0	0	0	0	112.4	T550 R587 C588	T550-G590 WeakPolarHBondContact O-CA 3.28Å; R587-G590 PolarHBondContact O-N 2.94Å; R587-G590 VanDerWaalsContact O-N 3.09Å; C588-G590 PolarHBondContact O-N 2.83Å
591	R	74.3	Confident	75.6	Confident	176 Å²	176	76.8 Å²	76.8	66%	0.664	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-59	139.9	-173.2	-63.3	-173.2	-176.3	-165.2	2.5	111.9	N551 G552	N551-R591 PolarHBondContact OD1-N 2.85Å; G552-R591 PolarHBondContact N-O 3.43Å
592	A	79.3	Confident	75	Confident	67 Å²	67	81.6 Å²	81.6	55%	0.554	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-64.4	155.4	171	0	0	0	0	0	111.3	E594	A592-E594 PolarHBondContact O-N 3.31Å
593	C	82.3	Confident	74.3	Confident	12 Å²	12	80.2 Å²	80.2	8%	0.081	45%	0.45	C	S	.	.			trans	-65.7	115.8	178	-59.4	0	0	0	0	112.3	R553 L554 C581	R553-C593 PolarHBondContact N-SG 3.44Å; R553-C593 VanDerWaalsContact N-SG 3.37Å; L554-C593 HydrophobicContact CD2-CB 3.44Å; L554-C593 VanDerWaalsContact CD2-CB 3.44Å; L554-C593 HydrophobicContact CG-CB 3.8Å; C581-C593 WeakPolarHBondContact CA-SG 3.38Å; C581-C593 HydrophobicContact CB-CB 3.74Å; C581-C593 WeakPolarHBondContact CB-SG 3.33Å; C581-C593 WeakPolarHBondContact SG-CB 3.37Å; C581-C593 CovalentContact SG-SG 2.02Å; C581-C593 PolarHBondContact SG-SG 2.97Å
594	E	79.9	Confident	74	Confident	155 Å²	155	81.7 Å²	81.7	72%	0.724	46%	0.46	S	S	*	.			trans	-81.5	136.6	173.4	-67.1	169.8	-160.6	0	0	111.2	L554 A592	L554-E594 WeakPolarHBondContact CD1-O 3.47Å; A592-E594 PolarHBondContact O-N 3.31Å
595	G	80.9	Confident	73.9	Confident	52 Å²	52	83.6 Å²	83.6	54%	0.536	46%	0.459	S	S	.	.	S	Bend	trans	117.5	162.6	176.2	0	0	0	0	0	115.2	R597	G595-R597 PolarHBondContact O-N 3.38Å
596	A	76.6	Confident	73.8	Confident	60 Å²	60	80.4 Å²	80.4	50%	0.496	46%	0.455	S	S	.	.			trans	-63.5	132.3	-177.3	0	0	0	0	0	112.3	W557 R579	W557-A596 WeakPolarHBondContact CH2-O 3.39Å; R579-A596 VanDerWaalsContact CZ-O 3.31Å; R579-A596 PolarHBondContact NE-O 2.79Å; R579-A596 PolarHBondContact NH2-O 2.84Å
597	R	82.4	Confident	73.6	Confident	136 Å²	136	79 Å²	79	51%	0.513	45%	0.448	S	S	.	.	S	Bend	trans	-93.8	-16.3	177.4	-61.4	-175.2	-174.3	-169.3	2	113.9	L554 S578 R579 G595	L554-R597 HydrophobicContact CD2-CG 4.36Å; S578-R597 CarbonylContact C-O 3.59Å; S578-R597 WeakPolarHBondContact CA-O 3.21Å; R579-R597 PolarHBondContact N-O 2.68Å; G595-R597 PolarHBondContact O-N 3.38Å
598	I	80.8	Confident	73.9	Confident	115 Å²	115	74.7 Å²	74.7	59%	0.59	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.6	143.2	177.5	-56.9	176.8	0	0	0	107.1	R577 V600	R577-I598 CarbonylContact O-C 3.5Å; R577-I598 WeakPolarHBondContact O-CA 3.17Å; I598-V600 HydrophobicContact CG2-CG2 4.18Å
599	E	81.8	Confident	74.5	Confident	69 Å²	69	76.1 Å²	76.1	32%	0.322	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	139.4	176.8	-167.8	-175.7	155	0	0	108.7	W557 W560 C576 R577	W557-E599 HydrophobicContact CH2-CB 3.72Å; W557-E599 HydrophobicContact CZ2-CB 4.28Å; W557-E599 VanDerWaalsContact CZ2-OE2 3.28Å; W557-E599 WeakPolarHBondContact CZ2-OE2 3.47Å; W557-E599 HydrophobicContact CZ3-CB 4.04Å; W560-E599 HydrophobicContact CH2-CB 4.29Å; W560-E599 HydrophobicContact CH2-CG 3.87Å; C576-E599 CarbonylContact C-O 3.48Å; C576-E599 WeakPolarHBondContact CA-O 3.44Å; R577-E599 HydrophobicContact CG-CB 3.96Å; R577-E599 IonicContact CZ-OE1 2.85Å; R577-E599 IonicContact CZ-OE2 3.59Å; R577-E599 PolarHBondContact N-O 3.13Å; R577-E599 IonicContact NE-OE1 3.55Å; R577-E599 IonicContact NE-OE2 3.37Å; R577-E599 PolarHBondContact NE-OE2 2.77Å; R577-E599 IonicContact NH2-OE1 3.93Å; R577-E599 PolarHBondContact NH2-OE1 3.34Å; R577-E599 IonicContact NH2-OE2 2.82Å; R577-E599 PolarHBondContact NH2-OE2 3.39Å; R577-E599 PolarHBondContact O-N 2.66Å
600	V	75.1	Confident	75.3	Confident	65 Å²	65	73.7 Å²	73.7	39%	0.394	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	139.2	-171.7	-171.7	0	0	0	0	110.4	M575 I598	M575-V600 CarbonylContact O-C 3.58Å; M575-V600 VanDerWaalsContact O-CA 3.31Å; M575-V600 WeakPolarHBondContact O-CA 3.49Å; I598-V600 HydrophobicContact CG2-CG2 4.18Å
601	A	67.8	Low	75.7	Confident	33 Å²	33	78 Å²	78	27%	0.273	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	164.3	-179	0	0	0	0	0	113.2	W560 M575	W560-A601 HydrophobicContact CH2-CB 4.18Å; W560-A601 HydrophobicContact CZ3-CB 4.18Å; M575-A601 PolarHBondContact N-O 2.65Å; M575-A601 VanDerWaalsContact N-O 3.11Å; M575-A601 PolarHBondContact O-N 3.27Å
602	N	67.3	Low	76.2	Confident	124 Å²	124	72.9 Å²	72.9	66%	0.663	42%	0.416	S	S	*	.	S	Bend	trans	69.5	29.9	171.6	-59.4	-9.9	0	0	0	117.9
603	C	66.1	Low	76.2	Confident	25 Å²	25	72 Å²	72	17%	0.169	41%	0.406	C	S	.	.			trans	-136.9	25.7	-176.3	56.6	0	0	0	0	116.1	C574 R605 Y640	C574-C603 WeakPolarHBondContact SG-CB 3.35Å; C603-R605 PolarHBondContact O-N 2.91Å; C603-Y640 HydrophobicContact CB-CD2 4.22Å; C603-Y640 VanDerWaalsContact O-CD2 3.28Å; C603-Y640 WeakPolarHBondContact O-CD2 3.24Å
604	S	64.3	Low	76	Confident	85 Å²	85	76.4 Å²	76.4	59%	0.594	44%	0.437	S	S	*	.			trans	-64.9	123.5	-175.7	50.7	0	0	0	0	113.9	Y640	S604-Y640 WeakPolarHBondContact CA-O 3.22Å; S604-Y640 VanDerWaalsContact CB-O 3.24Å; S604-Y640 WeakPolarHBondContact CB-O 3.26Å
605	R	67	Low	76	Confident	100 Å²	100	72.1 Å²	72.1	38%	0.377	41%	0.414	S	S	.	.	B	Isolated β-bridge	trans	-114.1	118	176.7	-169	179.3	-167.7	171.8	5.3	109.9	C603 P638 R639 G642	C603-R605 PolarHBondContact O-N 2.91Å; R605-P638 CarbonylContact O-C 3.52Å; R605-P638 VanDerWaalsContact O-CA 3.26Å; R605-P638 WeakPolarHBondContact O-CA 3.38Å; R605-R639 PolarHBondContact N-O 3.31Å; R605-R639 PolarHBondContact O-N 2.75Å; R605-G642 WeakPolarHBondContact O-CA 3.27Å
606	N	72.5	Confident	75.8	Confident	103 Å²	103	71.6 Å²	71.6	55%	0.551	41%	0.405	S	S	*	.			trans	-71	149.1	176.2	-64.1	-41.3	0	0	0	111.3	G642 R643	N606-G642 WeakPolarHBondContact OD1-CA 3.18Å; N606-R643 PolarHBondContact OD1-N 2.97Å
607	G	74.3	Confident	75.6	Confident	16 Å²	16	74.2 Å²	74.2	17%	0.165	42%	0.417	C	S	.	.			trans	-85.9	146.9	177	0	0	0	0	0	112.9	P636 R643	G607-P636 CarbonylContact C-O 3.54Å; G607-P636 VanDerWaalsContact CA-O 3.28Å; G607-P636 WeakPolarHBondContact CA-O 3.21Å; G607-R643 PolarHBondContact N-O 3.34Å
608	A	78.3	Confident	75.4	Confident	43 Å²	43	69.3 Å²	69.3	36%	0.355	40%	0.403	S	S	.	.			trans	-133.4	154	167.4	0	0	0	0	0	112.6	S634 N635 P636 C645	A608-S634 PolarHBondContact O-N 3.27Å; A608-N635 WeakPolarHBondContact CB-O 3.04Å; A608-N635 CarbonylContact O-C 3.26Å; A608-N635 PolarHBondContact O-N 2.87Å; A608-N635 VanDerWaalsContact O-N 3.09Å; A608-P636 PolarHBondContact N-O 2.84Å; A608-C645 WeakPolarHBondContact CA-SG 3.37Å; A608-C645 PolarHBondContact N-SG 3.5Å; A608-C645 VanDerWaalsContact N-SG 3.39Å
609	W	80.3	Confident	75	Confident	63 Å²	63	66.7 Å²	66.7	24%	0.239	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-71.3	143.5	-176.7	-69.4	115.1	0	0	0	112	R631 S632 C633 C645 V646 G647	W609-R631 HydrophobicContact CD2-CG 4.21Å; W609-R631 HydrophobicContact CE3-CB 4.4Å; W609-R631 HydrophobicContact CE3-CG 3.71Å; W609-R631 HydrophobicContact CZ3-CG 4.17Å; W609-S632 CarbonylContact C-O 3.56Å; W609-S632 WeakPolarHBondContact CA-O 3.19Å; W609-C633 HydrophobicContact CE3-CB 4.22Å; W609-C633 HydrophobicContact CZ3-CB 4.09Å; W609-C645 HydrophobicContact CD2-CB 3.7Å; W609-C645 HydrophobicContact CE3-CB 4.28Å; W609-C645 HydrophobicContact CG-CB 4.09Å; W609-C645 HydrophobicContact CH2-CB 4.18Å; W609-C645 HydrophobicContact CZ2-CB 3.6Å; W609-V646 PolarHBondContact NE1-O 2.91Å; W609-G647 VanDerWaalsContact CZ2-O 3.31Å; W609-G647 WeakPolarHBondContact CZ2-O 3.42Å
610	T	78.9	Confident	74	Confident	34 Å²	34	66 Å²	66	21%	0.209	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-61.6	162.8	158.3	63.3	0	0	0	0	110.8	S632 S634 N635	T610-S632 WeakPolarHBondContact CG2-OG 3.26Å; T610-S632 PolarHBondContact N-O 3.34Å; T610-S632 PolarHBondContact OG1-N 3.07Å; T610-S634 VanDerWaalsContact CG2-OG 3.23Å; T610-S634 WeakPolarHBondContact CG2-OG 3.34Å; T610-N635 HydrophobicContact CG2-CB 4.14Å
611	P	80.7	Confident	73.3	Confident	104 Å²	104	68.5 Å²	68.5	68%	0.675	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-49	153.8	154.6	-24.6	35.1	0	0	0	111.6
612	W	82.9	Confident	72.8	Confident	70 Å²	70	69 Å²	69	27%	0.265	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-66.8	146.2	168.9	-73.1	111.4	0	0	0	110.8	R629 R631 E651	W612-R629 HydrophobicContact CD2-CG 4.36Å; W612-R629 HydrophobicContact CE3-CG 3.91Å; W612-R629 HydrophobicContact CZ3-CG 4.38Å; W612-R631 HydrophobicContact CD2-CB 4.22Å; W612-R631 HydrophobicContact CD2-CG 4.03Å; W612-R631 HydrophobicContact CE3-CB 3.88Å; W612-R631 HydrophobicContact CE3-CG 3.69Å; W612-R631 HydrophobicContact CH2-CG 4.05Å; W612-R631 HydrophobicContact CZ2-CG 4.37Å; W612-R631 VanDerWaalsContact CZ2-NE 3.31Å; W612-R631 HydrophobicContact CZ3-CB 4.33Å; W612-R631 HydrophobicContact CZ3-CG 3.7Å; W612-E651 HydrophobicContact CH2-CB 3.7Å; W612-E651 HydrophobicContact CZ2-CB 4.24Å; W612-E651 HydrophobicContact CZ3-CB 3.98Å
613	S	79.8	Confident	72.4	Confident	47 Å²	47	64.2 Å²	64.2	33%	0.329	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-61	164.3	163.6	73.7	0	0	0	0	111.5	R629 Q630	S613-R629 WeakPolarHBondContact OG-CA 3.26Å; S613-R629 WeakPolarHBondContact OG-CB 3.49Å; S613-Q630 PolarHBondContact N-O 3.42Å; S613-Q630 PolarHBondContact OG-N 2.93Å
614	S	77.4	Confident	72.5	Confident	105 Å²	105	68.3 Å²	68.3	73%	0.734	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-56.4	157.9	157.7	44.7	0	0	0	0	111
615	W	80.7	Confident	72.9	Confident	65 Å²	65	64.3 Å²	64.3	25%	0.246	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-69.7	132.7	170.5	-71.1	103.8	0	0	0	110.2	Q627 R629 E651 R653	W615-Q627 HydrophobicContact CE3-CB 4Å; W615-Q627 WeakPolarHBondContact CZ3-O 3.45Å; W615-R629 HydrophobicContact CD2-CB 4.18Å; W615-R629 HydrophobicContact CD2-CG 4.02Å; W615-R629 HydrophobicContact CE3-CB 4.02Å; W615-R629 HydrophobicContact CE3-CG 3.92Å; W615-R629 HydrophobicContact CH2-CG 3.96Å; W615-R629 HydrophobicContact CZ2-CG 4.04Å; W615-R629 HydrophobicContact CZ3-CB 4.39Å; W615-R629 HydrophobicContact CZ3-CG 3.89Å; W615-E651 HydrophobicContact CH2-CB 4.29Å; W615-E651 HydrophobicContact CH2-CG 3.98Å; W615-E651 WeakPolarHBondContact CZ3-O 3.31Å; W615-R653 HydrophobicContact CD2-CG 4.38Å; W615-R653 HydrophobicContact CE3-CG 4Å; W615-R653 HydrophobicContact CH2-CB 4.11Å; W615-R653 HydrophobicContact CH2-CG 3.93Å; W615-R653 HydrophobicContact CZ2-CG 4.31Å; W615-R653 HydrophobicContact CZ3-CB 4.26Å; W615-R653 HydrophobicContact CZ3-CG 3.76Å
616	A	76.8	Confident	73.2	Confident	42 Å²	42	64 Å²	64	35%	0.347	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-60.7	157.1	169.6	0	0	0	0	0	111.7	Q627 V628	A616-Q627 WeakPolarHBondContact O-CB 3.16Å; A616-Q627 VanDerWaalsContact O-CD 3.22Å; A616-Q627 WeakPolarHBondContact O-CG 3.45Å; A616-Q627 PolarHBondContact O-NE2 2.86Å; A616-V628 WeakPolarHBondContact CB-O 3.29Å; A616-V628 PolarHBondContact N-O 3.29Å
617	P	72.8	Confident	73.5	Confident	114 Å²	114	60.8 Å²	60.8	74%	0.74	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-57.7	160.7	168.5	26.1	-35.3	0	0	0	111.9
618	C	77.7	Confident	73.8	Confident	33 Å²	33	61.4 Å²	61.4	22%	0.223	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-64.6	137	-179.7	-166.8	0	0	0	0	110.9	T620 Q627 C655 N656	C618-T620 PolarHBondContact O-N 2.82Å; C618-Q627 HydrophobicContact CB-CG 4.38Å; C618-C655 VanDerWaalsContact CA-SG 3.56Å; C618-C655 HydrophobicContact CB-CB 3.96Å; C618-C655 WeakPolarHBondContact CB-SG 3.28Å; C618-C655 WeakPolarHBondContact SG-CB 3.25Å; C618-C655 CovalentContact SG-SG 2.03Å; C618-C655 PolarHBondContact SG-SG 3.11Å; C618-N656 PolarHBondContact SG-ND2 3.11Å
619	S	72.9	Confident	73.9	Confident	60 Å²	60	62.3 Å²	62.3	42%	0.42	37%	0.366	S	S	.	.	S	Bend	trans	-64	-18.8	-176.7	64	0	0	0	0	115	G625 F626	S619-G625 VanDerWaalsContact OG-CA 3.32Å; S619-G625 WeakPolarHBondContact OG-CA 3.34Å; S619-F626 WeakPolarHBondContact CB-O 3.48Å; S619-F626 PolarHBondContact N-O 3.5Å; S619-F626 WeakPolarHBondContact OG-CD1 3.38Å; S619-F626 PolarHBondContact OG-N 2.84Å
620	T	59.7	Low	74	Confident	54 Å²	54	65.6 Å²	65.6	33%	0.331	38%	0.384	S	S	.	.			trans	-137.4	148.6	-179.3	54	0	0	0	0	111.3	C618 C622 G623 G625 N656	C618-T620 PolarHBondContact O-N 2.82Å; T620-C622 WeakPolarHBondContact CB-O 3.29Å; T620-G623 PolarHBondContact OG1-O 3.27Å; T620-G625 WeakPolarHBondContact OG1-CA 3.38Å; T620-G625 PolarHBondContact OG1-N 3Å; T620-N656 PolarHBondContact O-ND2 3.22Å
621	S	60.3	Low	74.1	Confident	118 Å²	118	67 Å²	67	83%	0.825	39%	0.385	S	S	*	.	S	Bend	trans	-92.3	-18.1	176.9	50.2	0	0	0	0	114.2
622	C	57.5	Low	74.1	Confident	43 Å²	43	64.9 Å²	64.9	29%	0.291	37%	0.374	S	S	.	.	S	Bend	trans	-140.4	156.5	165.6	66.4	0	0	0	0	109.2	T620 C661	T620-C622 WeakPolarHBondContact CB-O 3.29Å; C622-C661 HydrophobicContact CB-CB 4.32Å; C622-C661 WeakPolarHBondContact CB-SG 3.36Å; C622-C661 WeakPolarHBondContact SG-CB 3.32Å; C622-C661 CovalentContact SG-SG 2.04Å; C622-C661 PolarHBondContact SG-SG 3.44Å
623	G	60.1	Low	73.7	Confident	24 Å²	24	63.4 Å²	63.4	25%	0.247	37%	0.373	C	S	.	.	S	Bend	trans	68.3	164.7	-169	0	0	0	0	0	114.1	T620 G625 N656 S659	T620-G623 PolarHBondContact OG1-O 3.27Å; G623-G625 PolarHBondContact O-N 2.89Å; G623-G625 VanDerWaalsContact O-N 3.15Å; G623-N656 CarbonylContact C-O 3.55Å; G623-N656 VanDerWaalsContact C-O 3.26Å; G623-N656 WeakPolarHBondContact O-CB 3.3Å; G623-S659 PolarHBondContact N-O 3.34Å
624	I	68.3	Low	73.4	Confident	112 Å²	112	64.2 Å²	64.2	57%	0.574	38%	0.379	S	S	*	.	S	Bend	trans	-58	118.1	-178.8	-55.4	165.5	0	0	0	109.9	F654 E657	I624-F654 HydrophobicContact CG2-CB 4.42Å; I624-F654 HydrophobicContact CG2-CD1 4.09Å; I624-E657 HydrophobicContact CG1-CB 4.49Å; I624-E657 HydrophobicContact CG1-CG 4.33Å
625	G	71.3	Confident	73.1	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.01	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	-175.6	171.8	0	0	0	0	0	111.8	S619 T620 G623 F654 C655	S619-G625 VanDerWaalsContact OG-CA 3.32Å; S619-G625 WeakPolarHBondContact OG-CA 3.34Å; T620-G625 WeakPolarHBondContact OG1-CA 3.38Å; T620-G625 PolarHBondContact OG1-N 3Å; G623-G625 PolarHBondContact O-N 2.89Å; G623-G625 VanDerWaalsContact O-N 3.15Å; G625-F654 CarbonylContact O-C 3.57Å; G625-F654 WeakPolarHBondContact O-CA 3.39Å; G625-C655 PolarHBondContact N-O 3.04Å; G625-C655 PolarHBondContact O-N 3.01Å
626	F	74.9	Confident	72.3	Confident	94 Å²	94	63 Å²	63	41%	0.412	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	154.5	174.6	55.7	-87.7	0	0	0	112.1	S619 V628 R653 C655	S619-F626 WeakPolarHBondContact CB-O 3.48Å; S619-F626 PolarHBondContact N-O 3.5Å; S619-F626 WeakPolarHBondContact OG-CD1 3.38Å; S619-F626 PolarHBondContact OG-N 2.84Å; F626-V628 HydrophobicContact CD2-CG2 3.83Å; F626-V628 HydrophobicContact CE2-CG2 4.12Å; F626-R653 CarbonylContact C-O 3.58Å; F626-R653 WeakPolarHBondContact CA-O 3.36Å; F626-C655 VanDerWaalsContact C-SG 3.57Å; F626-C655 PolarHBondContact N-SG 2.81Å; F626-C655 VanDerWaalsContact N-SG 3.44Å
627	Q	77.8	Confident	72.1	Confident	35 Å²	35	63 Å²	63	16%	0.164	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	149.8	169.3	-65.6	-172.2	-21.6	0	0	109.2	W615 A616 C618 E652 R653 C655	W615-Q627 HydrophobicContact CE3-CB 4Å; W615-Q627 WeakPolarHBondContact CZ3-O 3.45Å; A616-Q627 WeakPolarHBondContact O-CB 3.16Å; A616-Q627 VanDerWaalsContact O-CD 3.22Å; A616-Q627 WeakPolarHBondContact O-CG 3.45Å; A616-Q627 PolarHBondContact O-NE2 2.86Å; C618-Q627 HydrophobicContact CB-CG 4.38Å; Q627-E652 CarbonylContact O-C 3.59Å; Q627-E652 WeakPolarHBondContact O-CA 3.33Å; Q627-R653 HydrophobicContact CB-CG 4.04Å; Q627-R653 PolarHBondContact N-O 3.14Å; Q627-R653 PolarHBondContact O-N 2.81Å; Q627-R653 VanDerWaalsContact OE1-CZ 3.31Å; Q627-C655 HydrophobicContact CG-CB 4.47Å
628	V	81.5	Confident	72.2	Confident	29 Å²	29	59.6 Å²	59.6	18%	0.176	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	144.9	-174.1	-170	0	0	0	0	109.8	A616 F626 R650 E651 E652	A616-V628 WeakPolarHBondContact CB-O 3.29Å; A616-V628 PolarHBondContact N-O 3.29Å; F626-V628 HydrophobicContact CD2-CG2 3.83Å; F626-V628 HydrophobicContact CE2-CG2 4.12Å; V628-R650 HydrophobicContact CG1-CG 3.7Å; V628-E651 WeakPolarHBondContact CA-O 3.44Å; V628-E652 HydrophobicContact CG1-CG 4.39Å; V628-E652 HydrophobicContact CG2-CG 4.24Å
629	R	79.5	Confident	71.6	Confident	62 Å²	62	63.1 Å²	63.1	23%	0.234	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	159.5	163.1	66.7	178.3	-176.8	-176.9	-6.5	111.7	W612 S613 W615 R650 E651	W612-R629 HydrophobicContact CD2-CG 4.36Å; W612-R629 HydrophobicContact CE3-CG 3.91Å; W612-R629 HydrophobicContact CZ3-CG 4.38Å; S613-R629 WeakPolarHBondContact OG-CA 3.26Å; S613-R629 WeakPolarHBondContact OG-CB 3.49Å; W615-R629 HydrophobicContact CD2-CB 4.18Å; W615-R629 HydrophobicContact CD2-CG 4.02Å; W615-R629 HydrophobicContact CE3-CB 4.02Å; W615-R629 HydrophobicContact CE3-CG 3.92Å; W615-R629 HydrophobicContact CH2-CG 3.96Å; W615-R629 HydrophobicContact CZ2-CG 4.04Å; W615-R629 HydrophobicContact CZ3-CB 4.39Å; W615-R629 HydrophobicContact CZ3-CG 3.89Å; R629-R650 WeakPolarHBondContact O-CA 3.4Å; R629-E651 HydrophobicContact CG-CB 4.16Å; R629-E651 IonicContact CZ-OE2 3.01Å; R629-E651 PolarHBondContact N-O 2.96Å; R629-E651 IonicContact NE-OE2 2.66Å; R629-E651 PolarHBondContact NE-OE2 3.35Å; R629-E651 IonicContact NH2-OE1 2.73Å; R629-E651 IonicContact NH2-OE2 2.68Å; R629-E651 PolarHBondContact NH2-OE2 2.77Å; R629-E651 PolarHBondContact O-N 3.32Å
630	Q	83.2	Confident	71.2	Confident	132 Å²	132	65.9 Å²	65.9	62%	0.617	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141	157.7	-172.9	61.8	-177.1	-1.4	0	0	113.6	S613 S649	S613-Q630 PolarHBondContact N-O 3.42Å; S613-Q630 PolarHBondContact OG-N 2.93Å; Q630-S649 CarbonylContact C-O 3.55Å; Q630-S649 VanDerWaalsContact CA-O 3.27Å; Q630-S649 WeakPolarHBondContact CA-O 3.4Å
631	R	81	Confident	71.2	Confident	62 Å²	62	67.2 Å²	67.2	23%	0.234	39%	0.385	C	S	.	.			trans	-145.3	151.9	175.2	61	-179.8	174.2	-170.7	-6.6	110.5	W609 W612 Q648 S649	W609-R631 HydrophobicContact CD2-CG 4.21Å; W609-R631 HydrophobicContact CE3-CB 4.4Å; W609-R631 HydrophobicContact CE3-CG 3.71Å; W609-R631 HydrophobicContact CZ3-CG 4.17Å; W612-R631 HydrophobicContact CD2-CB 4.22Å; W612-R631 HydrophobicContact CD2-CG 4.03Å; W612-R631 HydrophobicContact CE3-CB 3.88Å; W612-R631 HydrophobicContact CE3-CG 3.69Å; W612-R631 HydrophobicContact CH2-CG 4.05Å; W612-R631 HydrophobicContact CZ2-CG 4.37Å; W612-R631 VanDerWaalsContact CZ2-NE 3.31Å; W612-R631 HydrophobicContact CZ3-CB 4.33Å; W612-R631 HydrophobicContact CZ3-CG 3.7Å; R631-Q648 VanDerWaalsContact CZ-O 3.28Å; R631-Q648 PolarHBondContact NE-O 2.74Å; R631-Q648 PolarHBondContact NH2-O 3.19Å; R631-S649 PolarHBondContact N-O 2.92Å
632	S	79.3	Confident	71.4	Confident	61 Å²	61	62.2 Å²	62.2	43%	0.427	35%	0.352	S	S	.	.			trans	-119.3	154.4	-178.2	53.1	0	0	0	0	112.2	W609 T610 S634	W609-S632 CarbonylContact C-O 3.56Å; W609-S632 WeakPolarHBondContact CA-O 3.19Å; T610-S632 WeakPolarHBondContact CG2-OG 3.26Å; T610-S632 PolarHBondContact N-O 3.34Å; T610-S632 PolarHBondContact OG1-N 3.07Å; S632-S634 VanDerWaalsContact C-N 3.27Å; S632-S634 PolarHBondContact O-N 3.07Å; S632-S634 VanDerWaalsContact O-N 3.13Å; S632-S634 PolarHBondContact OG-OG 2.82Å
633	C	75.7	Confident	71.8	Confident	38 Å²	38	69.4 Å²	69.4	26%	0.257	37%	0.373	S	S	.	.	S	Bend	trans	-88.5	62.2	-178.4	-175.7	0	0	0	0	110.3	W609 C645	W609-C633 HydrophobicContact CE3-CB 4.22Å; W609-C633 HydrophobicContact CZ3-CB 4.09Å; C633-C645 WeakPolarHBondContact CA-SG 3.49Å; C633-C645 HydrophobicContact CB-CB 3.75Å; C633-C645 WeakPolarHBondContact CB-SG 3.29Å; C633-C645 WeakPolarHBondContact SG-CB 3.49Å; C633-C645 PolarHBondContact SG-N 2.82Å; C633-C645 CovalentContact SG-SG 2.03Å; C633-C645 PolarHBondContact SG-SG 2.85Å
634	S	72.3	Confident	72.3	Confident	64 Å²	64	73.1 Å²	73.1	45%	0.448	39%	0.39	S	S	.	.			trans	-129.6	-1.4	-168.8	60.1	0	0	0	0	115.5	A608 T610 S632 P636 A637	A608-S634 PolarHBondContact O-N 3.27Å; T610-S634 VanDerWaalsContact CG2-OG 3.23Å; T610-S634 WeakPolarHBondContact CG2-OG 3.34Å; S632-S634 VanDerWaalsContact C-N 3.27Å; S632-S634 PolarHBondContact O-N 3.07Å; S632-S634 VanDerWaalsContact O-N 3.13Å; S632-S634 PolarHBondContact OG-OG 2.82Å; S634-P636 VanDerWaalsContact C-CA 3.49Å; S634-P636 CarbonylContact O-C 3.56Å; S634-P636 WeakPolarHBondContact O-CA 3.48Å; S634-A637 PolarHBondContact O-N 2.93Å
635	N	71.5	Confident	72.6	Confident	105 Å²	105	68.8 Å²	68.8	56%	0.561	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.4	70.6	-175.7	-170.4	38.1	0	0	0	113.1	A608 T610	A608-N635 WeakPolarHBondContact CB-O 3.04Å; A608-N635 CarbonylContact O-C 3.26Å; A608-N635 PolarHBondContact O-N 2.87Å; A608-N635 VanDerWaalsContact O-N 3.09Å; T610-N635 HydrophobicContact CG2-CB 4.14Å
636	P	65.2	Low	72.5	Confident	40 Å²	40	74.8 Å²	74.8	26%	0.26	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	cis	-88.5	167.2	-1.7	35.7	-34.9	0	0	0	112.7	G607 A608 S634	G607-P636 CarbonylContact C-O 3.54Å; G607-P636 VanDerWaalsContact CA-O 3.28Å; G607-P636 WeakPolarHBondContact CA-O 3.21Å; A608-P636 PolarHBondContact N-O 2.84Å; S634-P636 VanDerWaalsContact C-CA 3.49Å; S634-P636 CarbonylContact O-C 3.56Å; S634-P636 WeakPolarHBondContact O-CA 3.48Å
637	A	71.3	Confident	72.6	Confident	43 Å²	43	72.8 Å²	72.8	36%	0.355	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-76.7	144.3	171.6	0	0	0	0	0	111.9	S634	S634-A637 PolarHBondContact O-N 2.93Å
638	P	75.2	Confident	72.4	Confident	42 Å²	42	78 Å²	78	27%	0.273	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-69.2	137.9	177.4	27.6	-32.1	0	0	0	111.7	R605 V644	R605-P638 CarbonylContact O-C 3.52Å; R605-P638 VanDerWaalsContact O-CA 3.26Å; R605-P638 WeakPolarHBondContact O-CA 3.38Å; P638-V644 HydrophobicContact CG-CG1 4.2Å
639	R	65.6	Low	72.1	Confident	106 Å²	106	79.8 Å²	79.8	40%	0.4	45%	0.45	S	S	.	.	B	Isolated β-bridge	trans	-140.1	159.1	174.6	-63.5	-165.9	-170.8	162.7	9.4	112.3	D567 R605 G641 G642	D567-R639 IonicContact OD2-CZ 3.55Å; D567-R639 IonicContact OD2-NH1 3.46Å; D567-R639 PolarHBondContact OD2-NH1 2.76Å; D567-R639 IonicContact OD2-NH2 2.76Å; R605-R639 PolarHBondContact N-O 3.31Å; R605-R639 PolarHBondContact O-N 2.75Å; R639-G641 VanDerWaalsContact C-N 3.33Å; R639-G641 PolarHBondContact O-N 2.76Å; R639-G642 PolarHBondContact O-N 2.82Å
640	Y	63.8	Low	72.1	Confident	119 Å²	119	82.3 Å²	82.3	47%	0.467	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.6	44.6	171.3	-45.7	-71.2	0	0	0	114.6	C603 S604	C603-Y640 HydrophobicContact CB-CD2 4.22Å; C603-Y640 VanDerWaalsContact O-CD2 3.28Å; C603-Y640 WeakPolarHBondContact O-CD2 3.24Å; S604-Y640 WeakPolarHBondContact CA-O 3.22Å; S604-Y640 VanDerWaalsContact CB-O 3.24Å; S604-Y640 WeakPolarHBondContact CB-O 3.26Å
641	G	60	Low	72.1	Confident	82 Å²	82	79.2 Å²	79.2	85%	0.845	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.1	4.8	179.5	0	0	0	0	0	115.7	R639	R639-G641 VanDerWaalsContact C-N 3.33Å; R639-G641 PolarHBondContact O-N 2.76Å
642	G	65.3	Low	72	Confident	13 Å²	13	81.2 Å²	81.2	13%	0.134	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-63.7	149.3	172.4	0	0	0	0	0	113.5	R605 N606 R639	R605-G642 WeakPolarHBondContact O-CA 3.27Å; N606-G642 WeakPolarHBondContact OD1-CA 3.18Å; R639-G642 PolarHBondContact O-N 2.82Å
643	R	64.6	Low	72.1	Confident	194 Å²	194	84.1 Å²	84.1	73%	0.732	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-65.4	133	-176.4	-170.1	179.2	-69.1	-172.7	-1.2	111.2	N606 G607	N606-R643 PolarHBondContact OD1-N 2.97Å; G607-R643 PolarHBondContact N-O 3.34Å
644	V	70.8	Confident	71.9	Confident	102 Å²	102	89.6 Å²	89.6	62%	0.618	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-69.1	154.1	172.3	-69.2	0	0	0	0	112.1	P638	P638-V644 HydrophobicContact CG-CG1 4.2Å
645	C	75.4	Confident	71.7	Confident	21 Å²	21	87.5 Å²	87.5	14%	0.142	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-64.3	133.7	179.2	-50.4	0	0	0	0	111.7	A608 W609 C633	A608-C645 WeakPolarHBondContact CA-SG 3.37Å; A608-C645 PolarHBondContact N-SG 3.5Å; A608-C645 VanDerWaalsContact N-SG 3.39Å; W609-C645 HydrophobicContact CD2-CB 3.7Å; W609-C645 HydrophobicContact CE3-CB 4.28Å; W609-C645 HydrophobicContact CG-CB 4.09Å; W609-C645 HydrophobicContact CH2-CB 4.18Å; W609-C645 HydrophobicContact CZ2-CB 3.6Å; C633-C645 WeakPolarHBondContact CA-SG 3.49Å; C633-C645 HydrophobicContact CB-CB 3.75Å; C633-C645 WeakPolarHBondContact CB-SG 3.29Å; C633-C645 WeakPolarHBondContact SG-CB 3.49Å; C633-C645 PolarHBondContact SG-N 2.82Å; C633-C645 CovalentContact SG-SG 2.03Å; C633-C645 PolarHBondContact SG-SG 2.85Å
646	V	69.6	Low	71.4	Confident	126 Å²	126	85.8 Å²	85.8	76%	0.764	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-98.8	136.6	178.6	-176.1	0	0	0	0	110	W609	W609-V646 PolarHBondContact NE1-O 2.91Å
647	G	75.7	Confident	71.1	Confident	52 Å²	52	90.1 Å²	90.1	54%	0.536	47%	0.471	S	S	.	.	S	Bend	trans	123.9	171.6	-179.7	0	0	0	0	0	113.1	W609	W609-G647 VanDerWaalsContact CZ2-O 3.31Å; W609-G647 WeakPolarHBondContact CZ2-O 3.42Å
648	Q	73.1	Confident	70.3	Confident	145 Å²	145	95.5 Å²	95.5	68%	0.678	49%	0.493	S	S	*	.			trans	-74	138.5	176.7	-67.3	177.1	-11.9	0	0	111.2	R631	R631-Q648 VanDerWaalsContact CZ-O 3.28Å; R631-Q648 PolarHBondContact NE-O 2.74Å; R631-Q648 PolarHBondContact NH2-O 3.19Å
649	S	76.6	Confident	69.1	Low	66 Å²	66	96.4 Å²	96.4	46%	0.462	50%	0.501	S	S	.	.	S	Bend	trans	-86.5	-12.4	175.9	50.8	0	0	0	0	113.9	Q630 R631	Q630-S649 CarbonylContact C-O 3.55Å; Q630-S649 VanDerWaalsContact CA-O 3.27Å; Q630-S649 WeakPolarHBondContact CA-O 3.4Å; R631-S649 PolarHBondContact N-O 2.92Å
650	R	79.3	Confident	68.5	Low	116 Å²	116	97.6 Å²	97.6	44%	0.438	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	141	-173.5	-175.4	177.1	175.6	-78.3	-4.4	109.1	V628 R629 E652	V628-R650 HydrophobicContact CG1-CG 3.7Å; R629-R650 WeakPolarHBondContact O-CA 3.4Å; R650-E652 IonicContact CZ-OE1 2.8Å; R650-E652 IonicContact NH1-OE1 3.94Å; R650-E652 PolarHBondContact NH1-OE1 3.24Å; R650-E652 IonicContact NH1-OE2 2.99Å; R650-E652 IonicContact NH2-OE1 2.68Å; R650-E652 PolarHBondContact NH2-OE1 2.96Å
651	E	82.9	Confident	67.8	Low	66 Å²	66	95.4 Å²	95.4	31%	0.308	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	145.9	-176.6	-167.4	-176.3	-171.7	0	0	109.6	W612 W615 V628 R629	W612-E651 HydrophobicContact CH2-CB 3.7Å; W612-E651 HydrophobicContact CZ2-CB 4.24Å; W612-E651 HydrophobicContact CZ3-CB 3.98Å; W615-E651 HydrophobicContact CH2-CB 4.29Å; W615-E651 HydrophobicContact CH2-CG 3.98Å; W615-E651 WeakPolarHBondContact CZ3-O 3.31Å; V628-E651 WeakPolarHBondContact CA-O 3.44Å; R629-E651 HydrophobicContact CG-CB 4.16Å; R629-E651 IonicContact CZ-OE2 3.01Å; R629-E651 PolarHBondContact N-O 2.96Å; R629-E651 IonicContact NE-OE2 2.66Å; R629-E651 PolarHBondContact NE-OE2 3.35Å; R629-E651 IonicContact NH2-OE1 2.73Å; R629-E651 IonicContact NH2-OE2 2.68Å; R629-E651 PolarHBondContact NH2-OE2 2.77Å; R629-E651 PolarHBondContact O-N 3.32Å
652	E	79.3	Confident	67.3	Low	104 Å²	104	97.7 Å²	97.7	49%	0.486	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	152.2	-174.1	-62	-171.6	132.1	0	0	112.1	Q627 V628 R650	Q627-E652 CarbonylContact O-C 3.59Å; Q627-E652 WeakPolarHBondContact O-CA 3.33Å; V628-E652 HydrophobicContact CG1-CG 4.39Å; V628-E652 HydrophobicContact CG2-CG 4.24Å; R650-E652 IonicContact CZ-OE1 2.8Å; R650-E652 IonicContact NH1-OE1 3.94Å; R650-E652 PolarHBondContact NH1-OE1 3.24Å; R650-E652 IonicContact NH1-OE2 2.99Å; R650-E652 IonicContact NH2-OE1 2.68Å; R650-E652 PolarHBondContact NH2-OE1 2.96Å
653	R	80.8	Confident	66.9	Low	122 Å²	122	104.8 Å²	104.8	46%	0.46	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-148.7	153.2	171	69.2	-179.2	-171.9	163.9	2.2	111.5	W615 F626 Q627	W615-R653 HydrophobicContact CD2-CG 4.38Å; W615-R653 HydrophobicContact CE3-CG 4Å; W615-R653 HydrophobicContact CH2-CB 4.11Å; W615-R653 HydrophobicContact CH2-CG 3.93Å; W615-R653 HydrophobicContact CZ2-CG 4.31Å; W615-R653 HydrophobicContact CZ3-CB 4.26Å; W615-R653 HydrophobicContact CZ3-CG 3.76Å; F626-R653 CarbonylContact C-O 3.58Å; F626-R653 WeakPolarHBondContact CA-O 3.36Å; Q627-R653 HydrophobicContact CB-CG 4.04Å; Q627-R653 PolarHBondContact N-O 3.14Å; Q627-R653 PolarHBondContact O-N 2.81Å; Q627-R653 VanDerWaalsContact OE1-CZ 3.31Å
654	F	71.4	Confident	66.3	Low	154 Å²	154	100.9 Å²	100.9	68%	0.675	56%	0.557	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-79.3	161.7	178.7	-58.4	-65.9	0	0	0	113.7	I624 G625	I624-F654 HydrophobicContact CG2-CB 4.42Å; I624-F654 HydrophobicContact CG2-CD1 4.09Å; G625-F654 CarbonylContact O-C 3.57Å; G625-F654 WeakPolarHBondContact O-CA 3.39Å
655	C	69.1	Low	65.7	Low	20 Å²	20	100.2 Å²	100.2	14%	0.135	55%	0.55	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	164.1	176.4	46.5	0	0	0	0	111.1	C618 G625 F626 Q627 E657	C618-C655 VanDerWaalsContact CA-SG 3.56Å; C618-C655 HydrophobicContact CB-CB 3.96Å; C618-C655 WeakPolarHBondContact CB-SG 3.28Å; C618-C655 WeakPolarHBondContact SG-CB 3.25Å; C618-C655 CovalentContact SG-SG 2.03Å; C618-C655 PolarHBondContact SG-SG 3.11Å; G625-C655 PolarHBondContact N-O 3.04Å; G625-C655 PolarHBondContact O-N 3.01Å; F626-C655 VanDerWaalsContact C-SG 3.57Å; F626-C655 PolarHBondContact N-SG 2.81Å; F626-C655 VanDerWaalsContact N-SG 3.44Å; Q627-C655 HydrophobicContact CG-CB 4.47Å; C655-E657 PolarHBondContact O-N 3.02Å
656	N	63.5	Low	65.2	Low	69 Å²	69	104.7 Å²	104.7	37%	0.369	57%	0.567	S	S	.	*			trans	59.5	39.7	172.8	-65.7	-9.5	0	0	0	116.8	C618 T620 G623 N658	C618-N656 PolarHBondContact SG-ND2 3.11Å; T620-N656 PolarHBondContact O-ND2 3.22Å; G623-N656 CarbonylContact C-O 3.55Å; G623-N656 VanDerWaalsContact C-O 3.26Å; G623-N656 WeakPolarHBondContact O-CB 3.3Å; N656-N658 VanDerWaalsContact C-N 3.31Å; N656-N658 PolarHBondContact O-N 2.72Å
657	E	59.8	Low	65.1	Low	131 Å²	131	101.5 Å²	101.5	61%	0.612	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-25.2	-176.1	-64.7	177.8	133.5	0	0	115.8	I624 C655	I624-E657 HydrophobicContact CG1-CB 4.49Å; I624-E657 HydrophobicContact CG1-CG 4.33Å; C655-E657 PolarHBondContact O-N 3.02Å
658	N	55.6	Low	65	Low	155 Å²	155	99.9 Å²	99.9	83%	0.829	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120	41.6	-167.7	-71.1	-52.5	0	0	0	115	N656	N656-N658 VanDerWaalsContact C-N 3.31Å; N656-N658 PolarHBondContact O-N 2.72Å
659	S	49.3	Very low	64.8	Low	62 Å²	62	98.1 Å²	98.1	43%	0.434	53%	0.525	S	S	.	.			trans	-133.1	108	175.7	-70.6	0	0	0	0	112.4	G623	G623-S659 PolarHBondContact N-O 3.34Å
660	P	53.8	Low	64.8	Low	130 Å²	130	98.3 Å²	98.3	84%	0.844	52%	0.516	S	S	*	.			trans	-76.3	148.8	-180	31.2	-34.7	0	0	0	113
661	C	47.3	Very low	64.7	Low	74 Å²	74	94.1 Å²	94.1	50%	0.5	51%	0.509	S	S	.	.			trans	-106.3	149.4	178.1	-50.5	0	0	0	0	111.5	C622	C622-C661 HydrophobicContact CB-CB 4.32Å; C622-C661 WeakPolarHBondContact CB-SG 3.36Å; C622-C661 WeakPolarHBondContact SG-CB 3.32Å; C622-C661 CovalentContact SG-SG 2.04Å; C622-C661 PolarHBondContact SG-SG 3.44Å
662	P	50.7	Low	64.1	Low	129 Å²	129	96.7 Å²	96.7	84%	0.838	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-78.4	171.2	178.6	32.2	-35.7	0	0	0	114.4
663	L	55.9	Low	63.9	Low	163 Å²	163	95.5 Å²	95.5	85%	0.853	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-71	153.8	-171.6	-68.8	170.2	0	0	0	114.8
664	P	52.9	Low	63.8	Low	111 Å²	111	94.3 Å²	94.3	72%	0.721	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-84.4	157.1	-171.1	33.7	-37.1	0	0	0	115.6
665	I	56.8	Low	63.7	Low	89 Å²	89	96.5 Å²	96.5	46%	0.456	54%	0.535	S	S	.	.			trans	-114.9	145.4	-177	-59.3	170.6	0	0	0	109	E692	I665-E692 WeakPolarHBondContact CG2-O 2.95Å
666	F	65.1	Low	64.1	Low	114 Å²	114	96.9 Å²	96.9	50%	0.5	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	161.8	-175.2	59.9	-97	0	0	0	115.3	E692 C697	F666-E692 HydrophobicContact CE2-CB 4.27Å; F666-E692 PolarHBondContact O-N 2.85Å; F666-C697 PolarHBondContact O-SG 2.89Å
667	W	69.3	Low	64.5	Low	59 Å²	59	97.4 Å²	97.4	22%	0.223	55%	0.546	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	142.4	176.8	-74.7	108.1	0	0	0	112.4	R689 C691 C697 P698 G699 A701	W667-R689 HydrophobicContact CD2-CG 4.39Å; W667-R689 HydrophobicContact CE3-CG 3.7Å; W667-R689 HydrophobicContact CZ3-CG 4.09Å; W667-C691 HydrophobicContact CE3-CB 4.43Å; W667-C691 HydrophobicContact CZ3-CB 4.31Å; W667-C697 HydrophobicContact CD2-CB 3.59Å; W667-C697 HydrophobicContact CE3-CB 4.04Å; W667-C697 HydrophobicContact CG-CB 4.11Å; W667-C697 HydrophobicContact CH2-CB 3.85Å; W667-C697 HydrophobicContact CZ2-CB 3.4Å; W667-C697 VanDerWaalsContact CZ2-O 3.28Å; W667-C697 WeakPolarHBondContact CZ2-O 3.28Å; W667-C697 HydrophobicContact CZ3-CB 4.16Å; W667-P698 PolarHBondContact NE1-O 3.43Å; W667-G699 VanDerWaalsContact CZ2-O 3.31Å; W667-G699 WeakPolarHBondContact CZ2-O 3.26Å; W667-A701 HydrophobicContact CH2-CB 3.81Å; W667-A701 HydrophobicContact CZ3-CB 3.86Å
668	S	73.6	Confident	64.6	Low	19 Å²	19	94 Å²	94	13%	0.133	53%	0.534	C	S	.	.	P	Polyproline II helix	trans	-72.3	166.5	164.4	73.1	0	0	0	0	112.2	S690 E692	S668-S690 WeakPolarHBondContact CB-O 3.32Å; S668-S690 PolarHBondContact N-O 2.93Å; S668-S690 PolarHBondContact OG-N 3.15Å; S668-S690 PolarHBondContact OG-O 3.23Å; S668-S690 PolarHBondContact OG-OG 2.74Å; S668-E692 VanDerWaalsContact CB-OE1 3.24Å; S668-E692 WeakPolarHBondContact CB-OE1 3.45Å
669	S	68	Low	65.1	Low	108 Å²	108	93.7 Å²	93.7	76%	0.755	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-66.4	140.2	176	54.6	0	0	0	0	112.2	G671	S669-G671 PolarHBondContact O-N 3.47Å
670	W	77.1	Confident	66	Low	69 Å²	69	92.3 Å²	92.3	26%	0.261	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-56.3	131.7	174.1	-69.9	108.9	0	0	0	113	R687 R689 C700 A701 E703	W670-R687 HydrophobicContact CE3-CG 3.96Å; W670-R687 WeakPolarHBondContact CZ3-O 3.48Å; W670-R689 HydrophobicContact CD2-CB 4.17Å; W670-R689 HydrophobicContact CD2-CG 3.99Å; W670-R689 HydrophobicContact CE3-CB 3.88Å; W670-R689 HydrophobicContact CE3-CG 3.72Å; W670-R689 HydrophobicContact CH2-CG 3.98Å; W670-R689 HydrophobicContact CZ2-CG 4.25Å; W670-R689 VanDerWaalsContact CZ2-CZ 3.4Å; W670-R689 HydrophobicContact CZ3-CB 4.31Å; W670-R689 HydrophobicContact CZ3-CG 3.72Å; W670-C700 WeakPolarHBondContact CH2-O 3.5Å; W670-A701 WeakPolarHBondContact CZ3-O 3.34Å; W670-E703 HydrophobicContact CE3-CB 4.36Å; W670-E703 HydrophobicContact CH2-CB 3.64Å; W670-E703 HydrophobicContact CZ2-CB 4.06Å; W670-E703 HydrophobicContact CZ3-CB 3.79Å
671	G	76.1	Confident	66.3	Low	29 Å²	29	88.7 Å²	88.7	30%	0.299	51%	0.509	S	S	.	.			trans	-66.7	175.6	170.1	0	0	0	0	0	113.7	S669 R687 Q688	S669-G671 PolarHBondContact O-N 3.47Å; G671-R687 VanDerWaalsContact O-CD 3.31Å; G671-R687 WeakPolarHBondContact O-CD 3.46Å; G671-Q688 PolarHBondContact N-O 2.71Å
672	P	71.1	Confident	67.3	Low	119 Å²	119	87.2 Å²	87.2	77%	0.773	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-64.7	156.3	176.1	29	-35.3	0	0	0	111.9	R687	P672-R687 WeakPolarHBondContact O-CB 3.15Å
673	W	75	Confident	68.3	Low	79 Å²	79	81.2 Å²	81.2	30%	0.299	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-73.3	138.6	173.3	-68.2	97.9	0	0	0	111.7	H685 S686 R687 E703 K705	W673-H685 AromaticContact CD2-CE1 3.94Å; W673-H685 AromaticContact CD2-NE2 3.71Å; W673-H685 AromaticContact CE3-CD2 3.47Å; W673-H685 VanDerWaalsContact CE3-CD2 3.47Å; W673-H685 AromaticContact CE3-CG 3.9Å; W673-H685 AromaticContact CE3-NE2 3.67Å; W673-H685 AromaticContact CG-CE1 3.73Å; W673-H685 AromaticContact CG-NE2 3.99Å; W673-H685 AromaticContact CZ3-CD2 3.97Å; W673-H685 WeakPolarHBondContact CZ3-O 3.41Å; W673-S686 VanDerWaalsContact CE3-C 3.47Å; W673-R687 HydrophobicContact CD2-CB 4.13Å; W673-R687 HydrophobicContact CD2-CG 3.88Å; W673-R687 VanDerWaalsContact CE2-CD 3.43Å; W673-R687 HydrophobicContact CE3-CB 4.06Å; W673-R687 HydrophobicContact CE3-CG 3.87Å; W673-R687 HydrophobicContact CG-CB 4.48Å; W673-R687 HydrophobicContact CH2-CG 3.98Å; W673-R687 HydrophobicContact CZ2-CG 4Å; W673-R687 VanDerWaalsContact CZ2-NE 3.27Å; W673-R687 HydrophobicContact CZ3-CB 4.49Å; W673-R687 HydrophobicContact CZ3-CG 3.92Å; W673-E703 HydrophobicContact CH2-CB 4.13Å; W673-E703 HydrophobicContact CH2-CG 3.82Å; W673-K705 HydrophobicContact CE3-CB 4.48Å; W673-K705 HydrophobicContact CH2-CB 3.5Å; W673-K705 HydrophobicContact CZ2-CB 4.12Å; W673-K705 HydrophobicContact CZ2-CD 4.33Å; W673-K705 HydrophobicContact CZ3-CB 3.71Å
674	N	77.9	Confident	68.7	Low	98 Å²	98	77.7 Å²	77.7	52%	0.524	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-63.9	167.8	169.4	-72.4	-43	0	0	0	111.9	H685 S686	N674-H685 VanDerWaalsContact O-CB 3.27Å; N674-H685 WeakPolarHBondContact O-CB 3.34Å; N674-H685 PolarHBondContact O-ND1 2.77Å; N674-S686 WeakPolarHBondContact CB-O 3.43Å; N674-S686 PolarHBondContact N-O 2.81Å; N674-S686 PolarHBondContact ND2-O 2.83Å; N674-S686 PolarHBondContact ND2-OG 3.42Å; N674-S686 VanDerWaalsContact ND2-OG 3.08Å
675	K	70.6	Confident	69.8	Low	200 Å²	200	74.2 Å²	74.2	87%	0.87	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-64.9	150.8	170.3	-66.2	-175.7	179.4	-179.7	0	110.4
676	C	77.4	Confident	70.6	Confident	28 Å²	28	71.3 Å²	71.3	19%	0.189	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-66.2	143.6	179	-158.9	0	0	0	0	111.6	V678 C707 N708	C676-V678 VanDerWaalsContact C-N 3.28Å; C676-V678 PolarHBondContact O-N 2.8Å; C676-V678 PolarHBondContact SG-O 2.73Å; C676-V678 VanDerWaalsContact SG-O 3.42Å; C676-C707 VanDerWaalsContact CA-SG 3.5Å; C676-C707 HydrophobicContact CB-CB 3.9Å; C676-C707 WeakPolarHBondContact CB-SG 3.37Å; C676-C707 VanDerWaalsContact SG-C 3.57Å; C676-C707 WeakPolarHBondContact SG-CB 3.45Å; C676-C707 CovalentContact SG-SG 2.03Å; C676-C707 PolarHBondContact SG-SG 2.78Å; C676-N708 WeakPolarHBondContact CB-ND2 3.41Å
677	S	71.6	Confident	71	Confident	79 Å²	79	68.7 Å²	68.7	55%	0.552	40%	0.397	S	S	*	.	S	Bend	trans	-65.8	-25.2	-178.4	64.6	0	0	0	0	114.6	G683 I684	S677-G683 WeakPolarHBondContact OG-CA 3.35Å; S677-I684 WeakPolarHBondContact CB-O 3.47Å; S677-I684 PolarHBondContact N-O 2.94Å; S677-I684 PolarHBondContact OG-N 2.74Å; S677-I684 PolarHBondContact OG-O 2.9Å
678	V	61.3	Low	71.4	Confident	59 Å²	59	72 Å²	72	36%	0.358	42%	0.415	S	S	.	.	S	Bend	trans	-142.7	156.7	173.3	-72	0	0	0	0	111.1	C676 N708	C676-V678 VanDerWaalsContact C-N 3.28Å; C676-V678 PolarHBondContact O-N 2.8Å; C676-V678 PolarHBondContact SG-O 2.73Å; C676-V678 VanDerWaalsContact SG-O 3.42Å; V678-N708 PolarHBondContact O-ND2 2.89Å
679	N	66.6	Low	71.3	Confident	149 Å²	149	73.6 Å²	73.6	80%	0.797	42%	0.418	S	S	*	.	S	Bend	trans	-84.7	-19.4	-172.1	-66.5	-11.1	0	0	0	114.3
680	C	67.4	Low	71.5	Confident	33 Å²	33	71.5 Å²	71.5	22%	0.223	40%	0.403	C	S	.	.	S	Bend	trans	-156.1	168.8	176.3	54.7	0	0	0	0	109.2	C712	C680-C712 HydrophobicContact CB-CB 4.07Å; C680-C712 WeakPolarHBondContact CB-SG 3.29Å; C680-C712 VanDerWaalsContact SG-CA 3.54Å; C680-C712 WeakPolarHBondContact SG-CB 3.43Å; C680-C712 CovalentContact SG-SG 2.04Å; C680-C712 PolarHBondContact SG-SG 3.37Å
681	G	61.4	Low	71.1	Confident	54 Å²	54	69.8 Å²	69.8	56%	0.557	40%	0.402	S	S	*	.	S	Bend	trans	81.5	7	176.7	0	0	0	0	0	115.8	N708 E710	G681-N708 PolarHBondContact N-O 3.34Å; G681-E710 PolarHBondContact N-O 3.5Å
682	G	68.2	Low	70.5	Confident	43 Å²	43	72.7 Å²	72.7	44%	0.443	41%	0.408	S	S	.	.			trans	88.6	95.4	-179.2	0	0	0	0	0	113.3	N708	G682-N708 WeakPolarHBondContact CA-O 3.47Å; G682-N708 PolarHBondContact N-O 2.87Å
683	G	70.2	Confident	70.1	Confident	4 Å²	4	73.5 Å²	73.5	4%	0.041	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	-177.5	169.3	0	0	0	0	0	112.9	S677 T706 C707	S677-G683 WeakPolarHBondContact OG-CA 3.35Å; G683-T706 CarbonylContact O-C 3.56Å; G683-T706 VanDerWaalsContact O-CA 3.26Å; G683-T706 WeakPolarHBondContact O-CA 3.25Å; G683-C707 PolarHBondContact N-O 2.76Å; G683-C707 PolarHBondContact O-N 2.73Å
684	I	64.9	Low	69.3	Low	88 Å²	88	70.8 Å²	70.8	45%	0.451	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	150.2	171.5	52.4	169.3	0	0	0	111.2	S677 K705 T706	S677-I684 WeakPolarHBondContact CB-O 3.47Å; S677-I684 PolarHBondContact N-O 2.94Å; S677-I684 PolarHBondContact OG-N 2.74Å; S677-I684 PolarHBondContact OG-O 2.9Å; I684-K705 CarbonylContact C-O 3.53Å; I684-K705 VanDerWaalsContact CA-O 3.31Å; I684-K705 WeakPolarHBondContact CA-O 3.38Å; I684-T706 HydrophobicContact CG2-CG2 3.99Å
685	H	75.4	Confident	68.4	Low	39 Å²	39	74.2 Å²	74.2	18%	0.181	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	161.9	164.4	64	175.3	0	0	0	111.2	W673 N674 Y704 K705	W673-H685 AromaticContact CD2-CE1 3.94Å; W673-H685 AromaticContact CD2-NE2 3.71Å; W673-H685 AromaticContact CE3-CD2 3.47Å; W673-H685 VanDerWaalsContact CE3-CD2 3.47Å; W673-H685 AromaticContact CE3-CG 3.9Å; W673-H685 AromaticContact CE3-NE2 3.67Å; W673-H685 AromaticContact CG-CE1 3.73Å; W673-H685 AromaticContact CG-NE2 3.99Å; W673-H685 AromaticContact CZ3-CD2 3.97Å; W673-H685 WeakPolarHBondContact CZ3-O 3.41Å; N674-H685 VanDerWaalsContact O-CB 3.27Å; N674-H685 WeakPolarHBondContact O-CB 3.34Å; N674-H685 PolarHBondContact O-ND1 2.77Å; H685-Y704 WeakPolarHBondContact O-CA 3.31Å; H685-K705 PolarHBondContact CD2-O 3.25Å; H685-K705 PolarHBondContact N-O 2.85Å; H685-K705 PolarHBondContact O-N 2.84Å
686	S	74.4	Confident	67.8	Low	27 Å²	27	70.6 Å²	70.6	19%	0.189	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	160.1	-176.5	62.4	0	0	0	0	112.6	W673 N674 E703	W673-S686 VanDerWaalsContact CE3-C 3.47Å; N674-S686 WeakPolarHBondContact CB-O 3.43Å; N674-S686 PolarHBondContact N-O 2.81Å; N674-S686 PolarHBondContact ND2-O 2.83Å; N674-S686 PolarHBondContact ND2-OG 3.42Å; N674-S686 VanDerWaalsContact ND2-OG 3.08Å; S686-E703 CarbonylContact C-O 3.58Å; S686-E703 WeakPolarHBondContact CA-O 3.21Å; S686-E703 WeakPolarHBondContact CB-O 3.47Å
687	R	74.1	Confident	67.1	Low	60 Å²	60	70 Å²	70	23%	0.226	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	160.1	166.2	63.2	178	180	171.5	-3.1	110.8	W670 G671 P672 W673 V702 E703	W670-R687 HydrophobicContact CE3-CG 3.96Å; W670-R687 WeakPolarHBondContact CZ3-O 3.48Å; G671-R687 VanDerWaalsContact O-CD 3.31Å; G671-R687 WeakPolarHBondContact O-CD 3.46Å; P672-R687 WeakPolarHBondContact O-CB 3.15Å; W673-R687 HydrophobicContact CD2-CB 4.13Å; W673-R687 HydrophobicContact CD2-CG 3.88Å; W673-R687 VanDerWaalsContact CE2-CD 3.43Å; W673-R687 HydrophobicContact CE3-CB 4.06Å; W673-R687 HydrophobicContact CE3-CG 3.87Å; W673-R687 HydrophobicContact CG-CB 4.48Å; W673-R687 HydrophobicContact CH2-CG 3.98Å; W673-R687 HydrophobicContact CZ2-CG 4Å; W673-R687 VanDerWaalsContact CZ2-NE 3.27Å; W673-R687 HydrophobicContact CZ3-CB 4.49Å; W673-R687 HydrophobicContact CZ3-CG 3.92Å; R687-V702 CarbonylContact O-C 3.55Å; R687-V702 WeakPolarHBondContact O-CA 3.38Å; R687-V702 WeakPolarHBondContact O-CG1 3.33Å; R687-E703 HydrophobicContact CG-CB 4.18Å; R687-E703 IonicContact CZ-OE2 3.12Å; R687-E703 PolarHBondContact N-O 2.89Å; R687-E703 IonicContact NE-OE2 3.73Å; R687-E703 PolarHBondContact NE-OE2 2.84Å; R687-E703 IonicContact NH2-OE1 3.93Å; R687-E703 IonicContact NH2-OE2 2.7Å; R687-E703 PolarHBondContact NH2-OE2 2.87Å; R687-E703 PolarHBondContact O-N 2.86Å
688	Q	77.8	Confident	66.4	Low	128 Å²	128	72 Å²	72	60%	0.598	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.3	156	-173.9	-175.2	164.2	-5.8	0	0	112.1	G671 A701 V702	G671-Q688 PolarHBondContact N-O 2.71Å; Q688-A701 CarbonylContact C-O 3.59Å; Q688-A701 VanDerWaalsContact CA-O 3.32Å; Q688-A701 WeakPolarHBondContact CA-O 3.15Å; Q688-A701 WeakPolarHBondContact CG-O 3.23Å; Q688-V702 HydrophobicContact CB-CG2 4.23Å; Q688-V702 HydrophobicContact CG-CG2 3.95Å
689	R	71.4	Confident	66.4	Low	53 Å²	53	72 Å²	72	20%	0.2	43%	0.433	C	S	.	.			trans	-137	164.8	169.1	61.6	179.2	173.9	179.4	-3.6	110.7	W667 W670 C700 A701	W667-R689 HydrophobicContact CD2-CG 4.39Å; W667-R689 HydrophobicContact CE3-CG 3.7Å; W667-R689 HydrophobicContact CZ3-CG 4.09Å; W670-R689 HydrophobicContact CD2-CB 4.17Å; W670-R689 HydrophobicContact CD2-CG 3.99Å; W670-R689 HydrophobicContact CE3-CB 3.88Å; W670-R689 HydrophobicContact CE3-CG 3.72Å; W670-R689 HydrophobicContact CH2-CG 3.98Å; W670-R689 HydrophobicContact CZ2-CG 4.25Å; W670-R689 VanDerWaalsContact CZ2-CZ 3.4Å; W670-R689 HydrophobicContact CZ3-CB 4.31Å; W670-R689 HydrophobicContact CZ3-CG 3.72Å; R689-C700 PolarHBondContact NE-O 2.99Å; R689-C700 VanDerWaalsContact NE-O 3.11Å; R689-C700 PolarHBondContact NH2-O 2.89Å; R689-A701 PolarHBondContact N-O 3.35Å
690	S	71.4	Confident	66.1	Low	63 Å²	63	69.3 Å²	69.3	44%	0.441	43%	0.425	S	S	.	.			trans	-112.9	155.6	178.5	47.4	0	0	0	0	111.5	S668	S668-S690 WeakPolarHBondContact CB-O 3.32Å; S668-S690 PolarHBondContact N-O 2.93Å; S668-S690 PolarHBondContact OG-N 3.15Å; S668-S690 PolarHBondContact OG-O 3.23Å; S668-S690 PolarHBondContact OG-OG 2.74Å
691	C	69.8	Low	66.1	Low	33 Å²	33	69.4 Å²	69.4	22%	0.223	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	137.3	167	-171.9	0	0	0	0	108.7	W667 G694 C697	W667-C691 HydrophobicContact CE3-CB 4.43Å; W667-C691 HydrophobicContact CZ3-CB 4.31Å; C691-G694 PolarHBondContact SG-O 2.83Å; C691-C697 VanDerWaalsContact CA-SG 3.53Å; C691-C697 HydrophobicContact CB-CB 3.67Å; C691-C697 WeakPolarHBondContact CB-SG 3.42Å; C691-C697 VanDerWaalsContact SG-CA 3.56Å; C691-C697 WeakPolarHBondContact SG-CB 2.99Å; C691-C697 PolarHBondContact SG-N 2.87Å; C691-C697 CovalentContact SG-SG 2.03Å; C691-C697 PolarHBondContact SG-SG 2.69Å
692	E	63	Low	66.4	Low	91 Å²	91	69 Å²	69	43%	0.425	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	141.6	176.7	-74	179.5	-169.4	0	0	110.4	I665 F666 S668 G694	I665-E692 WeakPolarHBondContact CG2-O 2.95Å; F666-E692 HydrophobicContact CE2-CB 4.27Å; F666-E692 PolarHBondContact O-N 2.85Å; S668-E692 VanDerWaalsContact CB-OE1 3.24Å; S668-E692 WeakPolarHBondContact CB-OE1 3.45Å; E692-G694 PolarHBondContact O-N 2.85Å
693	N	61.3	Low	66.6	Low	136 Å²	136	70.4 Å²	70.4	73%	0.727	41%	0.41	S	S	*	.	S	Bend	trans	59	20.6	-172.9	-59.2	-40.4	0	0	0	115.9
694	G	59.6	Low	66.7	Low	21 Å²	21	77.7 Å²	77.7	22%	0.216	44%	0.437	C	S	.	.	S	Bend	trans	-168.6	157.9	171.5	0	0	0	0	0	114	C691 E692	C691-G694 PolarHBondContact SG-O 2.83Å; E692-G694 PolarHBondContact O-N 2.85Å
695	N	58.7	Low	66.9	Low	170 Å²	170	79.5 Å²	79.5	91%	0.909	44%	0.442	S	S	*	.	S	Bend	trans	-80.2	-17.3	-176.8	-64.6	-0.1	0	0	0	113.2
696	T	57.6	Low	66.5	Low	125 Å²	125	82.8 Å²	82.8	77%	0.767	47%	0.465	S	S	*	.			trans	-146.3	107.5	-176.2	37.3	0	0	0	0	111.2
697	C	63.6	Low	66.2	Low	16 Å²	16	82.3 Å²	82.3	11%	0.108	46%	0.462	C	S	.	.			trans	-94.5	146.1	169.3	-77.4	0	0	0	0	110.1	F666 W667 C691 G699	F666-C697 PolarHBondContact O-SG 2.89Å; W667-C697 HydrophobicContact CD2-CB 3.59Å; W667-C697 HydrophobicContact CE3-CB 4.04Å; W667-C697 HydrophobicContact CG-CB 4.11Å; W667-C697 HydrophobicContact CH2-CB 3.85Å; W667-C697 HydrophobicContact CZ2-CB 3.4Å; W667-C697 VanDerWaalsContact CZ2-O 3.28Å; W667-C697 WeakPolarHBondContact CZ2-O 3.28Å; W667-C697 HydrophobicContact CZ3-CB 4.16Å; C691-C697 VanDerWaalsContact CA-SG 3.53Å; C691-C697 HydrophobicContact CB-CB 3.67Å; C691-C697 WeakPolarHBondContact CB-SG 3.42Å; C691-C697 VanDerWaalsContact SG-CA 3.56Å; C691-C697 WeakPolarHBondContact SG-CB 2.99Å; C691-C697 PolarHBondContact SG-N 2.87Å; C691-C697 CovalentContact SG-SG 2.03Å; C691-C697 PolarHBondContact SG-SG 2.69Å; C697-G699 PolarHBondContact O-N 2.83Å
698	P	56.6	Low	65.9	Low	121 Å²	121	82.7 Å²	82.7	79%	0.786	47%	0.468	S	S	*	.	S	Bend	trans	-73.9	124	176.6	28.4	-32.8	0	0	0	111.7	W667	W667-P698 PolarHBondContact NE1-O 3.43Å
699	G	60.7	Low	64.9	Low	57 Å²	57	81.8 Å²	81.8	59%	0.588	47%	0.473	S	S	*	.	S	Bend	trans	123.8	178.8	178.6	0	0	0	0	0	113.3	W667 C697	W667-G699 VanDerWaalsContact CZ2-O 3.31Å; W667-G699 WeakPolarHBondContact CZ2-O 3.26Å; C697-G699 PolarHBondContact O-N 2.83Å
700	C	60.6	Low	64.2	Low	93 Å²	93	87 Å²	87	63%	0.628	50%	0.5	S	S	*	.			trans	-79	135.6	178.1	-58.7	0	0	0	0	111.6	W670 R689	W670-C700 WeakPolarHBondContact CH2-O 3.5Å; R689-C700 PolarHBondContact NE-O 2.99Å; R689-C700 VanDerWaalsContact NE-O 3.11Å; R689-C700 PolarHBondContact NH2-O 2.89Å
701	A	66.8	Low	63.4	Low	36 Å²	36	89 Å²	89	30%	0.298	51%	0.514	S	S	.	.	S	Bend	trans	-82.7	-20	172.4	0	0	0	0	0	113.2	W667 W670 Q688 R689	W667-A701 HydrophobicContact CH2-CB 3.81Å; W667-A701 HydrophobicContact CZ3-CB 3.86Å; W670-A701 WeakPolarHBondContact CZ3-O 3.34Å; Q688-A701 CarbonylContact C-O 3.59Å; Q688-A701 VanDerWaalsContact CA-O 3.32Å; Q688-A701 WeakPolarHBondContact CA-O 3.15Å; Q688-A701 WeakPolarHBondContact CG-O 3.23Å; R689-A701 PolarHBondContact N-O 3.35Å
702	V	69.5	Low	63.1	Low	46 Å²	46	88.3 Å²	88.3	28%	0.279	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	138.2	178.7	-176.6	0	0	0	0	109.1	R687 Q688 Y704	R687-V702 CarbonylContact O-C 3.55Å; R687-V702 WeakPolarHBondContact O-CA 3.38Å; R687-V702 WeakPolarHBondContact O-CG1 3.33Å; Q688-V702 HydrophobicContact CB-CG2 4.23Å; Q688-V702 HydrophobicContact CG-CG2 3.95Å; V702-Y704 HydrophobicContact CB-CE2 4.35Å; V702-Y704 HydrophobicContact CG1-CD2 4.27Å; V702-Y704 HydrophobicContact CG1-CE2 3.63Å
703	E	70.8	Confident	62.9	Low	71 Å²	71	88.8 Å²	88.8	33%	0.332	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	145	175.1	-166.3	-174.1	-164.7	0	0	109.3	W670 W673 S686 R687	W670-E703 HydrophobicContact CE3-CB 4.36Å; W670-E703 HydrophobicContact CH2-CB 3.64Å; W670-E703 HydrophobicContact CZ2-CB 4.06Å; W670-E703 HydrophobicContact CZ3-CB 3.79Å; W673-E703 HydrophobicContact CH2-CB 4.13Å; W673-E703 HydrophobicContact CH2-CG 3.82Å; S686-E703 CarbonylContact C-O 3.58Å; S686-E703 WeakPolarHBondContact CA-O 3.21Å; S686-E703 WeakPolarHBondContact CB-O 3.47Å; R687-E703 HydrophobicContact CG-CB 4.18Å; R687-E703 IonicContact CZ-OE2 3.12Å; R687-E703 PolarHBondContact N-O 2.89Å; R687-E703 IonicContact NE-OE2 3.73Å; R687-E703 PolarHBondContact NE-OE2 2.84Å; R687-E703 IonicContact NH2-OE1 3.93Å; R687-E703 IonicContact NH2-OE2 2.7Å; R687-E703 PolarHBondContact NH2-OE2 2.87Å; R687-E703 PolarHBondContact O-N 2.86Å
704	Y	74	Confident	62.7	Low	157 Å²	157	87.1 Å²	87.1	62%	0.616	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.3	143.7	177.8	-65.1	-92.8	0	0	0	110.2	H685 V702	H685-Y704 WeakPolarHBondContact O-CA 3.31Å; V702-Y704 HydrophobicContact CB-CE2 4.35Å; V702-Y704 HydrophobicContact CG1-CD2 4.27Å; V702-Y704 HydrophobicContact CG1-CE2 3.63Å
705	K	67.6	Low	62.7	Low	127 Å²	127	87.9 Å²	87.9	55%	0.552	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.1	150.8	176.9	-174.1	174.1	179	178.5	0	110.9	W673 I684 H685	W673-K705 HydrophobicContact CE3-CB 4.48Å; W673-K705 HydrophobicContact CH2-CB 3.5Å; W673-K705 HydrophobicContact CZ2-CB 4.12Å; W673-K705 HydrophobicContact CZ2-CD 4.33Å; W673-K705 HydrophobicContact CZ3-CB 3.71Å; I684-K705 CarbonylContact C-O 3.53Å; I684-K705 VanDerWaalsContact CA-O 3.31Å; I684-K705 WeakPolarHBondContact CA-O 3.38Å; H685-K705 PolarHBondContact CD2-O 3.25Å; H685-K705 PolarHBondContact N-O 2.85Å; H685-K705 PolarHBondContact O-N 2.84Å
706	T	67.4	Low	62.6	Low	108 Å²	108	87.2 Å²	87.2	66%	0.663	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	147	174.2	45.3	0	0	0	0	112.4	G683 I684	G683-T706 CarbonylContact O-C 3.56Å; G683-T706 VanDerWaalsContact O-CA 3.26Å; G683-T706 WeakPolarHBondContact O-CA 3.25Å; I684-T706 HydrophobicContact CG2-CG2 3.99Å
707	C	68.9	Low	62.7	Low	17 Å²	17	88.7 Å²	88.7	12%	0.115	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	161.6	-175.9	46.2	0	0	0	0	110.6	C676 G683	C676-C707 VanDerWaalsContact CA-SG 3.5Å; C676-C707 HydrophobicContact CB-CB 3.9Å; C676-C707 WeakPolarHBondContact CB-SG 3.37Å; C676-C707 VanDerWaalsContact SG-C 3.57Å; C676-C707 WeakPolarHBondContact SG-CB 3.45Å; C676-C707 CovalentContact SG-SG 2.03Å; C676-C707 PolarHBondContact SG-SG 2.78Å; G683-C707 PolarHBondContact N-O 2.76Å; G683-C707 PolarHBondContact O-N 2.73Å
708	N	67	Low	62.5	Low	68 Å²	68	92.1 Å²	92.1	36%	0.364	50%	0.502	S	S	.	.			trans	48.6	54.3	-179.1	-56.2	-15.8	0	0	0	114.9	C676 V678 G681 G682 E710	C676-N708 WeakPolarHBondContact CB-ND2 3.41Å; V678-N708 PolarHBondContact O-ND2 2.89Å; G681-N708 PolarHBondContact N-O 3.34Å; G682-N708 WeakPolarHBondContact CA-O 3.47Å; G682-N708 PolarHBondContact N-O 2.87Å; N708-E710 PolarHBondContact O-N 2.89Å
709	P	55.9	Low	62.7	Low	109 Å²	109	88.2 Å²	88.2	71%	0.708	48%	0.476	S	S	*	.			trans	-75.9	-2.7	-173.6	34.3	-38.5	0	0	0	115
710	E	58.5	Low	62.7	Low	161 Å²	161	90.9 Å²	90.9	75%	0.752	48%	0.483	S	S	*	.	S	Bend	trans	-75.9	141.8	-178.8	-63.1	-175.7	178.3	0	0	111.9	G681 N708	G681-E710 PolarHBondContact N-O 3.5Å; N708-E710 PolarHBondContact O-N 2.89Å
711	S	54.6	Low	63	Low	105 Å²	105	89 Å²	89	73%	0.734	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-64.9	138.1	-177.1	-50	0	0	0	0	112.6
712	C	62.3	Low	63.1	Low	19 Å²	19	89.6 Å²	89.6	13%	0.128	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-66.9	143.4	179.3	-62.5	0	0	0	0	112.6	C680	C680-C712 HydrophobicContact CB-CB 4.07Å; C680-C712 WeakPolarHBondContact CB-SG 3.29Å; C680-C712 VanDerWaalsContact SG-CA 3.54Å; C680-C712 WeakPolarHBondContact SG-CB 3.43Å; C680-C712 CovalentContact SG-SG 2.04Å; C680-C712 PolarHBondContact SG-SG 3.37Å
713	P	59.4	Low	62.9	Low	102 Å²	102	92.5 Å²	92.5	66%	0.662	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-67.9	145.9	-177	26.8	-34.6	0	0	0	113.7
714	E	55.8	Low	62.9	Low	100 Å²	100	91.7 Å²	91.7	47%	0.467	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	124.7	-177.7	-172.4	-171	141.5	0	0	112.4	R716 Q747	E714-R716 IonicContact OE1-NE 2.71Å; E714-R716 PolarHBondContact OE1-NE 2.95Å; E714-Q747 HydrophobicContact CB-CG 3.75Å; E714-Q747 HydrophobicContact CG-CG 4.15Å
715	V	59.4	Low	62.5	Low	37 Å²	37	88.6 Å²	88.6	22%	0.224	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	121.3	175.8	-177.7	0	0	0	0	110	R717 A746 P751 L754	V715-R717 HydrophobicContact CG1-CG 4.43Å; V715-A746 PolarHBondContact N-O 3.44Å; V715-A746 PolarHBondContact O-N 2.79Å; V715-P751 HydrophobicContact CG1-CB 4.45Å; V715-L754 HydrophobicContact CG1-CD1 4.16Å
716	R	57.3	Low	62.3	Low	157 Å²	157	86.6 Å²	86.6	59%	0.592	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.9	125.9	171.7	-75.8	-177.5	172.1	-168.6	4.2	110.6	E714 R745	E714-R716 IonicContact OE1-NE 2.71Å; E714-R716 PolarHBondContact OE1-NE 2.95Å; R716-R745 HydrophobicContact CG-CB 4.49Å; R716-R745 HydrophobicContact CG-CG 4.03Å
717	R	59.1	Low	62.3	Low	155 Å²	155	84.7 Å²	84.7	59%	0.585	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.7	145.4	167.6	-70.5	-170.3	175.1	-167.1	0.5	111.1	V715 C744	V715-R717 HydrophobicContact CG1-CG 4.43Å; R717-C744 PolarHBondContact N-O 2.76Å; R717-C744 VanDerWaalsContact N-O 3.15Å; R717-C744 PolarHBondContact O-N 3.12Å
718	N	60.1	Low	61.8	Low	89 Å²	89	89.9 Å²	89.9	48%	0.476	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	142.2	177.9	-54.5	-38.6	0	0	0	108.4	Y742 T743	N718-Y742 WeakPolarHBondContact CA-O 3.32Å; N718-T743 HydrophobicContact CB-CG2 4.36Å; N718-T743 VanDerWaalsContact OD1-CB 3.28Å; N718-T743 WeakPolarHBondContact OD1-CB 3.32Å; N718-T743 WeakPolarHBondContact OD1-CG2 3.41Å
719	T	62	Low	61.4	Low	38 Å²	38	92.2 Å²	92.2	23%	0.233	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-66.3	159.5	168.4	68.8	0	0	0	0	110.2	Y742 F756	T719-Y742 PolarHBondContact N-O 2.8Å; T719-Y742 PolarHBondContact OG1-N 2.97Å; T719-F756 HydrophobicContact CG2-CD1 4.43Å; T719-F756 HydrophobicContact CG2-CE1 3.94Å
720	P	60.4	Low	61.4	Low	114 Å²	114	91 Å²	91	74%	0.74	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-50.6	153.2	158	-24.1	34.9	0	0	0	110.8
721	W	66.8	Low	61.3	Low	54 Å²	54	93 Å²	93	21%	0.205	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-69.2	142.9	166	-69.9	110	0	0	0	109.7	R739 F740 R741 K760 E762	W721-R739 HydrophobicContact CB-CG 4.38Å; W721-R739 HydrophobicContact CD2-CG 4.28Å; W721-R739 HydrophobicContact CE3-CG 3.85Å; W721-R739 HydrophobicContact CZ3-CG 4.47Å; W721-F740 WeakPolarHBondContact CA-O 3.39Å; W721-R741 HydrophobicContact CD2-CB 3.89Å; W721-R741 HydrophobicContact CD2-CG 3.83Å; W721-R741 HydrophobicContact CE3-CB 3.71Å; W721-R741 HydrophobicContact CE3-CG 3.75Å; W721-R741 HydrophobicContact CG-CB 4.33Å; W721-R741 HydrophobicContact CH2-CG 3.97Å; W721-R741 HydrophobicContact CZ2-CG 4.08Å; W721-R741 HydrophobicContact CZ3-CB 4.17Å; W721-R741 HydrophobicContact CZ3-CG 3.82Å; W721-K760 HydrophobicContact CH2-CG 4.47Å; W721-K760 WeakPolarHBondContact CZ3-O 3.3Å; W721-E762 HydrophobicContact CE3-CB 4.42Å; W721-E762 HydrophobicContact CH2-CB 3.6Å; W721-E762 HydrophobicContact CH2-CG 4.47Å; W721-E762 HydrophobicContact CZ2-CB 4.13Å; W721-E762 WeakPolarHBondContact CZ2-OE1 3.43Å; W721-E762 HydrophobicContact CZ3-CB 3.76Å
722	T	67.3	Low	61.3	Low	48 Å²	48	95.1 Å²	95.1	29%	0.294	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-59.1	162.1	166.2	61.8	0	0	0	0	110.7	R739 F740	T722-R739 WeakPolarHBondContact O-CB 3.09Å; T722-R739 WeakPolarHBondContact OG1-CA 3.5Å; T722-R739 WeakPolarHBondContact OG1-CB 3.49Å; T722-F740 PolarHBondContact N-O 3.12Å; T722-F740 PolarHBondContact OG1-N 3.11Å
723	P	66.8	Low	61.1	Low	106 Å²	106	95.2 Å²	95.2	69%	0.688	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-50.4	154.8	159.4	-25.4	35.7	0	0	0	111.7	M725	P723-M725 PolarHBondContact O-N 3.06Å
724	W	71.2	Confident	61.1	Low	55 Å²	55	92.2 Å²	92.2	21%	0.208	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-70.3	122.6	171.2	-71.5	107.1	0	0	0	109.5	E737 R739 E762 R764	W724-E737 HydrophobicContact CB-CB 4.14Å; W724-E737 WeakPolarHBondContact CB-OE2 3.45Å; W724-E737 HydrophobicContact CE3-CB 4.03Å; W724-R739 HydrophobicContact CD2-CB 4.19Å; W724-R739 HydrophobicContact CD2-CG 3.94Å; W724-R739 HydrophobicContact CE3-CB 4.01Å; W724-R739 HydrophobicContact CE3-CG 3.8Å; W724-R739 HydrophobicContact CH2-CG 3.89Å; W724-R739 HydrophobicContact CZ2-CG 4.01Å; W724-R739 HydrophobicContact CZ3-CB 4.38Å; W724-R739 HydrophobicContact CZ3-CG 3.77Å; W724-E762 HydrophobicContact CH2-CB 4.32Å; W724-E762 HydrophobicContact CH2-CG 4.03Å; W724-E762 WeakPolarHBondContact CZ3-O 3.21Å; W724-R764 HydrophobicContact CD2-CG 4.18Å; W724-R764 HydrophobicContact CE3-CG 3.83Å; W724-R764 HydrophobicContact CH2-CB 3.97Å; W724-R764 HydrophobicContact CH2-CG 3.91Å; W724-R764 HydrophobicContact CZ2-CG 4.24Å; W724-R764 HydrophobicContact CZ3-CB 4.05Å; W724-R764 HydrophobicContact CZ3-CG 3.69Å
725	M	64.1	Low	61.5	Low	91 Å²	91	92.4 Å²	92.4	45%	0.448	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	132.5	179.5	-60.8	-174.3	-64.2	0	0	109.7	P723 E737 Q738 F740	P723-M725 PolarHBondContact O-N 3.06Å; M725-E737 CarbonylContact O-C 3.59Å; M725-E737 VanDerWaalsContact O-CA 3.32Å; M725-E737 WeakPolarHBondContact O-CA 3.26Å; M725-Q738 PolarHBondContact N-O 3.34Å; M725-Q738 PolarHBondContact O-N 3.38Å; M725-F740 HydrophobicContact CE-CD2 4.02Å; M725-F740 HydrophobicContact CE-CE2 3.79Å
726	P	63.8	Low	61.9	Low	85 Å²	85	93 Å²	93	55%	0.552	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	135.2	176	29.4	-33.9	0	0	0	110.2	Q736	P726-Q736 WeakPolarHBondContact CA-O 3.35Å
727	V	67.2	Low	62.6	Low	69 Å²	69	86.2 Å²	86.2	42%	0.418	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	-32.8	-174.8	-176.3	0	0	0	0	112.6	Q736 Q738	V727-Q736 PolarHBondContact N-O 3.12Å; V727-Q738 HydrophobicContact CG2-CB 3.73Å; V727-Q738 HydrophobicContact CG2-CG 3.63Å
728	N	59.8	Low	63.3	Low	125 Å²	125	81 Å²	81	67%	0.668	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-156.6	151.6	166.5	-97.6	-43.2	0	0	0	109.9	Q736	N728-Q736 PolarHBondContact O-N 2.86Å
729	I	57.5	Low	63.8	Low	117 Å²	117	79.8 Å²	79.8	60%	0.6	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.5	126.2	174.8	-57.6	175.2	0	0	0	106.9	R735	I729-R735 HydrophobicContact CG1-CB 4.44Å
730	T	56.5	Low	64.3	Low	85 Å²	85	79.7 Å²	79.7	52%	0.521	43%	0.425	S	S	.	.			trans	-87.9	157.3	176.4	60.4	0	0	0	0	110.6	N732 G733 A734	T730-N732 PolarHBondContact O-N 2.98Å; T730-G733 PolarHBondContact O-N 2.87Å; T730-A734 PolarHBondContact N-O 3.07Å; T730-A734 PolarHBondContact OG1-O 2.81Å
731	Q	55.3	Low	64.7	Low	201 Å²	201	77.6 Å²	77.6	94%	0.939	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-15	-176.1	-72.3	177.6	-22.9	0	0	114.2
732	N	55.8	Low	64.5	Low	151 Å²	151	79.6 Å²	79.6	81%	0.807	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	17.1	173.7	-62.8	1	0	0	0	113.2	T730 A734	T730-N732 PolarHBondContact O-N 2.98Å; N732-A734 VanDerWaalsContact C-N 3.29Å; N732-A734 PolarHBondContact O-N 2.81Å; N732-A734 VanDerWaalsContact O-N 3.11Å
733	G	57.5	Low	64.3	Low	20 Å²	20	78.8 Å²	78.8	21%	0.206	41%	0.405	C	S	.	.	S	Bend	trans	81	-18.8	167	0	0	0	0	0	117.1	T730 R735 N768	T730-G733 PolarHBondContact O-N 2.87Å; G733-R735 PolarHBondContact O-N 2.73Å; G733-N768 PolarHBondContact O-OD1 2.94Å
734	A	59.7	Low	63.8	Low	39 Å²	39	74.1 Å²	74.1	32%	0.322	38%	0.376	S	S	.	.			trans	-63.5	134	174.7	0	0	0	0	0	111.3	T730 N732	T730-A734 PolarHBondContact N-O 3.07Å; T730-A734 PolarHBondContact OG1-O 2.81Å; N732-A734 VanDerWaalsContact C-N 3.29Å; N732-A734 PolarHBondContact O-N 2.81Å; N732-A734 VanDerWaalsContact O-N 3.11Å
735	R	62.9	Low	63.2	Low	104 Å²	104	78.5 Å²	78.5	39%	0.392	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	137.1	-174.4	71.1	-176.9	-166.1	-104	-1.4	112.5	I729 G733 E737 C766	I729-R735 HydrophobicContact CG1-CB 4.44Å; G733-R735 PolarHBondContact O-N 2.73Å; R735-E737 IonicContact CZ-OE1 3.01Å; R735-E737 IonicContact NE-OE1 3.9Å; R735-E737 PolarHBondContact NE-OE1 2.89Å; R735-E737 IonicContact NH2-OE1 3.38Å; R735-E737 PolarHBondContact NH2-OE1 3.37Å; R735-C766 HydrophobicContact CG-CB 4.12Å; R735-C766 PolarHBondContact N-O 3.22Å; R735-C766 PolarHBondContact O-N 2.85Å
736	Q	68	Low	62.6	Low	51 Å²	51	75.7 Å²	75.7	24%	0.238	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	128.9	173.5	-166.7	-174.8	14.3	0	0	109.8	P726 V727 N728 F765	P726-Q736 WeakPolarHBondContact CA-O 3.35Å; V727-Q736 PolarHBondContact N-O 3.12Å; N728-Q736 PolarHBondContact O-N 2.86Å; Q736-F765 HydrophobicContact CB-CD1 4Å; Q736-F765 HydrophobicContact CB-CE1 3.72Å; Q736-F765 HydrophobicContact CB-CZ 4.17Å; Q736-F765 HydrophobicContact CG-CD1 4.01Å; Q736-F765 HydrophobicContact CG-CD2 4.23Å; Q736-F765 HydrophobicContact CG-CE1 3.72Å; Q736-F765 HydrophobicContact CG-CE2 3.95Å; Q736-F765 HydrophobicContact CG-CG 4.27Å; Q736-F765 HydrophobicContact CG-CZ 3.68Å; Q736-F765 VanDerWaalsContact NE2-CE2 3.3Å
737	E	72.8	Confident	62.1	Low	13 Å²	13	77.6 Å²	77.6	6%	0.061	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	142.4	-179.7	-64.9	172.5	-171.6	0	0	110.6	W724 M725 R735 S763 R764	W724-E737 HydrophobicContact CB-CB 4.14Å; W724-E737 WeakPolarHBondContact CB-OE2 3.45Å; W724-E737 HydrophobicContact CE3-CB 4.03Å; M725-E737 CarbonylContact O-C 3.59Å; M725-E737 VanDerWaalsContact O-CA 3.32Å; M725-E737 WeakPolarHBondContact O-CA 3.26Å; R735-E737 IonicContact CZ-OE1 3.01Å; R735-E737 IonicContact NE-OE1 3.9Å; R735-E737 PolarHBondContact NE-OE1 2.89Å; R735-E737 IonicContact NH2-OE1 3.38Å; R735-E737 PolarHBondContact NH2-OE1 3.37Å; E737-S763 WeakPolarHBondContact O-CA 3.39Å; E737-R764 HydrophobicContact CB-CG 4.12Å; E737-R764 PolarHBondContact N-O 3.45Å; E737-R764 PolarHBondContact O-N 2.73Å; E737-R764 IonicContact OE2-CZ 3.2Å; E737-R764 IonicContact OE2-NE 2.88Å; E737-R764 PolarHBondContact OE2-NE 2.74Å; E737-R764 IonicContact OE2-NH2 2.69Å; E737-R764 PolarHBondContact OE2-NH2 2.76Å
738	Q	73.1	Confident	61.6	Low	47 Å²	47	77.1 Å²	77.1	22%	0.22	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	152.4	174.2	-64.3	-169.8	4.4	0	0	111.8	M725 V727 F740 E762	M725-Q738 PolarHBondContact N-O 3.34Å; M725-Q738 PolarHBondContact O-N 3.38Å; V727-Q738 HydrophobicContact CG2-CB 3.73Å; V727-Q738 HydrophobicContact CG2-CG 3.63Å; Q738-F740 HydrophobicContact CB-CZ 4.36Å; Q738-E762 WeakPolarHBondContact CA-O 3.28Å
739	R	72.1	Confident	61.3	Low	63 Å²	63	76 Å²	76	24%	0.238	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	162.3	170.3	66.8	-178.9	-174.6	178.6	-5.5	111.6	W721 T722 W724 E762	W721-R739 HydrophobicContact CB-CG 4.38Å; W721-R739 HydrophobicContact CD2-CG 4.28Å; W721-R739 HydrophobicContact CE3-CG 3.85Å; W721-R739 HydrophobicContact CZ3-CG 4.47Å; T722-R739 WeakPolarHBondContact O-CB 3.09Å; T722-R739 WeakPolarHBondContact OG1-CA 3.5Å; T722-R739 WeakPolarHBondContact OG1-CB 3.49Å; W724-R739 HydrophobicContact CD2-CB 4.19Å; W724-R739 HydrophobicContact CD2-CG 3.94Å; W724-R739 HydrophobicContact CE3-CB 4.01Å; W724-R739 HydrophobicContact CE3-CG 3.8Å; W724-R739 HydrophobicContact CH2-CG 3.89Å; W724-R739 HydrophobicContact CZ2-CG 4.01Å; W724-R739 HydrophobicContact CZ3-CB 4.38Å; W724-R739 HydrophobicContact CZ3-CG 3.77Å; R739-E762 HydrophobicContact CG-CB 4.21Å; R739-E762 IonicContact CZ-OE2 3.13Å; R739-E762 PolarHBondContact N-O 3.21Å; R739-E762 IonicContact NE-OE2 3.8Å; R739-E762 PolarHBondContact NE-OE2 2.72Å; R739-E762 IonicContact NH2-OE2 2.67Å; R739-E762 PolarHBondContact NH2-OE2 3.32Å; R739-E762 PolarHBondContact O-N 2.94Å
740	F	72.6	Confident	61.2	Low	35 Å²	35	74.1 Å²	74.1	15%	0.154	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	150.6	-173	-49.9	-73.6	0	0	0	111.8	W721 T722 M725 Q738 K759 K760 T761	W721-F740 WeakPolarHBondContact CA-O 3.39Å; T722-F740 PolarHBondContact N-O 3.12Å; T722-F740 PolarHBondContact OG1-N 3.11Å; M725-F740 HydrophobicContact CE-CD2 4.02Å; M725-F740 HydrophobicContact CE-CE2 3.79Å; Q738-F740 HydrophobicContact CB-CZ 4.36Å; F740-K759 HydrophobicContact CB-CG 4.34Å; F740-K759 HydrophobicContact CD1-CD 4.35Å; F740-K759 HydrophobicContact CD1-CG 4.5Å; F740-K760 VanDerWaalsContact CA-O 3.32Å; F740-K760 WeakPolarHBondContact CA-O 3.27Å; F740-T761 HydrophobicContact CD1-CG2 3.77Å; F740-T761 WeakPolarHBondContact CD1-OG1 3.28Å; F740-T761 HydrophobicContact CE1-CG2 3.44Å; F740-T761 VanDerWaalsContact CE1-CG2 3.44Å; F740-T761 WeakPolarHBondContact CE1-OG1 3.44Å; F740-T761 HydrophobicContact CZ-CG2 4.47Å
741	R	67.8	Low	61	Low	70 Å²	70	72.5 Å²	72.5	26%	0.264	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	159.3	165.2	75	176.7	179.6	-169.2	-2	110.8	W721 K759 K760	W721-R741 HydrophobicContact CD2-CB 3.89Å; W721-R741 HydrophobicContact CD2-CG 3.83Å; W721-R741 HydrophobicContact CE3-CB 3.71Å; W721-R741 HydrophobicContact CE3-CG 3.75Å; W721-R741 HydrophobicContact CG-CB 4.33Å; W721-R741 HydrophobicContact CH2-CG 3.97Å; W721-R741 HydrophobicContact CZ2-CG 4.08Å; W721-R741 HydrophobicContact CZ3-CB 4.17Å; W721-R741 HydrophobicContact CZ3-CG 3.82Å; R741-K759 CarbonylContact O-C 3.6Å; R741-K760 PolarHBondContact N-O 3.2Å; R741-K760 PolarHBondContact O-N 2.74Å
742	Y	63	Low	60.9	Low	96 Å²	96	70.1 Å²	70.1	38%	0.376	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	143.9	179.3	-63.5	-104.2	0	0	0	109.3	N718 T719 G757 K759	N718-Y742 WeakPolarHBondContact CA-O 3.32Å; T719-Y742 PolarHBondContact N-O 2.8Å; T719-Y742 PolarHBondContact OG1-N 2.97Å; Y742-G757 WeakPolarHBondContact CD1-O 3.4Å; Y742-K759 HydrophobicContact CD1-CB 3.95Å; Y742-K759 HydrophobicContact CE1-CB 3.64Å; Y742-K759 HydrophobicContact CE1-CD 4.35Å; Y742-K759 HydrophobicContact CE1-CG 4.03Å; Y742-K759 HydrophobicContact CE2-CG 4.39Å
743	T	62.1	Low	60.9	Low	31 Å²	31	70.4 Å²	70.4	19%	0.19	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	117.2	-179.3	71.9	0	0	0	0	110.4	N718 G757 R758	N718-T743 HydrophobicContact CB-CG2 4.36Å; N718-T743 VanDerWaalsContact OD1-CB 3.28Å; N718-T743 WeakPolarHBondContact OD1-CB 3.32Å; N718-T743 WeakPolarHBondContact OD1-CG2 3.41Å; T743-G757 CarbonylContact O-C 3.57Å; T743-G757 WeakPolarHBondContact O-CA 3.34Å; T743-R758 PolarHBondContact N-O 3.36Å
744	C	57.6	Low	60.7	Low	9 Å²	9	71.3 Å²	71.3	6%	0.061	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	140.1	-175.4	-48	0	0	0	0	109.6	R717 L754 G757	R717-C744 PolarHBondContact N-O 2.76Å; R717-C744 VanDerWaalsContact N-O 3.15Å; R717-C744 PolarHBondContact O-N 3.12Å; C744-L754 HydrophobicContact CB-CD2 3.72Å; C744-G757 PolarHBondContact SG-N 3.17Å; C744-G757 VanDerWaalsContact SG-N 3.37Å
745	R	57.8	Low	60.4	Low	147 Å²	147	78 Å²	78	56%	0.555	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.2	128.2	-178.9	-45.1	-169.4	-177.2	162.1	3	109.2	R716	R716-R745 HydrophobicContact CG-CB 4.49Å; R716-R745 HydrophobicContact CG-CG 4.03Å
746	A	51.6	Low	59.7	Low	32 Å²	32	81 Å²	81	26%	0.264	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	153.9	171.9	0	0	0	0	0	110	V715 L748 L754	V715-A746 PolarHBondContact N-O 3.44Å; V715-A746 PolarHBondContact O-N 2.79Å; A746-L748 HydrophobicContact CB-CD1 3.8Å; A746-L748 HydrophobicContact CB-CG 3.77Å; A746-L754 HydrophobicContact CB-CD2 4.26Å
747	Q	54.5	Low	59.3	Low	124 Å²	124	79.9 Å²	79.9	58%	0.579	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	108	163.9	-72.3	174.9	0.6	0	0	106.6	E714	E714-Q747 HydrophobicContact CB-CG 3.75Å; E714-Q747 HydrophobicContact CG-CG 4.15Å
748	L	54.9	Low	58.6	Low	60 Å²	60	89.9 Å²	89.9	31%	0.314	43%	0.429	S	S	.	.			trans	-135.8	148.7	-175.4	-68.2	172.6	0	0	0	109.7	A746 E753 L754	A746-L748 HydrophobicContact CB-CD1 3.8Å; A746-L748 HydrophobicContact CB-CG 3.77Å; L748-E753 WeakPolarHBondContact CD1-O 3.09Å; L748-L754 HydrophobicContact CD1-CG 4.33Å
749	S	54.8	Low	58.2	Low	102 Å²	102	92.8 Å²	92.8	71%	0.713	44%	0.441	S	S	*	.	S	Bend	trans	-76.4	-24.8	178.1	42.3	0	0	0	0	113.5
750	D	55.3	Low	57.8	Low	76 Å²	76	95.9 Å²	95.9	41%	0.406	46%	0.456	S	S	.	.	S	Bend	trans	-122.7	130	169	-167.2	-54.1	0	0	0	110.3	H752	D750-H752 PolarHBondContact O-N 3.18Å; D750-H752 WeakPolarHBondContact OD1-CB 3.44Å; D750-H752 IonicContact OD1-CE1 3.87Å; D750-H752 IonicContact OD1-CG 3.43Å; D750-H752 PolarHBondContact OD1-N 2.99Å; D750-H752 IonicContact OD1-ND1 2.74Å; D750-H752 PolarHBondContact OD1-ND1 3.46Å
751	P	51.1	Low	57.5	Low	52 Å²	52	97.4 Å²	97.4	34%	0.338	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	1.6	-179.1	30.5	-37.1	0	0	0	116	V715	V715-P751 HydrophobicContact CG1-CB 4.45Å
752	H	53.6	Low	57.6	Low	150 Å²	150	96.8 Å²	96.8	69%	0.694	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-19.6	-177.8	-61.4	90.3	0	0	0	115.1	D750 L754	D750-H752 PolarHBondContact O-N 3.18Å; D750-H752 WeakPolarHBondContact OD1-CB 3.44Å; D750-H752 IonicContact OD1-CE1 3.87Å; D750-H752 IonicContact OD1-CG 3.43Å; D750-H752 PolarHBondContact OD1-N 2.99Å; D750-H752 IonicContact OD1-ND1 2.74Å; D750-H752 PolarHBondContact OD1-ND1 3.46Å; H752-L754 VanDerWaalsContact C-N 3.32Å; H752-L754 PolarHBondContact O-N 3.09Å; H752-L754 VanDerWaalsContact O-N 3.14Å
753	E	56.2	Low	57.7	Low	157 Å²	157	95.2 Å²	95.2	73%	0.734	47%	0.471	S	S	*	.			trans	-90.7	48.7	-174.4	-59.6	-166	139.7	0	0	113.8	L748	L748-E753 WeakPolarHBondContact CD1-O 3.09Å
754	L	52.6	Low	57.8	Low	40 Å²	40	96.4 Å²	96.4	21%	0.209	47%	0.472	C	S	.	.			trans	-97.8	110.7	-169.5	-109.4	160.1	0	0	0	114	V715 C744 A746 L748 H752	V715-L754 HydrophobicContact CG1-CD1 4.16Å; C744-L754 HydrophobicContact CB-CD2 3.72Å; A746-L754 HydrophobicContact CB-CD2 4.26Å; L748-L754 HydrophobicContact CD1-CG 4.33Å; H752-L754 VanDerWaalsContact C-N 3.32Å; H752-L754 PolarHBondContact O-N 3.09Å; H752-L754 VanDerWaalsContact O-N 3.14Å
755	Q	53.9	Low	58.2	Low	179 Å²	179	102.5 Å²	102.5	84%	0.836	50%	0.498	S	S	*	.			trans	-86.5	160.8	172.8	-61.8	-171.1	4.6	0	0	113
756	F	49.3	Very low	58.5	Low	167 Å²	167	95.8 Å²	95.8	73%	0.732	47%	0.473	S	S	*	.			trans	-83.4	130.1	-160.3	-74.7	-81.4	0	0	0	116.1	T719	T719-F756 HydrophobicContact CG2-CD1 4.43Å; T719-F756 HydrophobicContact CG2-CE1 3.94Å
757	G	58.7	Low	59	Low	28 Å²	28	98.2 Å²	98.2	29%	0.289	49%	0.486	S	S	.	.			trans	-98.7	-173.2	177.6	0	0	0	0	0	115.1	Y742 T743 C744	Y742-G757 WeakPolarHBondContact CD1-O 3.4Å; T743-G757 CarbonylContact O-C 3.57Å; T743-G757 WeakPolarHBondContact O-CA 3.34Å; C744-G757 PolarHBondContact SG-N 3.17Å; C744-G757 VanDerWaalsContact SG-N 3.37Å
758	R	58	Low	59.2	Low	223 Å²	223	97 Å²	97	84%	0.842	48%	0.484	S	S	*	.			trans	-62.1	149	-168.3	-66.5	-178.4	178.6	176.6	-0.5	114.7	T743	T743-R758 PolarHBondContact N-O 3.36Å
759	K	64	Low	59.4	Low	107 Å²	107	101.2 Å²	101.2	47%	0.465	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	138.3	176.9	-173.4	178.5	175.7	178.2	0	111.9	F740 R741 Y742	F740-K759 HydrophobicContact CB-CG 4.34Å; F740-K759 HydrophobicContact CD1-CD 4.35Å; F740-K759 HydrophobicContact CD1-CG 4.5Å; R741-K759 CarbonylContact O-C 3.6Å; Y742-K759 HydrophobicContact CD1-CB 3.95Å; Y742-K759 HydrophobicContact CE1-CB 3.64Å; Y742-K759 HydrophobicContact CE1-CD 4.35Å; Y742-K759 HydrophobicContact CE1-CG 4.03Å; Y742-K759 HydrophobicContact CE2-CG 4.39Å
760	K	64.7	Low	59.5	Low	128 Å²	128	99.9 Å²	99.9	56%	0.557	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.5	142.8	165.7	-167.7	179.2	-177.7	-171.4	0	109.9	W721 F740 R741	W721-K760 HydrophobicContact CH2-CG 4.47Å; W721-K760 WeakPolarHBondContact CZ3-O 3.3Å; F740-K760 VanDerWaalsContact CA-O 3.32Å; F740-K760 WeakPolarHBondContact CA-O 3.27Å; R741-K760 PolarHBondContact N-O 3.2Å; R741-K760 PolarHBondContact O-N 2.74Å
761	T	64.9	Low	59.5	Low	67 Å²	67	100.3 Å²	100.3	41%	0.411	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	152.9	179.4	-51.7	0	0	0	0	111.2	F740	F740-T761 HydrophobicContact CD1-CG2 3.77Å; F740-T761 WeakPolarHBondContact CD1-OG1 3.28Å; F740-T761 HydrophobicContact CE1-CG2 3.44Å; F740-T761 VanDerWaalsContact CE1-CG2 3.44Å; F740-T761 WeakPolarHBondContact CE1-OG1 3.44Å; F740-T761 HydrophobicContact CZ-CG2 4.47Å
762	E	70.3	Confident	59.6	Low	58 Å²	58	102.6 Å²	102.6	27%	0.271	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	143.2	166.7	-163.4	175.9	-102.1	0	0	108.6	W721 W724 Q738 R739	W721-E762 HydrophobicContact CE3-CB 4.42Å; W721-E762 HydrophobicContact CH2-CB 3.6Å; W721-E762 HydrophobicContact CH2-CG 4.47Å; W721-E762 HydrophobicContact CZ2-CB 4.13Å; W721-E762 WeakPolarHBondContact CZ2-OE1 3.43Å; W721-E762 HydrophobicContact CZ3-CB 3.76Å; W724-E762 HydrophobicContact CH2-CB 4.32Å; W724-E762 HydrophobicContact CH2-CG 4.03Å; W724-E762 WeakPolarHBondContact CZ3-O 3.21Å; Q738-E762 WeakPolarHBondContact CA-O 3.28Å; R739-E762 HydrophobicContact CG-CB 4.21Å; R739-E762 IonicContact CZ-OE2 3.13Å; R739-E762 PolarHBondContact N-O 3.21Å; R739-E762 IonicContact NE-OE2 3.8Å; R739-E762 PolarHBondContact NE-OE2 2.72Å; R739-E762 IonicContact NH2-OE2 2.67Å; R739-E762 PolarHBondContact NH2-OE2 3.32Å; R739-E762 PolarHBondContact O-N 2.94Å
763	S	64.8	Low	59.8	Low	62 Å²	62	101.4 Å²	101.4	43%	0.434	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	137.6	-173.4	58.4	0	0	0	0	111.6	E737	E737-S763 WeakPolarHBondContact O-CA 3.39Å
764	R	66	Low	59.9	Low	56 Å²	56	95 Å²	95	21%	0.211	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	151.8	175.6	72.3	-173.5	-173.1	161.5	0.6	111.6	W724 E737 C774	W724-R764 HydrophobicContact CD2-CG 4.18Å; W724-R764 HydrophobicContact CE3-CG 3.83Å; W724-R764 HydrophobicContact CH2-CB 3.97Å; W724-R764 HydrophobicContact CH2-CG 3.91Å; W724-R764 HydrophobicContact CZ2-CG 4.24Å; W724-R764 HydrophobicContact CZ3-CB 4.05Å; W724-R764 HydrophobicContact CZ3-CG 3.69Å; E737-R764 HydrophobicContact CB-CG 4.12Å; E737-R764 PolarHBondContact N-O 3.45Å; E737-R764 PolarHBondContact O-N 2.73Å; E737-R764 IonicContact OE2-CZ 3.2Å; E737-R764 IonicContact OE2-NE 2.88Å; E737-R764 PolarHBondContact OE2-NE 2.74Å; E737-R764 IonicContact OE2-NH2 2.69Å; E737-R764 PolarHBondContact OE2-NH2 2.76Å; R764-C774 HydrophobicContact CB-CB 4.32Å; R764-C774 HydrophobicContact CG-CB 4.18Å
765	F	65.4	Low	60.1	Low	138 Å²	138	100 Å²	100	61%	0.605	54%	0.544	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.8	126.7	174.1	-87.1	-83.9	0	0	0	110.1	Q736 C774	Q736-F765 HydrophobicContact CB-CD1 4Å; Q736-F765 HydrophobicContact CB-CE1 3.72Å; Q736-F765 HydrophobicContact CB-CZ 4.17Å; Q736-F765 HydrophobicContact CG-CD1 4.01Å; Q736-F765 HydrophobicContact CG-CD2 4.23Å; Q736-F765 HydrophobicContact CG-CE1 3.72Å; Q736-F765 HydrophobicContact CG-CE2 3.95Å; Q736-F765 HydrophobicContact CG-CG 4.27Å; Q736-F765 HydrophobicContact CG-CZ 3.68Å; Q736-F765 VanDerWaalsContact NE2-CE2 3.3Å; F765-C774 WeakPolarHBondContact O-CB 3.42Å
766	C	64.4	Low	60	Low	5 Å²	5	95.4 Å²	95.4	3%	0.034	53%	0.528	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	115.1	180	-63.6	0	0	0	0	110	R735 C774	R735-C766 HydrophobicContact CG-CB 4.12Å; R735-C766 PolarHBondContact N-O 3.22Å; R735-C766 PolarHBondContact O-N 2.85Å; C766-C774 VanDerWaalsContact CA-SG 3.58Å; C766-C774 HydrophobicContact CB-CB 4.14Å; C766-C774 WeakPolarHBondContact CB-SG 3.45Å; C766-C774 WeakPolarHBondContact SG-CB 3.37Å; C766-C774 CovalentContact SG-SG 2.04Å; C766-C774 PolarHBondContact SG-SG 3.12Å
767	P	61.1	Low	59.8	Low	83 Å²	83	95.2 Å²	95.2	54%	0.539	54%	0.535	S	S	.	.			trans	-61.6	163.3	169.2	-20.3	33.2	0	0	0	111.9
768	N	59.6	Low	58.8	Low	99 Å²	99	99.2 Å²	99.2	53%	0.529	56%	0.558	S	S	.	*	S	Bend	trans	-93.2	-2.8	-171.3	-154.2	35.5	0	0	0	114.8	G733 G770	G733-N768 PolarHBondContact O-OD1 2.94Å; N768-G770 PolarHBondContact O-N 2.84Å
769	D	59.6	Low	57.8	Low	148 Å²	148	96.7 Å²	96.7	79%	0.791	56%	0.56	S	S	*	*	S	Bend	trans	-78.2	35.6	-173.8	-68.1	-41.9	0	0	0	114.8	S771	D769-S771 PolarHBondContact O-N 3.15Å
770	G	55.8	Low	56.3	Low	74 Å²	74	97.9 Å²	97.9	76%	0.763	58%	0.576	S	S	*	*	S	Bend	trans	69.2	-19.2	169	0	0	0	0	0	117.6	N768 A772	N768-G770 PolarHBondContact O-N 2.84Å; G770-A772 PolarHBondContact O-N 3.49Å
771	S	56	Low	54.9	Low	86 Å²	86	98.8 Å²	98.8	60%	0.601	59%	0.587	S	S	*	*			trans	-75.2	114.5	178.7	58.3	0	0	0	0	111.8	D769 V773	D769-S771 PolarHBondContact O-N 3.15Å; S771-V773 VanDerWaalsContact C-N 3.28Å; S771-V773 PolarHBondContact O-N 3.31Å
772	A	52	Low	53.5	Low	99 Å²	99	103.2 Å²	103.2	82%	0.818	61%	0.609	S	S	*	*			trans	-81.8	37.9	-163.3	0	0	0	0	0	116.6	G770	G770-A772 PolarHBondContact O-N 3.49Å
773	V	58.5	Low	52	Low	125 Å²	125	107.9 Å²	107.9	76%	0.758	63%	0.634	S	S	*	*			trans	-125.6	134.2	178.7	-173.7	0	0	0	0	110.3	S771	S771-V773 VanDerWaalsContact C-N 3.28Å; S771-V773 PolarHBondContact O-N 3.31Å
774	C	59.1	Low	50.8	Low	23 Å²	23	113.5 Å²	113.5	16%	0.155	66%	0.659	C	S	.	*			trans	-138.9	130.8	-178.2	-34.1	0	0	0	0	108.5	R764 F765 C766	R764-C774 HydrophobicContact CB-CB 4.32Å; R764-C774 HydrophobicContact CG-CB 4.18Å; F765-C774 WeakPolarHBondContact O-CB 3.42Å; C766-C774 VanDerWaalsContact CA-SG 3.58Å; C766-C774 HydrophobicContact CB-CB 4.14Å; C766-C774 WeakPolarHBondContact CB-SG 3.45Å; C766-C774 WeakPolarHBondContact SG-CB 3.37Å; C766-C774 CovalentContact SG-SG 2.04Å; C766-C774 PolarHBondContact SG-SG 3.12Å
775	D	56.8	Low	49.2	Very low	145 Å²	145	120 Å²	120	78%	0.775	69%	0.689	S	S	*	*			trans	-94	160.4	-155.3	-150.6	-7.5	0	0	0	115.4
776	T	51.8	Low	47.6	Very low	83 Å²	83	120.6 Å²	120.6	51%	0.509	70%	0.703	S	S	.	*			trans	-151.7	137.7	-179.3	54.9	0	0	0	0	113.1
777	D	45	Very low	46.1	Very low	163 Å²	163	124 Å²	124	87%	0.872	74%	0.74	S	S	*	*			trans	-105.2	114.8	-157.6	-173.4	11.8	0	0	0	114.5
778	S	37	Very low	44.7	Very low	111 Å²	111	130.2 Å²	130.2	78%	0.776	76%	0.758	S	S	*	*			trans	-176.9	113.9	159.1	43.2	0	0	0	0	114.2
779	L	36.1	Very low	43.4	Very low	170 Å²	170	132.7 Å²	132.7	89%	0.89	78%	0.777	S	S	*	*			trans	-161.6	166.3	167.6	-119.2	163.7	0	0	0	110.4
780	V	34.4	Very low	42.3	Very low	132 Å²	132	131.3 Å²	131.3	80%	0.8	78%	0.779	S	S	*	*			trans	70.8	116	-169.4	-168.1	0	0	0	0	111.3
781	D	34.7	Very low	41.6	Very low	147 Å²	147	131 Å²	131	79%	0.786	77%	0.769	S	S	*	*				-166.9	112.7	74.1	-160.4	19.8	0	0	0	111.3
782	D	34.3	Very low	41.4	Very low	161 Å²	161	137.7 Å²	137.7	86%	0.861	78%	0.782	S	S	*	*			trans	-153.7	43.9	173	-164.1	15.3	0	0	0	112.2
783	L	39.5	Very low	41.7	Very low	155 Å²	155	138 Å²	138	81%	0.812	77%	0.768	S	S	*	*			trans	-142.7	95.5	175.1	-77.3	178.2	0	0	0	111.3
784	L	39.4	Very low	42.1	Very low	180 Å²	180	135.8 Å²	135.8	94%	0.942	75%	0.751	S	S	*	*			trans	-173.4	114.4	143.3	-104	161.8	0	0	0	111
785	K	32.1	Very low	42.7	Very low	194 Å²	194	138.5 Å²	138.5	84%	0.843	76%	0.764	S	S	*	*			trans	-144.7	147.4	176.9	-129.7	174.3	-170.2	168	0	110.5
786	T	32.9	Very low	43.5	Very low	149 Å²	149	132.4 Å²	132.4	91%	0.914	74%	0.735	S	S	*	*			trans	80.2	146.9	174.2	77.9	0	0	0	0	118
787	G	31.7	Very low	44.8	Very low	78 Å²	78	129.3 Å²	129.3	80%	0.804	72%	0.72	S	S	*	*			trans	153.8	105.9	-177.8	0	0	0	0	0	110.4
788	K	32	Very low	46.5	Very low	212 Å²	212	124.2 Å²	124.2	92%	0.922	69%	0.689	S	S	*	*			trans	-130.1	138.5	-176.5	-105	-172.1	178	-179.2	0	110.9
789	T	33.3	Very low	48.6	Very low	151 Å²	151	120.3 Å²	120.3	93%	0.926	66%	0.662	S	S	*	*			trans	-136	163.5	154.5	44.4	0	0	0	0	109.6
790	S	36.5	Very low	50.7	Low	120 Å²	120	121.3 Å²	121.3	84%	0.839	66%	0.659	S	S	*	*			trans	-118.7	144.3	-155.2	-176.6	0	0	0	0	114.9
791	A	39.6	Very low	53	Low	67 Å²	67	118.4 Å²	118.4	55%	0.554	63%	0.634	S	S	*	*			trans	-125.8	157.7	155.6	0	0	0	0	0	109.4	I793	A791-I793 PolarHBondContact O-N 2.82Å
792	R	53.1	Low	55.1	Low	227 Å²	227	113.4 Å²	113.4	86%	0.857	62%	0.617	S	S	*	*			trans	-75.1	88.1	-173	-94.8	-173	171.6	-178.5	-1.5	113.4	N829	R792-N829 WeakPolarHBondContact O-CB 3.45Å; R792-N829 PolarHBondContact O-ND2 2.86Å
793	I	57.6	Low	57.2	Low	105 Å²	105	110.3 Å²	110.3	54%	0.538	61%	0.614	S	S	.	*			trans	-44.2	128.7	167.9	-67.1	174.3	0	0	0	112.1	A791 N795 N829	A791-I793 PolarHBondContact O-N 2.82Å; I793-N795 VanDerWaalsContact CG2-OD1 3.31Å; I793-N795 WeakPolarHBondContact CG2-OD1 3.08Å; I793-N829 WeakPolarHBondContact CA-O 3.39Å; I793-N829 WeakPolarHBondContact CG1-O 3.34Å
794	I	67.9	Low	59.2	Low	78 Å²	78	106 Å²	106	40%	0.4	59%	0.587	S	S	.	*	B	Isolated β-bridge	trans	-120	114.3	168.6	-62.5	176.2	0	0	0	107.3	P827 K828 G831	I794-P827 CarbonylContact O-C 3.54Å; I794-P827 VanDerWaalsContact O-CA 3.22Å; I794-P827 WeakPolarHBondContact O-CA 3.49Å; I794-K828 HydrophobicContact CB-CB 4.28Å; I794-K828 HydrophobicContact CD1-CB 4.4Å; I794-K828 PolarHBondContact N-O 2.82Å; I794-K828 PolarHBondContact O-N 2.92Å; I794-G831 WeakPolarHBondContact O-CA 3.3Å
795	N	70.9	Confident	61	Low	81 Å²	81	99.8 Å²	99.8	43%	0.433	56%	0.558	S	S	.	*			trans	-77	150.1	-178.5	-63.8	-22.2	0	0	0	112.1	I793 L832	I793-N795 VanDerWaalsContact CG2-OD1 3.31Å; I793-N795 WeakPolarHBondContact CG2-OD1 3.08Å; N795-L832 HydrophobicContact CB-CB 4.42Å; N795-L832 PolarHBondContact OD1-N 2.85Å
796	G	73.9	Confident	63	Low	16 Å²	16	95.6 Å²	95.6	17%	0.165	55%	0.554	C	S	.	*			trans	-78.3	137.9	179.8	0	0	0	0	0	113.1	P825 L832 C834	G796-P825 CarbonylContact C-O 3.6Å; G796-P825 WeakPolarHBondContact CA-O 3.26Å; G796-L832 PolarHBondContact N-O 3.38Å; G796-C834 PolarHBondContact O-SG 2.89Å; G796-C834 VanDerWaalsContact O-SG 3.4Å
797	G	78.8	Confident	65.1	Low	18 Å²	18	90 Å²	90	19%	0.186	52%	0.52	C	S	.	.			trans	-114.8	145.5	171	0	0	0	0	0	112.7	C822 T823 N824 P825 C834	G797-C822 CarbonylContact O-C 3.43Å; G797-T823 PolarHBondContact O-N 2.96Å; G797-N824 CarbonylContact C-O 3.57Å; G797-N824 VanDerWaalsContact C-O 3.31Å; G797-N824 VanDerWaalsContact CA-O 3.27Å; G797-N824 WeakPolarHBondContact CA-O 3.46Å; G797-N824 CarbonylContact O-C 3.59Å; G797-N824 PolarHBondContact O-N 3.34Å; G797-P825 PolarHBondContact N-O 3.47Å; G797-C834 PolarHBondContact N-SG 3.06Å; G797-C834 VanDerWaalsContact N-SG 3.39Å; G797-C834 PolarHBondContact O-SG 2.84Å; G797-C834 VanDerWaalsContact O-SG 3.38Å
798	W	81.9	Confident	67.2	Low	56 Å²	56	89.2 Å²	89.2	21%	0.212	50%	0.502	C	S	.	.	P	Polyproline II helix	trans	-75	145.3	179.8	-71.4	115.8	0	0	0	112.5	R820 C822 C834 V835 G836 A838	W798-R820 VanDerWaalsContact CD1-CZ 3.5Å; W798-R820 HydrophobicContact CD2-CG 3.98Å; W798-R820 HydrophobicContact CE3-CB 4.46Å; W798-R820 HydrophobicContact CE3-CG 3.64Å; W798-R820 HydrophobicContact CG-CG 4.39Å; W798-R820 HydrophobicContact CZ3-CG 4.23Å; W798-C822 HydrophobicContact CE3-CB 4.12Å; W798-C822 HydrophobicContact CH2-CB 4.41Å; W798-C822 HydrophobicContact CZ3-CB 3.85Å; W798-C834 HydrophobicContact CD2-CB 3.57Å; W798-C834 HydrophobicContact CE3-CB 4.05Å; W798-C834 HydrophobicContact CG-CB 4.03Å; W798-C834 HydrophobicContact CH2-CB 3.91Å; W798-C834 HydrophobicContact CZ2-CB 3.43Å; W798-C834 VanDerWaalsContact CZ2-CB 3.43Å; W798-C834 WeakPolarHBondContact CZ2-O 3.46Å; W798-C834 HydrophobicContact CZ3-CB 4.21Å; W798-V835 PolarHBondContact NE1-O 2.94Å; W798-G836 WeakPolarHBondContact CZ2-O 3.09Å; W798-A838 HydrophobicContact CH2-CB 3.58Å; W798-A838 HydrophobicContact CZ3-CB 3.78Å
799	S	80.7	Confident	68.7	Low	30 Å²	30	84.4 Å²	84.4	21%	0.21	48%	0.478	C	S	.	.	P	Polyproline II helix	trans	-62.9	166.3	161.1	76.7	0	0	0	0	111.4	R820 T821	S799-R820 WeakPolarHBondContact OG-CB 3.28Å; S799-T821 WeakPolarHBondContact CB-O 3.49Å; S799-T821 PolarHBondContact N-O 3.01Å; S799-T821 PolarHBondContact OG-N 3.44Å; S799-T821 PolarHBondContact OG-O 2.93Å
800	F	78.9	Confident	70.2	Confident	190 Å²	190	84.3 Å²	84.3	83%	0.833	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-56.7	152.9	158.9	-67.4	-75.8	0	0	0	110.9
801	W	83.6	Confident	71.5	Confident	71 Å²	71	80.3 Å²	80.3	27%	0.269	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-68.6	139.4	174.5	-71.3	113.7	0	0	0	111.5	R818 K819 R820 E840	W801-R818 HydrophobicContact CB-CG 4.47Å; W801-R818 HydrophobicContact CD2-CG 4.1Å; W801-R818 HydrophobicContact CE3-CB 4.47Å; W801-R818 HydrophobicContact CE3-CG 3.77Å; W801-R818 HydrophobicContact CG-CG 4.44Å; W801-R818 HydrophobicContact CZ3-CG 4.32Å; W801-R818 WeakPolarHBondContact CZ3-O 3.19Å; W801-K819 VanDerWaalsContact CE3-C 3.49Å; W801-R820 HydrophobicContact CD2-CB 4.12Å; W801-R820 HydrophobicContact CD2-CG 4.12Å; W801-R820 HydrophobicContact CE3-CB 3.67Å; W801-R820 HydrophobicContact CE3-CG 3.65Å; W801-R820 HydrophobicContact CH2-CG 3.78Å; W801-R820 VanDerWaalsContact CH2-NE 3.29Å; W801-R820 HydrophobicContact CZ2-CG 4.26Å; W801-R820 VanDerWaalsContact CZ2-NE 3.25Å; W801-R820 HydrophobicContact CZ3-CB 3.99Å; W801-R820 HydrophobicContact CZ3-CG 3.47Å; W801-R820 VanDerWaalsContact CZ3-CG 3.47Å; W801-E840 HydrophobicContact CH2-CB 3.52Å; W801-E840 HydrophobicContact CZ2-CB 3.78Å; W801-E840 HydrophobicContact CZ2-CG 4.44Å; W801-E840 VanDerWaalsContact CZ2-OE2 3.23Å; W801-E840 WeakPolarHBondContact CZ2-OE2 3.42Å; W801-E840 HydrophobicContact CZ3-CB 3.9Å; W801-E840 PolarHBondContact NE1-OE2 3.49Å
802	G	79.3	Confident	72.4	Confident	42 Å²	42	81.5 Å²	81.5	43%	0.433	44%	0.438	S	S	.	.			trans	-69.3	175.3	164.4	0	0	0	0	0	112.8	K819	G802-K819 PolarHBondContact N-O 2.91Å
803	A	78.1	Confident	72.6	Confident	96 Å²	96	75.8 Å²	75.8	79%	0.793	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-62.3	156	173.6	0	0	0	0	0	112.2
804	W	80.6	Confident	73	Confident	65 Å²	65	70.8 Å²	70.8	25%	0.246	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-71.2	146.2	171.6	-69	106.8	0	0	0	111.5	R816 I817 R818 E840 Q842	W804-R816 HydrophobicContact CB-CG 4.42Å; W804-R816 HydrophobicContact CD2-CG 4.16Å; W804-R816 HydrophobicContact CE3-CB 4.33Å; W804-R816 HydrophobicContact CE3-CG 3.74Å; W804-R816 HydrophobicContact CG-CG 4.48Å; W804-R816 HydrophobicContact CZ3-CG 4.35Å; W804-R816 WeakPolarHBondContact CZ3-O 3.37Å; W804-I817 VanDerWaalsContact CE3-C 3.41Å; W804-R818 HydrophobicContact CD2-CB 4Å; W804-R818 HydrophobicContact CD2-CG 3.98Å; W804-R818 HydrophobicContact CE3-CB 3.82Å; W804-R818 HydrophobicContact CE3-CG 3.82Å; W804-R818 HydrophobicContact CG-CB 4.47Å; W804-R818 HydrophobicContact CH2-CG 3.84Å; W804-R818 HydrophobicContact CZ2-CG 4.01Å; W804-R818 HydrophobicContact CZ3-CB 4.21Å; W804-R818 HydrophobicContact CZ3-CG 3.75Å; W804-E840 HydrophobicContact CH2-CB 4.3Å; W804-E840 HydrophobicContact CH2-CG 3.95Å; W804-E840 WeakPolarHBondContact CZ3-O 3.39Å; W804-Q842 HydrophobicContact CE3-CB 4.42Å; W804-Q842 HydrophobicContact CH2-CB 3.41Å; W804-Q842 VanDerWaalsContact CH2-CB 3.41Å; W804-Q842 HydrophobicContact CZ2-CB 3.91Å; W804-Q842 HydrophobicContact CZ3-CB 3.69Å
805	S	76.9	Confident	73.2	Confident	49 Å²	49	71.7 Å²	71.7	34%	0.343	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-66	169.2	166.5	69.3	0	0	0	0	112.5	R816 I817	S805-R816 WeakPolarHBondContact O-CB 3.47Å; S805-R816 WeakPolarHBondContact OG-CA 3.29Å; S805-I817 PolarHBondContact N-O 2.79Å; S805-I817 PolarHBondContact OG-N 3.01Å
806	S	74.4	Confident	73.5	Confident	107 Å²	107	72 Å²	72	75%	0.748	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-54.8	158.1	154.2	37.6	0	0	0	0	111.3
807	C	78.3	Confident	73.7	Confident	31 Å²	31	73.2 Å²	73.2	21%	0.209	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-73	146.2	177.7	-160.2	0	0	0	0	110.9	R809 G814 C844	C807-R809 VanDerWaalsContact C-N 3.34Å; C807-R809 PolarHBondContact SG-O 2.99Å; C807-R809 VanDerWaalsContact SG-O 3.36Å; C807-G814 VanDerWaalsContact SG-C 3.58Å; C807-C844 VanDerWaalsContact CA-SG 3.59Å; C807-C844 HydrophobicContact CB-CB 4.01Å; C807-C844 WeakPolarHBondContact CB-SG 3.48Å; C807-C844 WeakPolarHBondContact SG-CB 3.24Å; C807-C844 CovalentContact SG-SG 2.03Å; C807-C844 PolarHBondContact SG-SG 2.76Å
808	S	75.3	Confident	73.7	Confident	62 Å²	62	75.4 Å²	75.4	43%	0.434	40%	0.399	S	S	.	.	S	Bend	trans	-77.9	-13	-178.7	63.6	0	0	0	0	115.1	F815	S808-F815 WeakPolarHBondContact CB-O 3.5Å; S808-F815 PolarHBondContact N-O 2.96Å; S808-F815 VanDerWaalsContact OG-CD1 3.22Å; S808-F815 WeakPolarHBondContact OG-CD1 3.44Å; S808-F815 WeakPolarHBondContact OG-CE1 3.42Å; S808-F815 PolarHBondContact OG-N 3.27Å; S808-F815 PolarHBondContact OG-O 2.96Å; S808-F815 VanDerWaalsContact OG-O 3.12Å
809	R	62.8	Low	73.7	Confident	110 Å²	110	78.2 Å²	78.2	42%	0.415	41%	0.413	S	S	.	.			trans	-144.4	146.2	173.4	-55.5	178.7	69.7	-170.8	2.5	109.8	C807 C811 E812 N845	C807-R809 VanDerWaalsContact C-N 3.34Å; C807-R809 PolarHBondContact SG-O 2.99Å; C807-R809 VanDerWaalsContact SG-O 3.36Å; R809-C811 WeakPolarHBondContact CB-O 3.34Å; R809-C811 PolarHBondContact NE-O 2.92Å; R809-E812 IonicContact CZ-OE2 2.77Å; R809-E812 VanDerWaalsContact NH1-CB 3.34Å; R809-E812 PolarHBondContact NH1-O 3.12Å; R809-E812 IonicContact NH1-OE2 3.17Å; R809-E812 PolarHBondContact NH1-OE2 3.09Å; R809-E812 IonicContact NH2-OE2 3.43Å; R809-E812 PolarHBondContact NH2-OE2 3.38Å; R809-N845 PolarHBondContact O-ND2 3.02Å
810	D	65.4	Low	73.7	Confident	150 Å²	150	79.3 Å²	79.3	80%	0.802	41%	0.413	S	S	*	.	S	Bend	trans	-83.3	-15	177.4	-59.9	-54.7	0	0	0	113.7
811	C	64.4	Low	73.7	Confident	35 Å²	35	74.1 Å²	74.1	24%	0.236	40%	0.397	C	S	.	.	S	Bend	trans	-150.8	166.7	174.5	56.3	0	0	0	0	110.6	R809 H847 C849	R809-C811 WeakPolarHBondContact CB-O 3.34Å; R809-C811 PolarHBondContact NE-O 2.92Å; C811-H847 WeakPolarHBondContact CB-O 3.1Å; C811-C849 HydrophobicContact CB-CB 4.09Å; C811-C849 WeakPolarHBondContact CB-SG 3.43Å; C811-C849 VanDerWaalsContact SG-CA 3.55Å; C811-C849 WeakPolarHBondContact SG-CB 3.37Å; C811-C849 CovalentContact SG-SG 2.04Å; C811-C849 PolarHBondContact SG-SG 3.18Å
812	E	57.3	Low	73.4	Confident	92 Å²	92	72.5 Å²	72.5	43%	0.43	40%	0.396	S	S	.	.	S	Bend	trans	53.1	62.1	-174.8	-73.2	-179	168.3	0	0	114.5	R809 N845 H847 C849	R809-E812 IonicContact CZ-OE2 2.77Å; R809-E812 VanDerWaalsContact NH1-CB 3.34Å; R809-E812 PolarHBondContact NH1-O 3.12Å; R809-E812 IonicContact NH1-OE2 3.17Å; R809-E812 PolarHBondContact NH1-OE2 3.09Å; R809-E812 IonicContact NH2-OE2 3.43Å; R809-E812 PolarHBondContact NH2-OE2 3.38Å; E812-N845 PolarHBondContact N-O 2.8Å; E812-H847 PolarHBondContact N-O 3.38Å; E812-C849 HydrophobicContact CG-CB 4.13Å; E812-C849 VanDerWaalsContact CG-SG 3.59Å
813	L	56.7	Low	73.2	Confident	107 Å²	107	73.8 Å²	73.8	56%	0.56	40%	0.395	S	S	*	.			trans	52.7	69.4	168.7	-68.2	166.4	0	0	0	112.1	D843 C844 N845 P846	L813-D843 HydrophobicContact CD2-CB 4.32Å; L813-C844 CarbonylContact C-O 3.44Å; L813-C844 WeakPolarHBondContact CA-O 3.46Å; L813-N845 PolarHBondContact N-O 2.97Å; L813-P846 HydrophobicContact CD2-CB 3.75Å; L813-P846 HydrophobicContact CG-CB 4.44Å
814	G	68	Low	72.8	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	173.4	159.7	0	0	0	0	0	110.8	C807 D843 C844	C807-G814 VanDerWaalsContact SG-C 3.58Å; G814-D843 CarbonylContact O-C 3.55Å; G814-D843 WeakPolarHBondContact O-CA 3.46Å; G814-C844 PolarHBondContact N-O 2.66Å; G814-C844 PolarHBondContact O-N 2.77Å; G814-C844 VanDerWaalsContact O-O 3.07Å
815	F	72.2	Confident	72	Confident	97 Å²	97	74.5 Å²	74.5	43%	0.425	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	151	172.7	62.3	-91.6	0	0	0	110.5	S808 I817 Y841 Q842	S808-F815 WeakPolarHBondContact CB-O 3.5Å; S808-F815 PolarHBondContact N-O 2.96Å; S808-F815 VanDerWaalsContact OG-CD1 3.22Å; S808-F815 WeakPolarHBondContact OG-CD1 3.44Å; S808-F815 WeakPolarHBondContact OG-CE1 3.42Å; S808-F815 PolarHBondContact OG-N 3.27Å; S808-F815 PolarHBondContact OG-O 2.96Å; S808-F815 VanDerWaalsContact OG-O 3.12Å; F815-I817 HydrophobicContact CD2-CG2 4.13Å; F815-I817 HydrophobicContact CE2-CG2 4.35Å; F815-Y841 AromaticContact CD2-CD1 3.97Å; F815-Y841 HydrophobicContact CD2-CD1 3.97Å; F815-Y841 HydrophobicContact CD2-CE1 4.49Å; F815-Y841 HydrophobicContact CE2-CD1 4.27Å; F815-Y841 HydrophobicContact CE2-CE1 4.34Å; F815-Q842 CarbonylContact C-O 3.31Å; F815-Q842 WeakPolarHBondContact CA-O 3.33Å
816	R	75.3	Confident	71.8	Confident	87 Å²	87	76.9 Å²	76.9	33%	0.328	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	153.9	170.8	59.2	-176.6	-169.5	-173.3	-2.1	109.8	W804 S805 Y841 Q842	W804-R816 HydrophobicContact CB-CG 4.42Å; W804-R816 HydrophobicContact CD2-CG 4.16Å; W804-R816 HydrophobicContact CE3-CB 4.33Å; W804-R816 HydrophobicContact CE3-CG 3.74Å; W804-R816 HydrophobicContact CG-CG 4.48Å; W804-R816 HydrophobicContact CZ3-CG 4.35Å; W804-R816 WeakPolarHBondContact CZ3-O 3.37Å; S805-R816 WeakPolarHBondContact O-CB 3.47Å; S805-R816 WeakPolarHBondContact OG-CA 3.29Å; R816-Y841 WeakPolarHBondContact O-CA 3.32Å; R816-Q842 HydrophobicContact CG-CB 4.32Å; R816-Q842 WeakPolarHBondContact CG-O 3.41Å; R816-Q842 PolarHBondContact N-O 3.4Å; R816-Q842 VanDerWaalsContact NE-OE1 3.08Å; R816-Q842 PolarHBondContact O-N 2.77Å
817	I	78.5	Confident	71.9	Confident	43 Å²	43	74.2 Å²	74.2	22%	0.221	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	147.6	-178.1	59.9	173	0	0	0	112.4	W804 S805 F815 E840 Y841	W804-I817 VanDerWaalsContact CE3-C 3.41Å; S805-I817 PolarHBondContact N-O 2.79Å; S805-I817 PolarHBondContact OG-N 3.01Å; F815-I817 HydrophobicContact CD2-CG2 4.13Å; F815-I817 HydrophobicContact CE2-CG2 4.35Å; I817-E840 VanDerWaalsContact CA-O 3.27Å; I817-E840 WeakPolarHBondContact CA-O 3.48Å; I817-Y841 HydrophobicContact CG2-CD1 3.4Å; I817-Y841 VanDerWaalsContact CG2-CD1 3.4Å; I817-Y841 HydrophobicContact CG2-CE1 3.54Å; I817-Y841 HydrophobicContact CG2-CG 4Å
818	R	78.6	Confident	71.2	Confident	63 Å²	63	78.2 Å²	78.2	24%	0.238	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	155.8	165.1	65.6	-179.2	-177.2	-168.2	-10.6	110.5	W801 W804 M839 E840	W801-R818 HydrophobicContact CB-CG 4.47Å; W801-R818 HydrophobicContact CD2-CG 4.1Å; W801-R818 HydrophobicContact CE3-CB 4.47Å; W801-R818 HydrophobicContact CE3-CG 3.77Å; W801-R818 HydrophobicContact CG-CG 4.44Å; W801-R818 HydrophobicContact CZ3-CG 4.32Å; W801-R818 WeakPolarHBondContact CZ3-O 3.19Å; W804-R818 HydrophobicContact CD2-CB 4Å; W804-R818 HydrophobicContact CD2-CG 3.98Å; W804-R818 HydrophobicContact CE3-CB 3.82Å; W804-R818 HydrophobicContact CE3-CG 3.82Å; W804-R818 HydrophobicContact CG-CB 4.47Å; W804-R818 HydrophobicContact CH2-CG 3.84Å; W804-R818 HydrophobicContact CZ2-CG 4.01Å; W804-R818 HydrophobicContact CZ3-CB 4.21Å; W804-R818 HydrophobicContact CZ3-CG 3.75Å; R818-M839 WeakPolarHBondContact O-CA 3.36Å; R818-E840 HydrophobicContact CG-CB 4.04Å; R818-E840 IonicContact CZ-OE1 2.63Å; R818-E840 IonicContact CZ-OE2 3.8Å; R818-E840 PolarHBondContact N-O 2.83Å; R818-E840 IonicContact NE-OE1 3.28Å; R818-E840 IonicContact NE-OE2 3.81Å; R818-E840 PolarHBondContact NE-OE2 3.33Å; R818-E840 IonicContact NH2-OE1 2.55Å; R818-E840 PolarHBondContact NH2-OE1 2.66Å; R818-E840 IonicContact NH2-OE2 3.78Å; R818-E840 PolarHBondContact NH2-OE2 2.71Å; R818-E840 PolarHBondContact O-N 2.69Å
819	K	82.9	Confident	70.4	Confident	115 Å²	115	80 Å²	80	50%	0.5	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	152.9	-173.3	-57.4	-171.7	-177.9	-177.6	0	111.5	W801 G802 A838 M839	W801-K819 VanDerWaalsContact CE3-C 3.49Å; G802-K819 PolarHBondContact N-O 2.91Å; K819-A838 WeakPolarHBondContact CA-O 3.44Å; K819-M839 HydrophobicContact CD-CE 4.25Å; K819-M839 HydrophobicContact CD-CG 4.35Å; K819-M839 HydrophobicContact CD-SD 4.01Å; K819-M839 VanDerWaalsContact CE-SD 3.53Å; K819-M839 HydrophobicContact CG-CG 4.01Å; K819-M839 HydrophobicContact CG-SD 4.22Å
820	R	79.3	Confident	70.2	Confident	53 Å²	53	77.9 Å²	77.9	20%	0.2	41%	0.411	C	S	.	.			trans	-141.1	156	174.1	62.8	-175.9	177.1	178.3	-6.9	110	W798 S799 W801 S837 A838	W798-R820 VanDerWaalsContact CD1-CZ 3.5Å; W798-R820 HydrophobicContact CD2-CG 3.98Å; W798-R820 HydrophobicContact CE3-CB 4.46Å; W798-R820 HydrophobicContact CE3-CG 3.64Å; W798-R820 HydrophobicContact CG-CG 4.39Å; W798-R820 HydrophobicContact CZ3-CG 4.23Å; S799-R820 WeakPolarHBondContact OG-CB 3.28Å; W801-R820 HydrophobicContact CD2-CB 4.12Å; W801-R820 HydrophobicContact CD2-CG 4.12Å; W801-R820 HydrophobicContact CE3-CB 3.67Å; W801-R820 HydrophobicContact CE3-CG 3.65Å; W801-R820 HydrophobicContact CH2-CG 3.78Å; W801-R820 VanDerWaalsContact CH2-NE 3.29Å; W801-R820 HydrophobicContact CZ2-CG 4.26Å; W801-R820 VanDerWaalsContact CZ2-NE 3.25Å; W801-R820 HydrophobicContact CZ3-CB 3.99Å; W801-R820 HydrophobicContact CZ3-CG 3.47Å; W801-R820 VanDerWaalsContact CZ3-CG 3.47Å; R820-S837 VanDerWaalsContact CZ-O 3.31Å; R820-S837 PolarHBondContact NE-O 3.46Å; R820-S837 PolarHBondContact NH2-O 2.83Å; R820-A838 PolarHBondContact N-O 2.78Å
821	T	80.2	Confident	70.2	Confident	82 Å²	82	71.6 Å²	71.6	50%	0.503	38%	0.382	S	S	.	.			trans	-116.5	151.9	-176.3	48.1	0	0	0	0	111.6	S799 T823	S799-T821 WeakPolarHBondContact CB-O 3.49Å; S799-T821 PolarHBondContact N-O 3.01Å; S799-T821 PolarHBondContact OG-N 3.44Å; S799-T821 PolarHBondContact OG-O 2.93Å; T821-T823 VanDerWaalsContact C-N 3.27Å; T821-T823 PolarHBondContact O-N 3.08Å; T821-T823 PolarHBondContact OG1-OG1 3.12Å
822	C	76.1	Confident	70.2	Confident	36 Å²	36	75.1 Å²	75.1	24%	0.243	40%	0.398	C	S	.	.	S	Bend	trans	-87.7	59.5	-173.2	-174.8	0	0	0	0	111.5	G797 W798 C834	G797-C822 CarbonylContact O-C 3.43Å; W798-C822 HydrophobicContact CE3-CB 4.12Å; W798-C822 HydrophobicContact CH2-CB 4.41Å; W798-C822 HydrophobicContact CZ3-CB 3.85Å; C822-C834 WeakPolarHBondContact CA-SG 3.5Å; C822-C834 HydrophobicContact CB-CB 3.88Å; C822-C834 WeakPolarHBondContact CB-SG 3.39Å; C822-C834 WeakPolarHBondContact SG-CB 3.44Å; C822-C834 PolarHBondContact SG-N 3Å; C822-C834 VanDerWaalsContact SG-N 3.41Å; C822-C834 CovalentContact SG-SG 2.03Å; C822-C834 PolarHBondContact SG-SG 3.1Å
823	T	76.4	Confident	70.9	Confident	70 Å²	70	75.2 Å²	75.2	43%	0.429	41%	0.406	S	S	.	.			trans	-122.1	0.9	-165.3	53.8	0	0	0	0	115.4	G797 T821 P825 E826	G797-T823 PolarHBondContact O-N 2.96Å; T821-T823 VanDerWaalsContact C-N 3.27Å; T821-T823 PolarHBondContact O-N 3.08Å; T821-T823 PolarHBondContact OG1-OG1 3.12Å; T823-P825 VanDerWaalsContact C-C 3.47Å; T823-E826 HydrophobicContact CG2-CG 4.38Å
824	N	69.3	Low	71.9	Confident	102 Å²	102	70.9 Å²	70.9	55%	0.545	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.4	78.4	-172.1	-173.6	44.8	0	0	0	113	G797	G797-N824 CarbonylContact C-O 3.57Å; G797-N824 VanDerWaalsContact C-O 3.31Å; G797-N824 VanDerWaalsContact CA-O 3.27Å; G797-N824 WeakPolarHBondContact CA-O 3.46Å; G797-N824 CarbonylContact O-C 3.59Å; G797-N824 PolarHBondContact O-N 3.34Å
825	P	64.8	Low	72	Confident	74 Å²	74	77.1 Å²	77.1	48%	0.481	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	cis	-84	165.7	-6.8	35.3	-35.8	0	0	0	112.5	G796 G797 T823	G796-P825 CarbonylContact C-O 3.6Å; G796-P825 WeakPolarHBondContact CA-O 3.26Å; G797-P825 PolarHBondContact N-O 3.47Å; T823-P825 VanDerWaalsContact C-C 3.47Å
826	E	72.6	Confident	71.9	Confident	99 Å²	99	75.1 Å²	75.1	46%	0.463	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-70.1	141.9	168.5	-70.1	-178.6	150.9	0	0	112.1	T823 K828	T823-E826 HydrophobicContact CG2-CG 4.38Å; E826-K828 IonicContact OE2-NZ 2.76Å
827	P	75.5	Confident	71.4	Confident	50 Å²	50	74.2 Å²	74.2	33%	0.325	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-68.9	134	176	27.2	-32.2	0	0	0	112	I794	I794-P827 CarbonylContact O-C 3.54Å; I794-P827 VanDerWaalsContact O-CA 3.22Å; I794-P827 WeakPolarHBondContact O-CA 3.49Å
828	K	63.4	Low	71.2	Confident	115 Å²	115	74 Å²	74	50%	0.5	44%	0.44	S	S	.	.	B	Isolated β-bridge	trans	-138.3	161.2	179	-63.1	-172.8	-178.9	-178.6	0	111.6	I794 E826 G830 G831	I794-K828 HydrophobicContact CB-CB 4.28Å; I794-K828 HydrophobicContact CD1-CB 4.4Å; I794-K828 PolarHBondContact N-O 2.82Å; I794-K828 PolarHBondContact O-N 2.92Å; E826-K828 IonicContact OE2-NZ 2.76Å; K828-G830 VanDerWaalsContact C-N 3.31Å; K828-G830 PolarHBondContact O-N 2.72Å; K828-G831 PolarHBondContact O-N 3.06Å
829	N	58.8	Low	70.9	Confident	101 Å²	101	74.5 Å²	74.5	54%	0.54	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	35.8	174.3	-53.7	-20.2	0	0	0	115.4	R792 I793	R792-N829 WeakPolarHBondContact O-CB 3.45Å; R792-N829 PolarHBondContact O-ND2 2.86Å; I793-N829 WeakPolarHBondContact CA-O 3.39Å; I793-N829 WeakPolarHBondContact CG1-O 3.34Å
830	G	59.6	Low	70.6	Confident	64 Å²	64	71.9 Å²	71.9	66%	0.66	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.6	17.7	-174.6	0	0	0	0	0	114.8	K828	K828-G830 VanDerWaalsContact C-N 3.31Å; K828-G830 PolarHBondContact O-N 2.72Å
831	G	65.2	Low	70.3	Confident	18 Å²	18	76.5 Å²	76.5	19%	0.186	46%	0.455	C	S	.	.			trans	-42.1	135.9	168.4	0	0	0	0	0	114.9	I794 K828	I794-G831 WeakPolarHBondContact O-CA 3.3Å; K828-G831 PolarHBondContact O-N 3.06Å
832	L	64.8	Low	69.9	Low	110 Å²	110	76.3 Å²	76.3	58%	0.576	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-61.5	134.9	162.6	-67.7	173	0	0	0	109.1	N795 G796	N795-L832 HydrophobicContact CB-CB 4.42Å; N795-L832 PolarHBondContact OD1-N 2.85Å; G796-L832 PolarHBondContact N-O 3.38Å
833	P	71.5	Confident	69.5	Low	94 Å²	94	80.2 Å²	80.2	61%	0.61	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-66.5	160	174	30	-35.4	0	0	0	110.7	V835	P833-V835 PolarHBondContact O-N 3.07Å
834	C	76.7	Confident	69.2	Low	15 Å²	15	77.7 Å²	77.7	10%	0.101	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-57.3	122.9	-179.8	-59.7	0	0	0	0	111.7	G796 G797 W798 C822	G796-C834 PolarHBondContact O-SG 2.89Å; G796-C834 VanDerWaalsContact O-SG 3.4Å; G797-C834 PolarHBondContact N-SG 3.06Å; G797-C834 VanDerWaalsContact N-SG 3.39Å; G797-C834 PolarHBondContact O-SG 2.84Å; G797-C834 VanDerWaalsContact O-SG 3.38Å; W798-C834 HydrophobicContact CD2-CB 3.57Å; W798-C834 HydrophobicContact CE3-CB 4.05Å; W798-C834 HydrophobicContact CG-CB 4.03Å; W798-C834 HydrophobicContact CH2-CB 3.91Å; W798-C834 HydrophobicContact CZ2-CB 3.43Å; W798-C834 VanDerWaalsContact CZ2-CB 3.43Å; W798-C834 WeakPolarHBondContact CZ2-O 3.46Å; W798-C834 HydrophobicContact CZ3-CB 4.21Å; C822-C834 WeakPolarHBondContact CA-SG 3.5Å; C822-C834 HydrophobicContact CB-CB 3.88Å; C822-C834 WeakPolarHBondContact CB-SG 3.39Å; C822-C834 WeakPolarHBondContact SG-CB 3.44Å; C822-C834 PolarHBondContact SG-N 3Å; C822-C834 VanDerWaalsContact SG-N 3.41Å; C822-C834 CovalentContact SG-SG 2.03Å; C822-C834 PolarHBondContact SG-SG 3.1Å
835	V	71.3	Confident	68.9	Low	131 Å²	131	75.6 Å²	75.6	79%	0.794	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-82.2	141.7	-176.4	-177.6	0	0	0	0	110.9	W798 P833	W798-V835 PolarHBondContact NE1-O 2.94Å; P833-V835 PolarHBondContact O-N 3.07Å
836	G	69.8	Low	68.6	Low	55 Å²	55	76.4 Å²	76.4	57%	0.567	45%	0.445	S	S	*	.	S	Bend	trans	95	-179.7	-173	0	0	0	0	0	112.7	W798	W798-G836 WeakPolarHBondContact CZ2-O 3.09Å
837	S	65.1	Low	67.9	Low	68 Å²	68	78.1 Å²	78.1	48%	0.476	45%	0.453	S	S	.	.			trans	-81	144.7	-176.3	60.2	0	0	0	0	113.1	R820 M839	R820-S837 VanDerWaalsContact CZ-O 3.31Å; R820-S837 PolarHBondContact NE-O 3.46Å; R820-S837 PolarHBondContact NH2-O 2.83Å; S837-M839 WeakPolarHBondContact CB-O 3.46Å; S837-M839 PolarHBondContact OG-O 2.76Å
838	A	74.4	Confident	66.8	Low	38 Å²	38	81 Å²	81	31%	0.314	47%	0.472	S	S	.	.	S	Bend	trans	-75.6	-11.7	168.9	0	0	0	0	0	113.1	W798 K819 R820	W798-A838 HydrophobicContact CH2-CB 3.58Å; W798-A838 HydrophobicContact CZ3-CB 3.78Å; K819-A838 WeakPolarHBondContact CA-O 3.44Å; R820-A838 PolarHBondContact N-O 2.78Å
839	M	71.4	Confident	66.2	Low	75 Å²	75	76.8 Å²	76.8	37%	0.369	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	142.1	-177	-47.9	-165.3	-165.2	0	0	109.5	R818 K819 S837 Y841	R818-M839 WeakPolarHBondContact O-CA 3.36Å; K819-M839 HydrophobicContact CD-CE 4.25Å; K819-M839 HydrophobicContact CD-CG 4.35Å; K819-M839 HydrophobicContact CD-SD 4.01Å; K819-M839 VanDerWaalsContact CE-SD 3.53Å; K819-M839 HydrophobicContact CG-CG 4.01Å; K819-M839 HydrophobicContact CG-SD 4.22Å; S837-M839 WeakPolarHBondContact CB-O 3.46Å; S837-M839 PolarHBondContact OG-O 2.76Å; M839-Y841 HydrophobicContact CB-CE2 4.32Å
840	E	76.8	Confident	65.9	Low	60 Å²	60	77.9 Å²	77.9	28%	0.28	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	144	177.4	-170.9	-176.3	163.7	0	0	108.6	W801 W804 I817 R818	W801-E840 HydrophobicContact CH2-CB 3.52Å; W801-E840 HydrophobicContact CZ2-CB 3.78Å; W801-E840 HydrophobicContact CZ2-CG 4.44Å; W801-E840 VanDerWaalsContact CZ2-OE2 3.23Å; W801-E840 WeakPolarHBondContact CZ2-OE2 3.42Å; W801-E840 HydrophobicContact CZ3-CB 3.9Å; W801-E840 PolarHBondContact NE1-OE2 3.49Å; W804-E840 HydrophobicContact CH2-CB 4.3Å; W804-E840 HydrophobicContact CH2-CG 3.95Å; W804-E840 WeakPolarHBondContact CZ3-O 3.39Å; I817-E840 VanDerWaalsContact CA-O 3.27Å; I817-E840 WeakPolarHBondContact CA-O 3.48Å; R818-E840 HydrophobicContact CG-CB 4.04Å; R818-E840 IonicContact CZ-OE1 2.63Å; R818-E840 IonicContact CZ-OE2 3.8Å; R818-E840 PolarHBondContact N-O 2.83Å; R818-E840 IonicContact NE-OE1 3.28Å; R818-E840 IonicContact NE-OE2 3.81Å; R818-E840 PolarHBondContact NE-OE2 3.33Å; R818-E840 IonicContact NH2-OE1 2.55Å; R818-E840 PolarHBondContact NH2-OE1 2.66Å; R818-E840 IonicContact NH2-OE2 3.78Å; R818-E840 PolarHBondContact NH2-OE2 2.71Å; R818-E840 PolarHBondContact O-N 2.69Å
841	Y	72.3	Confident	65.5	Low	149 Å²	149	78.6 Å²	78.6	58%	0.584	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118	141.4	-175.6	-63.2	-105.3	0	0	0	108.3	F815 R816 I817 M839	F815-Y841 AromaticContact CD2-CD1 3.97Å; F815-Y841 HydrophobicContact CD2-CD1 3.97Å; F815-Y841 HydrophobicContact CD2-CE1 4.49Å; F815-Y841 HydrophobicContact CE2-CD1 4.27Å; F815-Y841 HydrophobicContact CE2-CE1 4.34Å; R816-Y841 WeakPolarHBondContact O-CA 3.32Å; I817-Y841 HydrophobicContact CG2-CD1 3.4Å; I817-Y841 VanDerWaalsContact CG2-CD1 3.4Å; I817-Y841 HydrophobicContact CG2-CE1 3.54Å; I817-Y841 HydrophobicContact CG2-CG 4Å; M839-Y841 HydrophobicContact CB-CE2 4.32Å
842	Q	73.3	Confident	64.9	Low	79 Å²	79	84.9 Å²	84.9	37%	0.369	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	134.1	174.5	176.5	174.8	58.1	0	0	110	W804 F815 R816	W804-Q842 HydrophobicContact CE3-CB 4.42Å; W804-Q842 HydrophobicContact CH2-CB 3.41Å; W804-Q842 VanDerWaalsContact CH2-CB 3.41Å; W804-Q842 HydrophobicContact CZ2-CB 3.91Å; W804-Q842 HydrophobicContact CZ3-CB 3.69Å; F815-Q842 CarbonylContact C-O 3.31Å; F815-Q842 WeakPolarHBondContact CA-O 3.33Å; R816-Q842 HydrophobicContact CG-CB 4.32Å; R816-Q842 WeakPolarHBondContact CG-O 3.41Å; R816-Q842 PolarHBondContact N-O 3.4Å; R816-Q842 VanDerWaalsContact NE-OE1 3.08Å; R816-Q842 PolarHBondContact O-N 2.77Å
843	D	65.9	Low	64.5	Low	117 Å²	117	80.5 Å²	80.5	63%	0.626	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	149.6	179.3	-51.8	-36.8	0	0	0	111.9	L813 G814	L813-D843 HydrophobicContact CD2-CB 4.32Å; G814-D843 CarbonylContact O-C 3.55Å; G814-D843 WeakPolarHBondContact O-CA 3.46Å
844	C	71	Confident	63.8	Low	17 Å²	17	78.6 Å²	78.6	12%	0.115	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	161.7	-177	42.7	0	0	0	0	110.9	C807 L813 G814	C807-C844 VanDerWaalsContact CA-SG 3.59Å; C807-C844 HydrophobicContact CB-CB 4.01Å; C807-C844 WeakPolarHBondContact CB-SG 3.48Å; C807-C844 WeakPolarHBondContact SG-CB 3.24Å; C807-C844 CovalentContact SG-SG 2.03Å; C807-C844 PolarHBondContact SG-SG 2.76Å; L813-C844 CarbonylContact C-O 3.44Å; L813-C844 WeakPolarHBondContact CA-O 3.46Å; G814-C844 PolarHBondContact N-O 2.66Å; G814-C844 PolarHBondContact O-N 2.77Å; G814-C844 VanDerWaalsContact O-O 3.07Å
845	N	63.6	Low	63.3	Low	59 Å²	59	80.2 Å²	80.2	32%	0.316	46%	0.457	S	S	.	.			trans	54.7	62.5	179.1	-57.7	-15.5	0	0	0	114.3	R809 E812 L813 H847	R809-N845 PolarHBondContact O-ND2 3.02Å; E812-N845 PolarHBondContact N-O 2.8Å; L813-N845 PolarHBondContact N-O 2.97Å; N845-H847 PolarHBondContact O-N 3.09Å; N845-H847 VanDerWaalsContact O-N 3.12Å
846	P	58.2	Low	62.8	Low	90 Å²	90	75.2 Å²	75.2	58%	0.584	43%	0.428	S	S	*	.			trans	-75.9	8.7	-176.1	34.7	-39	0	0	0	115	L813	L813-P846 HydrophobicContact CD2-CB 3.75Å; L813-P846 HydrophobicContact CG-CB 4.44Å
847	H	57.2	Low	62.1	Low	136 Å²	136	78 Å²	78	63%	0.63	44%	0.437	S	S	*	.	S	Bend	trans	-83.2	142.4	-177.5	-60	-67.3	0	0	0	111.3	C811 E812 N845	C811-H847 WeakPolarHBondContact CB-O 3.1Å; E812-H847 PolarHBondContact N-O 3.38Å; N845-H847 PolarHBondContact O-N 3.09Å; N845-H847 VanDerWaalsContact O-N 3.12Å
848	P	53.3	Low	62.1	Low	111 Å²	111	77.8 Å²	77.8	72%	0.721	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-69.4	145	-178	28.5	-35	0	0	0	112.4
849	C	49.2	Very low	61.7	Low	26 Å²	26	78.9 Å²	78.9	18%	0.176	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-80.9	157.1	176.1	-61.8	0	0	0	0	112	C811 E812	C811-C849 HydrophobicContact CB-CB 4.09Å; C811-C849 WeakPolarHBondContact CB-SG 3.43Å; C811-C849 VanDerWaalsContact SG-CA 3.55Å; C811-C849 WeakPolarHBondContact SG-CB 3.37Å; C811-C849 CovalentContact SG-SG 2.04Å; C811-C849 PolarHBondContact SG-SG 3.18Å; E812-C849 HydrophobicContact CG-CB 4.13Å; E812-C849 VanDerWaalsContact CG-SG 3.59Å
850	P	53.3	Low	60.9	Low	123 Å²	123	80.8 Å²	80.8	80%	0.799	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-60.1	135.1	164.6	-21.3	33.7	0	0	0	111.5
851	V	51.8	Low	60.4	Low	79 Å²	79	82.2 Å²	82.2	48%	0.479	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-94	117.8	-166.4	-176.2	0	0	0	0	111.5	P882	V851-P882 HydrophobicContact CG1-CB 4.22Å; V851-P882 HydrophobicContact CG1-CG 3.46Å; V851-P882 VanDerWaalsContact CG1-CG 3.46Å
852	K	51.7	Low	60	Low	151 Å²	151	77.9 Å²	77.9	66%	0.657	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-74.9	145	169.9	-66	-159	172	-149	0	110.8	D889	K852-D889 IonicContact NZ-OD2 2.76Å; K852-D889 PolarHBondContact NZ-OD2 3.13Å
853	G	56.6	Low	59.6	Low	18 Å²	18	83 Å²	83	19%	0.186	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-61.4	139.4	179.1	0	0	0	0	0	112.5	C891	G853-C891 VanDerWaalsContact C-SG 3.51Å; G853-C891 PolarHBondContact O-SG 3.27Å
854	S	56.6	Low	59.8	Low	53 Å²	53	79.1 Å²	79.1	37%	0.371	45%	0.447	S	S	.	.			trans	-129.2	149.7	-177.5	171.8	0	0	0	0	112	C879 T880 N881 P882 C891	S854-C879 CarbonylContact O-C 3.53Å; S854-T880 PolarHBondContact O-N 3.03Å; S854-T880 VanDerWaalsContact O-N 3.09Å; S854-N881 VanDerWaalsContact CB-O 3.25Å; S854-N881 WeakPolarHBondContact CB-O 3.38Å; S854-N881 PolarHBondContact O-N 2.94Å; S854-N881 PolarHBondContact OG-O 2.8Å; S854-P882 PolarHBondContact N-O 3.21Å; S854-C891 VanDerWaalsContact C-SG 3.55Å
855	W	66.1	Low	59.6	Low	50 Å²	50	81.7 Å²	81.7	19%	0.189	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-66	141.4	177.6	-64.7	111.5	0	0	0	112.1	R877 T878 C879 C891 I892 G893 H895	W855-R877 HydrophobicContact CB-CG 4.42Å; W855-R877 HydrophobicContact CD2-CG 3.94Å; W855-R877 HydrophobicContact CE3-CB 4.4Å; W855-R877 HydrophobicContact CE3-CG 3.63Å; W855-R877 HydrophobicContact CG-CG 4.31Å; W855-R877 HydrophobicContact CZ3-CG 4.21Å; W855-T878 CarbonylContact C-O 3.52Å; W855-T878 WeakPolarHBondContact CA-O 3.49Å; W855-C879 HydrophobicContact CE3-CB 4.22Å; W855-C879 HydrophobicContact CZ3-CB 4.12Å; W855-C891 HydrophobicContact CD2-CB 3.84Å; W855-C891 VanDerWaalsContact CE2-CB 3.43Å; W855-C891 HydrophobicContact CE3-CB 4.23Å; W855-C891 HydrophobicContact CG-CB 4.42Å; W855-C891 HydrophobicContact CH2-CB 3.91Å; W855-C891 HydrophobicContact CZ2-CB 3.47Å; W855-C891 VanDerWaalsContact CZ2-CB 3.47Å; W855-C891 WeakPolarHBondContact CZ2-O 3.34Å; W855-C891 HydrophobicContact CZ3-CB 4.27Å; W855-I892 PolarHBondContact NE1-O 2.93Å; W855-G893 WeakPolarHBondContact CZ2-O 3.33Å; W855-H895 HydrophobicContact CH2-CB 3.74Å; W855-H895 HydrophobicContact CZ3-CB 3.89Å
856	S	61.2	Low	59	Low	26 Å²	26	80.6 Å²	80.6	18%	0.182	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-69.8	170	163.4	61.5	0	0	0	0	111.6	T878	S856-T878 WeakPolarHBondContact CB-O 3.19Å; S856-T878 PolarHBondContact N-O 3.25Å; S856-T878 PolarHBondContact OG-N 3.33Å; S856-T878 PolarHBondContact OG-O 3.36Å; S856-T878 PolarHBondContact OG-OG1 2.03Å
857	C	55.6	Low	58.9	Low	113 Å²	113	82 Å²	82	76%	0.764	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-57.5	139.8	171.4	-61.2	0	0	0	0	110.4
858	W	65.6	Low	59	Low	64 Å²	64	76.9 Å²	76.9	24%	0.242	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-55.9	147.9	169.1	-68.4	113.6	0	0	0	111.3	R875 T876 R877 H895 E897	W858-R875 HydrophobicContact CB-CG 4.28Å; W858-R875 HydrophobicContact CD2-CG 3.9Å; W858-R875 HydrophobicContact CE3-CB 4.35Å; W858-R875 HydrophobicContact CE3-CG 3.64Å; W858-R875 HydrophobicContact CG-CG 4.23Å; W858-R875 HydrophobicContact CZ3-CG 4.21Å; W858-R875 WeakPolarHBondContact CZ3-O 3.4Å; W858-T876 CarbonylContact C-O 3.54Å; W858-T876 WeakPolarHBondContact CA-O 3.46Å; W858-T876 VanDerWaalsContact CE3-C 3.41Å; W858-R877 HydrophobicContact CD2-CB 4.05Å; W858-R877 HydrophobicContact CD2-CG 4.07Å; W858-R877 HydrophobicContact CE3-CB 3.64Å; W858-R877 HydrophobicContact CE3-CG 3.6Å; W858-R877 HydrophobicContact CH2-CG 3.83Å; W858-R877 VanDerWaalsContact CH2-NE 3.27Å; W858-R877 HydrophobicContact CZ2-CG 4.3Å; W858-R877 VanDerWaalsContact CZ2-NE 3.3Å; W858-R877 HydrophobicContact CZ3-CB 4.03Å; W858-R877 HydrophobicContact CZ3-CG 3.48Å; W858-R877 VanDerWaalsContact CZ3-CG 3.48Å; W858-H895 WeakPolarHBondContact CZ3-O 3.34Å; W858-E897 HydrophobicContact CH2-CB 3.39Å; W858-E897 HydrophobicContact CZ2-CB 3.73Å; W858-E897 HydrophobicContact CZ2-CG 4.43Å; W858-E897 WeakPolarHBondContact CZ2-OE2 3.12Å; W858-E897 HydrophobicContact CZ3-CB 3.86Å
859	T	65.3	Low	59.2	Low	60 Å²	60	74.1 Å²	74.1	37%	0.368	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-58.7	163	160.9	62.3	0	0	0	0	110.7	R875 T876	T859-R875 WeakPolarHBondContact OG1-CB 3.47Å; T859-T876 PolarHBondContact N-O 2.85Å; T859-T876 PolarHBondContact OG1-N 3.01Å
860	P	54.9	Low	59.9	Low	116 Å²	116	74.6 Å²	74.6	75%	0.753	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-49.5	152.2	156.2	-23.8	34.8	0	0	0	110.9
861	W	65.3	Low	60.3	Low	90 Å²	90	68.8 Å²	68.8	34%	0.341	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-62.5	144.3	167.9	-68.4	116.1	0	0	0	110.3	Y873 R875 E897 A899	W861-Y873 HydrophobicContact CB-CD2 4.36Å; W861-Y873 HydrophobicContact CB-CG 4.47Å; W861-Y873 AromaticContact CD2-CD2 3.49Å; W861-Y873 HydrophobicContact CD2-CD2 3.49Å; W861-Y873 VanDerWaalsContact CD2-CD2 3.49Å; W861-Y873 AromaticContact CD2-CE2 3.59Å; W861-Y873 HydrophobicContact CD2-CE2 3.59Å; W861-Y873 HydrophobicContact CD2-CG 4.41Å; W861-Y873 AromaticContact CE2-CE2 3.64Å; W861-Y873 AromaticContact CE3-CD2 3.22Å; W861-Y873 HydrophobicContact CE3-CD2 3.22Å; W861-Y873 AromaticContact CE3-CE2 3.68Å; W861-Y873 HydrophobicContact CE3-CE2 3.68Å; W861-Y873 HydrophobicContact CE3-CG 4.22Å; W861-Y873 HydrophobicContact CG-CD2 4.04Å; W861-Y873 HydrophobicContact CG-CE2 4.18Å; W861-Y873 HydrophobicContact CH2-CD2 4.09Å; W861-Y873 AromaticContact CH2-CE2 3.84Å; W861-Y873 HydrophobicContact CH2-CE2 3.84Å; W861-Y873 HydrophobicContact CZ2-CD2 4.34Å; W861-Y873 AromaticContact CZ2-CE2 3.78Å; W861-Y873 HydrophobicContact CZ2-CE2 3.78Å; W861-Y873 AromaticContact CZ3-CD2 3.53Å; W861-Y873 HydrophobicContact CZ3-CD2 3.53Å; W861-Y873 AromaticContact CZ3-CE2 3.78Å; W861-Y873 HydrophobicContact CZ3-CE2 3.78Å; W861-R875 HydrophobicContact CD2-CB 4.21Å; W861-R875 HydrophobicContact CD2-CG 4.03Å; W861-R875 HydrophobicContact CE3-CB 3.69Å; W861-R875 HydrophobicContact CE3-CG 3.53Å; W861-R875 HydrophobicContact CH2-CG 3.96Å; W861-R875 HydrophobicContact CZ2-CG 4.38Å; W861-R875 HydrophobicContact CZ3-CB 4.14Å; W861-R875 HydrophobicContact CZ3-CG 3.52Å; W861-E897 HydrophobicContact CH2-CB 4.49Å; W861-E897 HydrophobicContact CH2-CG 4Å; W861-E897 WeakPolarHBondContact CZ3-O 3.07Å; W861-A899 HydrophobicContact CH2-CB 4.36Å
862	S	64.2	Low	60.7	Low	58 Å²	58	69.6 Å²	69.6	41%	0.406	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-60.7	166.6	165.9	71.6	0	0	0	0	111.1	Y873 Q874	S862-Y873 WeakPolarHBondContact O-CB 3.18Å; S862-Y873 WeakPolarHBondContact OG-CA 3.09Å; S862-Q874 PolarHBondContact N-O 3.01Å; S862-Q874 PolarHBondContact OG-N 2.81Å
863	Q	64.1	Low	61.4	Low	186 Å²	186	65.9 Å²	65.9	87%	0.869	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-62.8	156	158.1	-66.3	-173	-6.8	0	0	109.7
864	C	70.9	Confident	61.9	Low	36 Å²	36	68.5 Å²	68.5	24%	0.243	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-67.8	133.7	178.9	-168	0	0	0	0	110.3	A866 C901 N902	C864-A866 PolarHBondContact O-N 3.2Å; C864-A866 PolarHBondContact SG-O 3.28Å; C864-C901 VanDerWaalsContact CA-SG 3.56Å; C864-C901 HydrophobicContact CB-CB 3.93Å; C864-C901 WeakPolarHBondContact CB-SG 3.05Å; C864-C901 WeakPolarHBondContact SG-CB 3.24Å; C864-C901 CovalentContact SG-SG 2.02Å; C864-C901 PolarHBondContact SG-SG 3.23Å; C864-N902 PolarHBondContact SG-ND2 2.87Å
865	S	67	Low	62.5	Low	71 Å²	71	68.9 Å²	68.9	50%	0.497	40%	0.396	S	S	.	.	S	Bend	trans	-69.8	-11.1	-176.2	57.9	0	0	0	0	115	H872	S865-H872 WeakPolarHBondContact CB-O 3.5Å; S865-H872 PolarHBondContact N-O 2.95Å; S865-H872 PolarHBondContact OG-CD2 2.97Å; S865-H872 PolarHBondContact OG-CE1 2.91Å; S865-H872 VanDerWaalsContact OG-CG 3.29Å; S865-H872 PolarHBondContact OG-N 3.44Å; S865-H872 PolarHBondContact OG-ND1 2.85Å; S865-H872 PolarHBondContact OG-NE2 2.85Å; S865-H872 VanDerWaalsContact OG-NE2 3.08Å; S865-H872 PolarHBondContact OG-O 3.44Å
866	A	51.5	Low	62.3	Low	36 Å²	36	69.3 Å²	69.3	30%	0.298	40%	0.404	S	S	.	.			trans	-139.5	149.8	169.9	0	0	0	0	0	110.8	C864 C868 N902	C864-A866 PolarHBondContact O-N 3.2Å; C864-A866 PolarHBondContact SG-O 3.28Å; A866-C868 WeakPolarHBondContact CB-O 3.1Å; A866-N902 PolarHBondContact O-ND2 2.56Å
867	T	56.3	Low	62.6	Low	118 Å²	118	70.8 Å²	70.8	72%	0.724	41%	0.405	S	S	*	.	S	Bend	trans	-79.8	-25.6	-179.7	43.6	0	0	0	0	113.6	N902 H904	T867-N902 WeakPolarHBondContact O-CB 3.45Å; T867-N902 PolarHBondContact O-ND2 2.72Å; T867-H904 PolarHBondContact O-CE1 3.33Å; T867-H904 PolarHBondContact O-NE2 2.76Å
868	C	59.6	Low	62.7	Low	29 Å²	29	69.1 Å²	69.1	20%	0.196	39%	0.392	C	S	.	.	S	Bend	trans	-149.4	-174.6	175.2	51.1	0	0	0	0	108.6	A866 G870 N902 H904 C906	A866-C868 WeakPolarHBondContact CB-O 3.1Å; C868-G870 PolarHBondContact O-N 2.58Å; C868-N902 CarbonylContact C-O 3.56Å; C868-N902 VanDerWaalsContact C-O 3.31Å; C868-N902 WeakPolarHBondContact CA-O 3.16Å; C868-H904 WeakPolarHBondContact CB-NE2 3.09Å; C868-H904 WeakPolarHBondContact CB-O 3.3Å; C868-C906 VanDerWaalsContact CA-SG 3.54Å; C868-C906 HydrophobicContact CB-CB 4.08Å; C868-C906 WeakPolarHBondContact CB-SG 3.28Å; C868-C906 PolarHBondContact O-SG 2.74Å; C868-C906 WeakPolarHBondContact SG-CA 3.42Å; C868-C906 WeakPolarHBondContact SG-CB 3.13Å; C868-C906 CovalentContact SG-SG 2.03Å; C868-C906 PolarHBondContact SG-SG 3.44Å
869	G	56.8	Low	62.5	Low	53 Å²	53	68 Å²	68	55%	0.546	39%	0.393	S	S	.	.	S	Bend	trans	76.2	-3.1	171.4	0	0	0	0	0	115.9	N902 H904 C906	G869-N902 PolarHBondContact N-O 3.05Å; G869-H904 PolarHBondContact N-O 2.73Å; G869-C906 PolarHBondContact N-SG 2.77Å; G869-C906 VanDerWaalsContact N-SG 3.35Å
870	G	62.9	Low	62	Low	36 Å²	36	68.9 Å²	68.9	37%	0.371	40%	0.399	S	S	.	.			trans	90.6	85.1	-171.5	0	0	0	0	0	112.2	C868 N902	C868-G870 PolarHBondContact O-N 2.58Å; G870-N902 PolarHBondContact N-O 3.27Å
871	G	62.9	Low	61.9	Low	2 Å²	2	68.3 Å²	68.3	2%	0.021	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-179.6	164.6	0	0	0	0	0	111.9	L900 C901	G871-L900 WeakPolarHBondContact O-CA 3.37Å; G871-C901 VanDerWaalsContact C-SG 3.55Å; G871-C901 PolarHBondContact N-O 2.81Å; G871-C901 PolarHBondContact O-N 2.83Å
872	H	60.3	Low	61.2	Low	95 Å²	95	67.1 Å²	67.1	44%	0.44	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	147.8	169.9	52.5	-100.5	0	0	0	110.4	S865 A899 C901	S865-H872 WeakPolarHBondContact CB-O 3.5Å; S865-H872 PolarHBondContact N-O 2.95Å; S865-H872 PolarHBondContact OG-CD2 2.97Å; S865-H872 PolarHBondContact OG-CE1 2.91Å; S865-H872 VanDerWaalsContact OG-CG 3.29Å; S865-H872 PolarHBondContact OG-N 3.44Å; S865-H872 PolarHBondContact OG-ND1 2.85Å; S865-H872 PolarHBondContact OG-NE2 2.85Å; S865-H872 VanDerWaalsContact OG-NE2 3.08Å; S865-H872 PolarHBondContact OG-O 3.44Å; H872-A899 WeakPolarHBondContact CA-O 3.2Å; H872-C901 VanDerWaalsContact CA-SG 3.58Å
873	Y	66.2	Low	60.5	Low	73 Å²	73	67.3 Å²	67.3	29%	0.286	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	149.2	161.2	51.4	-125.5	0	0	0	109.5	W861 S862 E898 A899 C901	W861-Y873 HydrophobicContact CB-CD2 4.36Å; W861-Y873 HydrophobicContact CB-CG 4.47Å; W861-Y873 AromaticContact CD2-CD2 3.49Å; W861-Y873 HydrophobicContact CD2-CD2 3.49Å; W861-Y873 VanDerWaalsContact CD2-CD2 3.49Å; W861-Y873 AromaticContact CD2-CE2 3.59Å; W861-Y873 HydrophobicContact CD2-CE2 3.59Å; W861-Y873 HydrophobicContact CD2-CG 4.41Å; W861-Y873 AromaticContact CE2-CE2 3.64Å; W861-Y873 AromaticContact CE3-CD2 3.22Å; W861-Y873 HydrophobicContact CE3-CD2 3.22Å; W861-Y873 AromaticContact CE3-CE2 3.68Å; W861-Y873 HydrophobicContact CE3-CE2 3.68Å; W861-Y873 HydrophobicContact CE3-CG 4.22Å; W861-Y873 HydrophobicContact CG-CD2 4.04Å; W861-Y873 HydrophobicContact CG-CE2 4.18Å; W861-Y873 HydrophobicContact CH2-CD2 4.09Å; W861-Y873 AromaticContact CH2-CE2 3.84Å; W861-Y873 HydrophobicContact CH2-CE2 3.84Å; W861-Y873 HydrophobicContact CZ2-CD2 4.34Å; W861-Y873 AromaticContact CZ2-CE2 3.78Å; W861-Y873 HydrophobicContact CZ2-CE2 3.78Å; W861-Y873 AromaticContact CZ3-CD2 3.53Å; W861-Y873 HydrophobicContact CZ3-CD2 3.53Å; W861-Y873 AromaticContact CZ3-CE2 3.78Å; W861-Y873 HydrophobicContact CZ3-CE2 3.78Å; S862-Y873 WeakPolarHBondContact O-CB 3.18Å; S862-Y873 WeakPolarHBondContact OG-CA 3.09Å; Y873-E898 WeakPolarHBondContact O-CA 3.07Å; Y873-A899 HydrophobicContact CD2-CB 4.34Å; Y873-A899 HydrophobicContact CE2-CB 3.72Å; Y873-A899 PolarHBondContact N-O 2.85Å; Y873-A899 PolarHBondContact O-N 3.37Å; Y873-A899 VanDerWaalsContact O-N 3.1Å; Y873-C901 HydrophobicContact CD1-CB 3.48Å; Y873-C901 VanDerWaalsContact CD1-CB 3.48Å; Y873-C901 VanDerWaalsContact CD1-SG 3.57Å; Y873-C901 HydrophobicContact CE1-CB 3.61Å; Y873-C901 HydrophobicContact CG-CB 4.44Å; Y873-C901 PolarHBondContact N-SG 2.81Å; Y873-C901 VanDerWaalsContact N-SG 3.4Å
874	Q	66.8	Low	60	Low	74 Å²	74	61.1 Å²	61.1	35%	0.346	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	150	-177.6	-168.6	-176.1	69.7	0	0	110.6	S862 T896 E897 E898	S862-Q874 PolarHBondContact N-O 3.01Å; S862-Q874 PolarHBondContact OG-N 2.81Å; Q874-T896 HydrophobicContact CG-CG2 4.28Å; Q874-E897 CarbonylContact C-O 3.6Å; Q874-E897 VanDerWaalsContact CA-O 3.3Å; Q874-E897 WeakPolarHBondContact CA-O 3.46Å; Q874-E897 WeakPolarHBondContact CG-O 3.31Å; Q874-E898 HydrophobicContact CB-CG 3.99Å; Q874-E898 HydrophobicContact CG-CG 3.67Å; Q874-E898 PolarHBondContact NE2-OE1 2.84Å
875	R	68.6	Low	58.9	Low	60 Å²	60	63.5 Å²	63.5	23%	0.226	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	156.6	166.4	65	-174.4	-178.1	-174.8	-4.7	111.2	W858 T859 W861 T896 E897	W858-R875 HydrophobicContact CB-CG 4.28Å; W858-R875 HydrophobicContact CD2-CG 3.9Å; W858-R875 HydrophobicContact CE3-CB 4.35Å; W858-R875 HydrophobicContact CE3-CG 3.64Å; W858-R875 HydrophobicContact CG-CG 4.23Å; W858-R875 HydrophobicContact CZ3-CG 4.21Å; W858-R875 WeakPolarHBondContact CZ3-O 3.4Å; T859-R875 WeakPolarHBondContact OG1-CB 3.47Å; W861-R875 HydrophobicContact CD2-CB 4.21Å; W861-R875 HydrophobicContact CD2-CG 4.03Å; W861-R875 HydrophobicContact CE3-CB 3.69Å; W861-R875 HydrophobicContact CE3-CG 3.53Å; W861-R875 HydrophobicContact CH2-CG 3.96Å; W861-R875 HydrophobicContact CZ2-CG 4.38Å; W861-R875 HydrophobicContact CZ3-CB 4.14Å; W861-R875 HydrophobicContact CZ3-CG 3.52Å; R875-T896 WeakPolarHBondContact O-CA 3.49Å; R875-E897 HydrophobicContact CG-CB 4.27Å; R875-E897 IonicContact CZ-OE2 3.29Å; R875-E897 PolarHBondContact N-O 2.8Å; R875-E897 IonicContact NE-OE2 3.03Å; R875-E897 PolarHBondContact NE-OE2 3.34Å; R875-E897 IonicContact NH2-OE1 3.16Å; R875-E897 IonicContact NH2-OE2 3.8Å; R875-E897 PolarHBondContact NH2-OE2 3.43Å; R875-E897 PolarHBondContact O-N 3.02Å
876	T	61.6	Low	57.6	Low	59 Å²	59	66.5 Å²	66.5	36%	0.362	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	156.6	-176.4	68.2	0	0	0	0	112.7	W858 T859 H895 T896	W858-T876 CarbonylContact C-O 3.54Å; W858-T876 WeakPolarHBondContact CA-O 3.46Å; W858-T876 VanDerWaalsContact CE3-C 3.41Å; T859-T876 PolarHBondContact N-O 2.85Å; T859-T876 PolarHBondContact OG1-N 3.01Å; T876-H895 CarbonylContact C-O 3.49Å; T876-H895 VanDerWaalsContact CA-O 3.31Å; T876-H895 WeakPolarHBondContact CA-O 3.38Å; T876-T896 HydrophobicContact CG2-CG2 3.73Å
877	R	67.5	Low	57.8	Low	57 Å²	57	68.3 Å²	68.3	22%	0.215	43%	0.434	C	S	.	.			trans	-145.7	157.8	176.6	62.9	-176.3	177.5	179.3	-6.7	111	W855 W858 L894 H895	W855-R877 HydrophobicContact CB-CG 4.42Å; W855-R877 HydrophobicContact CD2-CG 3.94Å; W855-R877 HydrophobicContact CE3-CB 4.4Å; W855-R877 HydrophobicContact CE3-CG 3.63Å; W855-R877 HydrophobicContact CG-CG 4.31Å; W855-R877 HydrophobicContact CZ3-CG 4.21Å; W858-R877 HydrophobicContact CD2-CB 4.05Å; W858-R877 HydrophobicContact CD2-CG 4.07Å; W858-R877 HydrophobicContact CE3-CB 3.64Å; W858-R877 HydrophobicContact CE3-CG 3.6Å; W858-R877 HydrophobicContact CH2-CG 3.83Å; W858-R877 VanDerWaalsContact CH2-NE 3.27Å; W858-R877 HydrophobicContact CZ2-CG 4.3Å; W858-R877 VanDerWaalsContact CZ2-NE 3.3Å; W858-R877 HydrophobicContact CZ3-CB 4.03Å; W858-R877 HydrophobicContact CZ3-CG 3.48Å; W858-R877 VanDerWaalsContact CZ3-CG 3.48Å; R877-L894 PolarHBondContact NE-O 2.96Å; R877-L894 PolarHBondContact NH2-O 3.11Å; R877-H895 PolarHBondContact N-O 3.42Å
878	T	59	Low	56.9	Low	79 Å²	79	71.5 Å²	71.5	49%	0.485	44%	0.441	S	S	.	.			trans	-124.2	145.4	-172.9	52.5	0	0	0	0	111.9	W855 S856 T880	W855-T878 CarbonylContact C-O 3.52Å; W855-T878 WeakPolarHBondContact CA-O 3.49Å; S856-T878 WeakPolarHBondContact CB-O 3.19Å; S856-T878 PolarHBondContact N-O 3.25Å; S856-T878 PolarHBondContact OG-N 3.33Å; S856-T878 PolarHBondContact OG-O 3.36Å; S856-T878 PolarHBondContact OG-OG1 2.03Å; T878-T880 VanDerWaalsContact C-N 3.31Å; T878-T880 PolarHBondContact O-N 3.24Å; T878-T880 PolarHBondContact O-OG1 2.76Å; T878-T880 PolarHBondContact OG1-OG1 3.01Å
879	C	60.6	Low	56.3	Low	40 Å²	40	75.1 Å²	75.1	27%	0.27	46%	0.458	S	S	.	.	S	Bend	trans	-81.1	70.8	-174.9	-173.8	0	0	0	0	111.5	S854 W855 C891	S854-C879 CarbonylContact O-C 3.53Å; W855-C879 HydrophobicContact CE3-CB 4.22Å; W855-C879 HydrophobicContact CZ3-CB 4.12Å; C879-C891 VanDerWaalsContact CA-SG 3.55Å; C879-C891 HydrophobicContact CB-CB 3.71Å; C879-C891 WeakPolarHBondContact CB-SG 3.45Å; C879-C891 WeakPolarHBondContact SG-CB 3.37Å; C879-C891 CovalentContact SG-SG 2.03Å; C879-C891 PolarHBondContact SG-SG 2.91Å
880	T	55.3	Low	56.4	Low	79 Å²	79	79.9 Å²	79.9	49%	0.485	47%	0.47	S	S	.	.			trans	-138.8	0.5	-164.5	55	0	0	0	0	116.2	S854 T878 P882 A883	S854-T880 PolarHBondContact O-N 3.03Å; S854-T880 VanDerWaalsContact O-N 3.09Å; T878-T880 VanDerWaalsContact C-N 3.31Å; T878-T880 PolarHBondContact O-N 3.24Å; T878-T880 PolarHBondContact O-OG1 2.76Å; T878-T880 PolarHBondContact OG1-OG1 3.01Å; T880-P882 VanDerWaalsContact C-C 3.48Å; T880-A883 PolarHBondContact O-N 2.87Å
881	N	53.4	Low	56.2	Low	103 Å²	103	78.7 Å²	78.7	55%	0.551	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.4	90.3	-173.6	-169	42.5	0	0	0	114.6	S854	S854-N881 VanDerWaalsContact CB-O 3.25Å; S854-N881 WeakPolarHBondContact CB-O 3.38Å; S854-N881 PolarHBondContact O-N 2.94Å; S854-N881 PolarHBondContact OG-O 2.8Å
882	P	49.5	Very low	56	Low	65 Å²	65	86.1 Å²	86.1	42%	0.422	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	cis	-69.5	154.2	-13.7	28.1	-36	0	0	0	112.8	V851 S854 T880	V851-P882 HydrophobicContact CG1-CB 4.22Å; V851-P882 HydrophobicContact CG1-CG 3.46Å; V851-P882 VanDerWaalsContact CG1-CG 3.46Å; S854-P882 PolarHBondContact N-O 3.21Å; T880-P882 VanDerWaalsContact C-C 3.48Å
883	A	50.1	Low	55.8	Low	63 Å²	63	84 Å²	84	52%	0.521	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-72.6	143.5	169.8	0	0	0	0	0	110.8	T880	T880-A883 PolarHBondContact O-N 2.87Å
884	P	53.8	Low	55.2	Low	56 Å²	56	86.6 Å²	86.6	36%	0.364	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-67.9	141.8	179.5	27.2	-33	0	0	0	112
885	S	47	Very low	54.9	Low	86 Å²	86	88.6 Å²	88.6	60%	0.601	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-73.3	137.8	169.4	56.3	0	0	0	0	111.1	G887	S885-G887 PolarHBondContact O-N 3.42Å
886	S	40.7	Very low	54.6	Low	134 Å²	134	87.3 Å²	87.3	94%	0.937	52%	0.524	S	S	*	.	S	Bend	trans	-41.8	113.2	-175.7	-50.3	0	0	0	0	114.6
887	G	55	Low	54.8	Low	73 Å²	73	88 Å²	88	75%	0.753	52%	0.522	S	S	*	.	S	Bend	trans	172.7	-86.8	178.1	0	0	0	0	0	112.5	S885	S885-G887 PolarHBondContact O-N 3.42Å
888	E	38.1	Very low	54.9	Low	185 Å²	185	90.7 Å²	90.7	86%	0.864	54%	0.538	S	S	*	.	S	Bend	trans	-154.1	167.9	-168.3	-112.2	159.5	-152.6	0	0	113
889	D	46.2	Very low	54.8	Low	105 Å²	105	88.7 Å²	88.7	56%	0.561	53%	0.529	S	S	*	.			trans	67	136.7	-178	-85.4	-8.2	0	0	0	119	K852	K852-D889 IonicContact NZ-OD2 2.76Å; K852-D889 PolarHBondContact NZ-OD2 3.13Å
890	I	59.5	Low	54.9	Low	154 Å²	154	93 Å²	93	79%	0.79	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-103.7	149	-172.5	-54.7	162.7	0	0	0	108.9	I892	I890-I892 WeakPolarHBondContact O-CG1 3.05Å; I890-I892 PolarHBondContact O-N 3.06Å; I890-I892 VanDerWaalsContact O-N 3.08Å
891	C	58.8	Low	55.2	Low	11 Å²	11	89.9 Å²	89.9	7%	0.074	53%	0.53	C	S	.	.	P	Polyproline II helix	trans	-58	116.8	169.3	-75.5	0	0	0	0	110.7	G853 S854 W855 C879	G853-C891 VanDerWaalsContact C-SG 3.51Å; G853-C891 PolarHBondContact O-SG 3.27Å; S854-C891 VanDerWaalsContact C-SG 3.55Å; W855-C891 HydrophobicContact CD2-CB 3.84Å; W855-C891 VanDerWaalsContact CE2-CB 3.43Å; W855-C891 HydrophobicContact CE3-CB 4.23Å; W855-C891 HydrophobicContact CG-CB 4.42Å; W855-C891 HydrophobicContact CH2-CB 3.91Å; W855-C891 HydrophobicContact CZ2-CB 3.47Å; W855-C891 VanDerWaalsContact CZ2-CB 3.47Å; W855-C891 WeakPolarHBondContact CZ2-O 3.34Å; W855-C891 HydrophobicContact CZ3-CB 4.27Å; C879-C891 VanDerWaalsContact CA-SG 3.55Å; C879-C891 HydrophobicContact CB-CB 3.71Å; C879-C891 WeakPolarHBondContact CB-SG 3.45Å; C879-C891 WeakPolarHBondContact SG-CB 3.37Å; C879-C891 CovalentContact SG-SG 2.03Å; C879-C891 PolarHBondContact SG-SG 2.91Å
892	I	58.7	Low	55.6	Low	157 Å²	157	88 Å²	88	81%	0.805	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-80.9	142.1	-177.4	-55.1	-179.3	0	0	0	110.2	W855 I890	W855-I892 PolarHBondContact NE1-O 2.93Å; I890-I892 WeakPolarHBondContact O-CG1 3.05Å; I890-I892 PolarHBondContact O-N 3.06Å; I890-I892 VanDerWaalsContact O-N 3.08Å
893	G	55.2	Low	55.9	Low	51 Å²	51	90 Å²	90	53%	0.526	53%	0.531	S	S	.	.	S	Bend	trans	105.2	172.3	-175.7	0	0	0	0	0	112.7	W855	W855-G893 WeakPolarHBondContact CZ2-O 3.33Å
894	L	54.3	Low	56.1	Low	128 Å²	128	92.1 Å²	92.1	67%	0.67	53%	0.53	S	S	*	.			trans	-74.6	142.2	-178.4	-61.5	167.4	0	0	0	111.6	R877 T896	R877-L894 PolarHBondContact NE-O 2.96Å; R877-L894 PolarHBondContact NH2-O 3.11Å; L894-T896 WeakPolarHBondContact CB-O 3.32Å
895	H	59.3	Low	55.6	Low	116 Å²	116	95 Å²	95	54%	0.537	55%	0.552	S	S	.	*	S	Bend	trans	-83.2	-16.9	172.2	59.8	57.1	0	0	0	113.1	W855 W858 T876 R877	W855-H895 HydrophobicContact CH2-CB 3.74Å; W855-H895 HydrophobicContact CZ3-CB 3.89Å; W858-H895 WeakPolarHBondContact CZ3-O 3.34Å; T876-H895 CarbonylContact C-O 3.49Å; T876-H895 VanDerWaalsContact CA-O 3.31Å; T876-H895 WeakPolarHBondContact CA-O 3.38Å; R877-H895 PolarHBondContact N-O 3.42Å
896	T	62.8	Low	55.7	Low	33 Å²	33	94 Å²	94	20%	0.202	54%	0.543	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	140.4	174.6	29.3	0	0	0	0	108.2	Q874 R875 T876 L894	Q874-T896 HydrophobicContact CG-CG2 4.28Å; R875-T896 WeakPolarHBondContact O-CA 3.49Å; T876-T896 HydrophobicContact CG2-CG2 3.73Å; L894-T896 WeakPolarHBondContact CB-O 3.32Å
897	E	67	Low	56.1	Low	72 Å²	72	97 Å²	97	34%	0.336	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	137.1	170.5	-176	179.5	-141.8	0	0	108.1	W858 W861 Q874 R875	W858-E897 HydrophobicContact CH2-CB 3.39Å; W858-E897 HydrophobicContact CZ2-CB 3.73Å; W858-E897 HydrophobicContact CZ2-CG 4.43Å; W858-E897 WeakPolarHBondContact CZ2-OE2 3.12Å; W858-E897 HydrophobicContact CZ3-CB 3.86Å; W861-E897 HydrophobicContact CH2-CB 4.49Å; W861-E897 HydrophobicContact CH2-CG 4Å; W861-E897 WeakPolarHBondContact CZ3-O 3.07Å; Q874-E897 CarbonylContact C-O 3.6Å; Q874-E897 VanDerWaalsContact CA-O 3.3Å; Q874-E897 WeakPolarHBondContact CA-O 3.46Å; Q874-E897 WeakPolarHBondContact CG-O 3.31Å; R875-E897 HydrophobicContact CG-CB 4.27Å; R875-E897 IonicContact CZ-OE2 3.29Å; R875-E897 PolarHBondContact N-O 2.8Å; R875-E897 IonicContact NE-OE2 3.03Å; R875-E897 PolarHBondContact NE-OE2 3.34Å; R875-E897 IonicContact NH2-OE1 3.16Å; R875-E897 IonicContact NH2-OE2 3.8Å; R875-E897 PolarHBondContact NH2-OE2 3.43Å; R875-E897 PolarHBondContact O-N 3.02Å
898	E	67.9	Low	55.9	Low	115 Å²	115	96.7 Å²	96.7	54%	0.537	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	140.4	-176.2	-71.2	168.2	-147.6	0	0	109	Y873 Q874	Y873-E898 WeakPolarHBondContact O-CA 3.07Å; Q874-E898 HydrophobicContact CB-CG 3.99Å; Q874-E898 HydrophobicContact CG-CG 3.67Å; Q874-E898 PolarHBondContact NE2-OE1 2.84Å
899	A	58.7	Low	56.8	Low	37 Å²	37	90 Å²	90	31%	0.306	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	153.9	171.5	0	0	0	0	0	111.3	W861 H872 Y873	W861-A899 HydrophobicContact CH2-CB 4.36Å; H872-A899 WeakPolarHBondContact CA-O 3.2Å; Y873-A899 HydrophobicContact CD2-CB 4.34Å; Y873-A899 HydrophobicContact CE2-CB 3.72Å; Y873-A899 PolarHBondContact N-O 2.85Å; Y873-A899 PolarHBondContact O-N 3.37Å; Y873-A899 VanDerWaalsContact O-N 3.1Å
900	L	61.3	Low	57.6	Low	130 Å²	130	87.7 Å²	87.7	68%	0.681	50%	0.504	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	143.6	-175.8	-65.1	171.7	0	0	0	111.9	G871 T903	G871-L900 WeakPolarHBondContact O-CA 3.37Å; L900-T903 HydrophobicContact CB-CG2 4Å
901	C	61.8	Low	57.8	Low	13 Å²	13	81 Å²	81	9%	0.088	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	161.1	179.6	49.4	0	0	0	0	110.4	C864 G871 H872 Y873 T903	C864-C901 VanDerWaalsContact CA-SG 3.56Å; C864-C901 HydrophobicContact CB-CB 3.93Å; C864-C901 WeakPolarHBondContact CB-SG 3.05Å; C864-C901 WeakPolarHBondContact SG-CB 3.24Å; C864-C901 CovalentContact SG-SG 2.02Å; C864-C901 PolarHBondContact SG-SG 3.23Å; G871-C901 VanDerWaalsContact C-SG 3.55Å; G871-C901 PolarHBondContact N-O 2.81Å; G871-C901 PolarHBondContact O-N 2.83Å; H872-C901 VanDerWaalsContact CA-SG 3.58Å; Y873-C901 HydrophobicContact CD1-CB 3.48Å; Y873-C901 VanDerWaalsContact CD1-CB 3.48Å; Y873-C901 VanDerWaalsContact CD1-SG 3.57Å; Y873-C901 HydrophobicContact CE1-CB 3.61Å; Y873-C901 HydrophobicContact CG-CB 4.44Å; Y873-C901 PolarHBondContact N-SG 2.81Å; Y873-C901 VanDerWaalsContact N-SG 3.4Å; C901-T903 PolarHBondContact O-N 2.7Å
902	N	61.4	Low	57.9	Low	63 Å²	63	88.9 Å²	88.9	34%	0.337	51%	0.506	S	S	.	.			trans	50.7	43.2	-180	-62.9	-20.3	0	0	0	113.6	C864 A866 T867 C868 G869 G870 H904	C864-N902 PolarHBondContact SG-ND2 2.87Å; A866-N902 PolarHBondContact O-ND2 2.56Å; T867-N902 WeakPolarHBondContact O-CB 3.45Å; T867-N902 PolarHBondContact O-ND2 2.72Å; C868-N902 CarbonylContact C-O 3.56Å; C868-N902 VanDerWaalsContact C-O 3.31Å; C868-N902 WeakPolarHBondContact CA-O 3.16Å; G869-N902 PolarHBondContact N-O 3.05Å; G870-N902 PolarHBondContact N-O 3.27Å; N902-H904 PolarHBondContact O-N 2.88Å
903	T	57.3	Low	58.7	Low	107 Å²	107	84.6 Å²	84.6	66%	0.656	48%	0.48	S	S	*	.			trans	-76.8	30.8	-177.4	61.5	0	0	0	0	113.6	L900 C901	L900-T903 HydrophobicContact CB-CG2 4Å; C901-T903 PolarHBondContact O-N 2.7Å
904	H	52.7	Low	59.5	Low	109 Å²	109	84.5 Å²	84.5	51%	0.505	47%	0.471	S	S	.	.	S	Bend	trans	-104.2	137	171.5	58.3	-90.2	0	0	0	108	T867 C868 G869 N902 C906	T867-H904 PolarHBondContact O-CE1 3.33Å; T867-H904 PolarHBondContact O-NE2 2.76Å; C868-H904 WeakPolarHBondContact CB-NE2 3.09Å; C868-H904 WeakPolarHBondContact CB-O 3.3Å; G869-H904 PolarHBondContact N-O 2.73Å; N902-H904 PolarHBondContact O-N 2.88Å; H904-C906 PolarHBondContact O-N 3.43Å
905	S	45.1	Very low	60.4	Low	117 Å²	117	86.5 Å²	86.5	82%	0.818	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-56.8	136.8	-170.7	-49	0	0	0	0	113.5
906	C	49.2	Very low	61.3	Low	63 Å²	63	83.9 Å²	83.9	43%	0.426	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-81.4	148.2	160.7	-63.1	0	0	0	0	110.1	C868 G869 H904	C868-C906 VanDerWaalsContact CA-SG 3.54Å; C868-C906 HydrophobicContact CB-CB 4.08Å; C868-C906 WeakPolarHBondContact CB-SG 3.28Å; C868-C906 PolarHBondContact O-SG 2.74Å; C868-C906 WeakPolarHBondContact SG-CA 3.42Å; C868-C906 WeakPolarHBondContact SG-CB 3.13Å; C868-C906 CovalentContact SG-SG 2.03Å; C868-C906 PolarHBondContact SG-SG 3.44Å; G869-C906 PolarHBondContact N-SG 2.77Å; G869-C906 VanDerWaalsContact N-SG 3.35Å; H904-C906 PolarHBondContact O-N 3.43Å
907	E	47.9	Very low	61.8	Low	197 Å²	197	83.7 Å²	83.7	92%	0.921	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-86.7	147	159.3	-62.7	-177	141.6	0	0	109.3
908	G	51.4	Low	62	Low	67 Å²	67	87.7 Å²	87.7	69%	0.691	49%	0.485	S	S	*	.			trans	-105	139	-156.1	0	0	0	0	0	116.4	W910	G908-W910 VanDerWaalsContact C-N 3.3Å; G908-W910 PolarHBondContact O-N 3.25Å
909	G	55.9	Low	62.3	Low	44 Å²	44	85.2 Å²	85.2	45%	0.454	48%	0.48	S	S	.	.			trans	-78.3	51.3	-175.5	0	0	0	0	0	117.2
910	W	64.3	Low	62.8	Low	58 Å²	58	86.3 Å²	86.3	22%	0.22	48%	0.481	C	S	.	.	B	Isolated β-bridge	trans	-95.6	143.6	160.5	-80.9	102.4	0	0	0	109.3	G908 R929 C941 G943	G908-W910 VanDerWaalsContact C-N 3.3Å; G908-W910 PolarHBondContact O-N 3.25Å; W910-R929 HydrophobicContact CE3-CG 3.81Å; W910-R929 HydrophobicContact CZ3-CG 4.11Å; W910-C941 HydrophobicContact CH2-CB 4.28Å; W910-C941 HydrophobicContact CZ2-CB 3.83Å; W910-G943 WeakPolarHBondContact CH2-O 3.02Å; W910-G943 WeakPolarHBondContact CZ2-O 3.46Å
911	S	62.5	Low	62.9	Low	12 Å²	12	90.1 Å²	90.1	8%	0.084	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-66.9	159.9	169	76.6	0	0	0	0	111.3	R929 Y930	S911-R929 WeakPolarHBondContact O-CD 3.36Å; S911-Y930 PolarHBondContact N-O 3.43Å; S911-Y930 PolarHBondContact OG-N 3.43Å; S911-Y930 PolarHBondContact OG-O 3.34Å
912	E	62	Low	63.2	Low	177 Å²	177	97.2 Å²	97.2	83%	0.827	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-53.7	152.5	166.2	-77.9	-70	122.1	0	0	111.2
913	W	74.2	Confident	63.4	Low	67 Å²	67	95.6 Å²	95.6	25%	0.254	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-76.9	145.4	176.5	-73.3	100.1	0	0	0	111.4	R927 R929 Q947	W913-R927 HydrophobicContact CE3-CG 3.92Å; W913-R927 HydrophobicContact CZ3-CG 4.45Å; W913-R929 HydrophobicContact CD2-CB 4.2Å; W913-R929 HydrophobicContact CD2-CG 3.92Å; W913-R929 VanDerWaalsContact CE2-CD 3.5Å; W913-R929 HydrophobicContact CE3-CB 3.99Å; W913-R929 HydrophobicContact CE3-CG 3.76Å; W913-R929 HydrophobicContact CH2-CG 3.97Å; W913-R929 HydrophobicContact CZ2-CG 4.13Å; W913-R929 HydrophobicContact CZ3-CB 4.41Å; W913-R929 HydrophobicContact CZ3-CG 3.78Å; W913-Q947 HydrophobicContact CE3-CB 4.49Å; W913-Q947 HydrophobicContact CH2-CB 3.78Å; W913-Q947 HydrophobicContact CZ2-CB 4.42Å; W913-Q947 HydrophobicContact CZ3-CB 3.81Å
914	S	73.2	Confident	64	Low	50 Å²	50	92.6 Å²	92.6	35%	0.35	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-62.9	161.5	167.5	77	0	0	0	0	112.1	R927 S928	S914-R927 WeakPolarHBondContact O-CD 3.24Å; S914-R927 WeakPolarHBondContact OG-CA 3.46Å; S914-R927 WeakPolarHBondContact OG-CB 3.34Å; S914-S928 PolarHBondContact N-O 2.92Å; S914-S928 PolarHBondContact OG-N 3.46Å; S914-S928 VanDerWaalsContact OG-N 3.08Å
915	E	72.8	Confident	65.1	Low	169 Å²	169	90 Å²	90	79%	0.79	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-53.2	156.8	157.8	-74.2	-64.2	159.2	0	0	111.2
916	W	78.7	Confident	66.6	Low	62 Å²	62	89.9 Å²	89.9	24%	0.235	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-75	143.4	176.1	-71.5	104.4	0	0	0	111.8	Q925 R927 Q947 Q949	W916-Q925 HydrophobicContact CB-CB 4.25Å; W916-Q925 HydrophobicContact CD2-CB 4.4Å; W916-Q925 HydrophobicContact CE3-CB 3.79Å; W916-Q925 WeakPolarHBondContact CZ3-O 3.2Å; W916-R927 HydrophobicContact CD2-CB 4.18Å; W916-R927 HydrophobicContact CD2-CG 3.95Å; W916-R927 VanDerWaalsContact CE2-CD 3.49Å; W916-R927 HydrophobicContact CE3-CB 3.95Å; W916-R927 HydrophobicContact CE3-CG 3.77Å; W916-R927 HydrophobicContact CH2-CG 3.87Å; W916-R927 HydrophobicContact CZ2-CG 4.04Å; W916-R927 VanDerWaalsContact CZ2-NE 3.33Å; W916-R927 HydrophobicContact CZ3-CB 4.33Å; W916-R927 HydrophobicContact CZ3-CG 3.73Å; W916-Q947 HydrophobicContact CH2-CB 4.23Å; W916-Q947 HydrophobicContact CH2-CG 3.94Å; W916-Q947 WeakPolarHBondContact CZ3-O 3.43Å; W916-Q949 HydrophobicContact CE3-CB 4.43Å; W916-Q949 HydrophobicContact CH2-CB 3.34Å; W916-Q949 HydrophobicContact CH2-CG 4.48Å; W916-Q949 HydrophobicContact CZ2-CB 3.85Å; W916-Q949 VanDerWaalsContact CZ2-OE1 3.24Å; W916-Q949 HydrophobicContact CZ3-CB 3.67Å
917	S	73.5	Confident	67.9	Low	28 Å²	28	89.7 Å²	89.7	20%	0.196	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-60.8	159.3	169.2	74.5	0	0	0	0	111.4	Q925 Y926	S917-Q925 VanDerWaalsContact O-CG 3.25Å; S917-Q925 WeakPolarHBondContact O-CG 3.43Å; S917-Q925 PolarHBondContact O-NE2 2.91Å; S917-Q925 WeakPolarHBondContact OG-CA 3.49Å; S917-Y926 WeakPolarHBondContact CB-O 3.45Å; S917-Y926 PolarHBondContact N-O 3.45Å; S917-Y926 WeakPolarHBondContact OG-CD1 3.32Å; S917-Y926 PolarHBondContact OG-N 3.16Å
918	L	70.1	Confident	69.1	Low	157 Å²	157	83 Å²	83	82%	0.822	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-59.4	158.5	160	-67	176.3	0	0	0	110.1	N920	L918-N920 PolarHBondContact O-N 2.85Å
919	C	74.1	Confident	70	Confident	63 Å²	63	82.7 Å²	82.7	43%	0.426	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-65.9	127.5	-176.9	-156.6	0	0	0	0	110.9	G923 C951	C919-G923 VanDerWaalsContact SG-CA 3.59Å; C919-C951 HydrophobicContact CB-CB 4.26Å; C919-C951 WeakPolarHBondContact CB-SG 3.42Å; C919-C951 WeakPolarHBondContact SG-CB 3.25Å; C919-C951 CovalentContact SG-SG 2.03Å; C919-C951 PolarHBondContact SG-SG 2.96Å
920	N	69.9	Low	70.5	Confident	59 Å²	59	87.5 Å²	87.5	32%	0.316	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-64.8	163.6	171	-60.7	-8.1	0	0	0	110.5	L918 E922 G923 I924	L918-N920 PolarHBondContact O-N 2.85Å; N920-E922 HydrophobicContact CB-CB 4.48Å; N920-E922 PolarHBondContact O-N 2.91Å; N920-E922 VanDerWaalsContact O-N 3.12Å; N920-G923 PolarHBondContact O-N 3.45Å; N920-I924 WeakPolarHBondContact CB-O 3.3Å; N920-I924 PolarHBondContact N-O 3.35Å; N920-I924 PolarHBondContact OD1-O 2.76Å
921	E	62.7	Low	70.5	Confident	211 Å²	211	87.5 Å²	87.5	99%	0.986	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-22.6	169.6	-64.3	-170	169.3	0	0	112.6	G923	E921-G923 VanDerWaalsContact C-N 3.29Å; E921-G923 PolarHBondContact O-N 2.79Å
922	E	68.4	Low	70.4	Confident	161 Å²	161	92.1 Å²	92.1	75%	0.752	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	1.3	174.9	-60.8	176.9	151	0	0	113.9	N920	N920-E922 HydrophobicContact CB-CB 4.48Å; N920-E922 PolarHBondContact O-N 2.91Å; N920-E922 VanDerWaalsContact O-N 3.12Å
923	G	65.2	Low	70	Confident	29 Å²	29	88.5 Å²	88.5	30%	0.299	44%	0.442	S	S	.	.	S	Bend	trans	82.8	13.6	177	0	0	0	0	0	115.5	C919 N920 E921 C951	C919-G923 VanDerWaalsContact SG-CA 3.59Å; N920-G923 PolarHBondContact O-N 3.45Å; E921-G923 VanDerWaalsContact C-N 3.29Å; E921-G923 PolarHBondContact O-N 2.79Å; G923-C951 VanDerWaalsContact C-SG 3.59Å; G923-C951 WeakPolarHBondContact O-CB 3.33Å; G923-C951 PolarHBondContact O-N 2.93Å; G923-C951 PolarHBondContact O-SG 3.47Å
924	I	71.2	Confident	68.7	Low	44 Å²	44	93.8 Å²	93.8	23%	0.226	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	141.4	-172.9	-57.6	173.1	0	0	0	110.7	N920 Y948	N920-I924 WeakPolarHBondContact CB-O 3.3Å; N920-I924 PolarHBondContact N-O 3.35Å; N920-I924 PolarHBondContact OD1-O 2.76Å; I924-Y948 HydrophobicContact CG2-CD1 4.08Å
925	Q	74.6	Confident	66.9	Low	54 Å²	54	96.9 Å²	96.9	25%	0.252	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	153.2	162	-55.9	-171.5	-39.6	0	0	110.5	W916 S917 Y948 Q949 C951	W916-Q925 HydrophobicContact CB-CB 4.25Å; W916-Q925 HydrophobicContact CD2-CB 4.4Å; W916-Q925 HydrophobicContact CE3-CB 3.79Å; W916-Q925 WeakPolarHBondContact CZ3-O 3.2Å; S917-Q925 VanDerWaalsContact O-CG 3.25Å; S917-Q925 WeakPolarHBondContact O-CG 3.43Å; S917-Q925 PolarHBondContact O-NE2 2.91Å; S917-Q925 WeakPolarHBondContact OG-CA 3.49Å; Q925-Y948 CarbonylContact O-C 3.58Å; Q925-Y948 WeakPolarHBondContact O-CA 3.37Å; Q925-Q949 PolarHBondContact N-O 3.08Å; Q925-Q949 PolarHBondContact O-N 3.43Å; Q925-C951 VanDerWaalsContact CG-SG 3.53Å
926	Y	78.2	Confident	65.8	Low	115 Å²	115	94.1 Å²	94.1	45%	0.451	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	156.4	171.6	72.6	-84.4	0	0	0	112.9	S917 Q947 Y948	S917-Y926 WeakPolarHBondContact CB-O 3.45Å; S917-Y926 PolarHBondContact N-O 3.45Å; S917-Y926 WeakPolarHBondContact OG-CD1 3.32Å; S917-Y926 PolarHBondContact OG-N 3.16Å; Y926-Q947 CarbonylContact C-O 3.59Å; Y926-Q947 VanDerWaalsContact CA-O 3.26Å; Y926-Q947 WeakPolarHBondContact CA-O 3.34Å; Y926-Y948 HydrophobicContact CG-CE1 4.3Å
927	R	75.3	Confident	63.9	Low	59 Å²	59	99.1 Å²	99.1	22%	0.223	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	162.8	173.6	65.6	176.9	-175.3	166.2	0.8	111.3	W913 S914 W916 T946 Q947	W913-R927 HydrophobicContact CE3-CG 3.92Å; W913-R927 HydrophobicContact CZ3-CG 4.45Å; S914-R927 WeakPolarHBondContact O-CD 3.24Å; S914-R927 WeakPolarHBondContact OG-CA 3.46Å; S914-R927 WeakPolarHBondContact OG-CB 3.34Å; W916-R927 HydrophobicContact CD2-CB 4.18Å; W916-R927 HydrophobicContact CD2-CG 3.95Å; W916-R927 VanDerWaalsContact CE2-CD 3.49Å; W916-R927 HydrophobicContact CE3-CB 3.95Å; W916-R927 HydrophobicContact CE3-CG 3.77Å; W916-R927 HydrophobicContact CH2-CG 3.87Å; W916-R927 HydrophobicContact CZ2-CG 4.04Å; W916-R927 VanDerWaalsContact CZ2-NE 3.33Å; W916-R927 HydrophobicContact CZ3-CB 4.33Å; W916-R927 HydrophobicContact CZ3-CG 3.73Å; R927-T946 WeakPolarHBondContact O-CA 3.48Å; R927-Q947 HydrophobicContact CG-CB 4.16Å; R927-Q947 PolarHBondContact N-O 3.33Å; R927-Q947 PolarHBondContact O-N 3.02Å
928	S	73.5	Confident	62.5	Low	58 Å²	58	103 Å²	103	41%	0.406	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	164.5	-175.9	64.7	0	0	0	0	113.9	S914 S945	S914-S928 PolarHBondContact N-O 2.92Å; S914-S928 PolarHBondContact OG-N 3.46Å; S914-S928 VanDerWaalsContact OG-N 3.08Å; S928-S945 CarbonylContact C-O 3.54Å; S928-S945 VanDerWaalsContact CA-O 3.22Å; S928-S945 WeakPolarHBondContact CA-O 3.21Å; S928-S945 WeakPolarHBondContact CB-O 3.05Å
929	R	69.9	Low	61.7	Low	59 Å²	59	100.1 Å²	100.1	22%	0.223	54%	0.539	C	S	.	.			trans	-152	166.9	171.2	65	174.8	179.3	175.8	2.2	110.6	W910 S911 W913 S945	W910-R929 HydrophobicContact CE3-CG 3.81Å; W910-R929 HydrophobicContact CZ3-CG 4.11Å; S911-R929 WeakPolarHBondContact O-CD 3.36Å; W913-R929 HydrophobicContact CD2-CB 4.2Å; W913-R929 HydrophobicContact CD2-CG 3.92Å; W913-R929 VanDerWaalsContact CE2-CD 3.5Å; W913-R929 HydrophobicContact CE3-CB 3.99Å; W913-R929 HydrophobicContact CE3-CG 3.76Å; W913-R929 HydrophobicContact CH2-CG 3.97Å; W913-R929 HydrophobicContact CZ2-CG 4.13Å; W913-R929 HydrophobicContact CZ3-CB 4.41Å; W913-R929 HydrophobicContact CZ3-CG 3.78Å; R929-S945 PolarHBondContact N-O 3.3Å; R929-S945 WeakPolarHBondContact O-CB 3.19Å
930	Y	65.8	Low	60.8	Low	146 Å²	146	105.9 Å²	105.9	57%	0.573	56%	0.56	S	S	*	*			trans	-130	169.5	-179.5	59.8	-83.8	0	0	0	112.1	S911 E932	S911-Y930 PolarHBondContact N-O 3.43Å; S911-Y930 PolarHBondContact OG-N 3.43Å; S911-Y930 PolarHBondContact OG-O 3.34Å; Y930-E932 HydrophobicContact CD2-CG 3.95Å; Y930-E932 HydrophobicContact CE2-CG 3.57Å; Y930-E932 WeakPolarHBondContact CE2-OE1 3.43Å; Y930-E932 VanDerWaalsContact CZ-OE1 3.24Å; Y930-E932 PolarHBondContact OH-OE1 3.21Å
931	C	64.6	Low	60.3	Low	57 Å²	57	104.9 Å²	104.9	39%	0.385	56%	0.557	S	S	.	*	B	Isolated β-bridge	trans	-98.5	127.1	-179.9	-176.8	0	0	0	0	108.4	C941	C931-C941 HydrophobicContact CB-CB 3.72Å; C931-C941 WeakPolarHBondContact CB-SG 3.17Å; C931-C941 WeakPolarHBondContact SG-CB 3.24Å; C931-C941 CovalentContact SG-SG 2.04Å; C931-C941 PolarHBondContact SG-SG 2.76Å
932	E	60	Low	59.9	Low	110 Å²	110	101.9 Å²	101.9	51%	0.514	55%	0.546	S	S	.	.			trans	-98.1	5.3	-168.5	-61.2	-157.4	134.8	0	0	114.8	Y930	Y930-E932 HydrophobicContact CD2-CG 3.95Å; Y930-E932 HydrophobicContact CE2-CG 3.57Å; Y930-E932 WeakPolarHBondContact CE2-OE1 3.43Å; Y930-E932 VanDerWaalsContact CZ-OE1 3.24Å; Y930-E932 PolarHBondContact OH-OE1 3.21Å
933	V	54.3	Low	59.5	Low	101 Å²	101	96.3 Å²	96.3	61%	0.612	53%	0.532	S	S	*	.			trans	-89.6	120.9	-176	-172.9	0	0	0	0	111.5
934	H	46.1	Very low	59.4	Low	178 Å²	178	101.1 Å²	101.1	82%	0.824	55%	0.551	S	S	*	*			trans	-92.5	150	175.9	-83.8	-84.2	0	0	0	113.2
935	S	36.8	Very low	59.2	Low	114 Å²	114	102 Å²	102	80%	0.797	56%	0.561	S	S	*	*	S	Bend	trans	74.9	150.7	174.8	-84.1	0	0	0	0	116.7
936	P	49.5	Very low	59.1	Low	112 Å²	112	101.9 Å²	101.9	73%	0.727	56%	0.564	S	S	*	*	S	Bend		-132.8	115.5	-122.3	35.5	-17.1	0	0	0	115.4
937	D	37.5	Very low	59.1	Low	166 Å²	166	99.8 Å²	99.8	89%	0.888	56%	0.559	S	S	*	*				-156.7	149.5	117	-105	-29.9	0	0	0	109.9
938	S	44.3	Very low	59.3	Low	111 Å²	111	104 Å²	104	78%	0.776	58%	0.575	S	S	*	*	S	Bend	trans	-83.1	136.2	-151.1	54.8	0	0	0	0	116.3
939	S	54.1	Low	59.3	Low	96 Å²	96	105.7 Å²	105.7	67%	0.671	58%	0.577	S	S	*	*			trans	170.6	-6.7	139.9	43.7	0	0	0	0	116.5	C941 I942	S939-C941 PolarHBondContact O-N 2.89Å; S939-I942 VanDerWaalsContact O-CG1 3.28Å; S939-I942 WeakPolarHBondContact O-CG1 3.37Å
940	Q	55.6	Low	59.3	Low	184 Å²	184	108.4 Å²	108.4	86%	0.86	60%	0.596	S	S	*	*			trans	-78.3	-16.6	-162.4	-72.8	178.9	-24.2	0	0	118.1	I942	Q940-I942 PolarHBondContact O-N 3.14Å
941	C	58.3	Low	59.4	Low	38 Å²	38	103.7 Å²	103.7	26%	0.257	58%	0.584	S	S	.	*			trans	-92	77.7	172.8	-82.5	0	0	0	0	110.9	W910 C931 S939	W910-C941 HydrophobicContact CH2-CB 4.28Å; W910-C941 HydrophobicContact CZ2-CB 3.83Å; C931-C941 HydrophobicContact CB-CB 3.72Å; C931-C941 WeakPolarHBondContact CB-SG 3.17Å; C931-C941 WeakPolarHBondContact SG-CB 3.24Å; C931-C941 CovalentContact SG-SG 2.04Å; C931-C941 PolarHBondContact SG-SG 2.76Å; S939-C941 PolarHBondContact O-N 2.89Å
942	I	54.3	Low	58.9	Low	147 Å²	147	108.9 Å²	108.9	75%	0.754	61%	0.607	S	S	*	*			trans	-86.6	122.9	179.2	-56.6	179.5	0	0	0	110	S939 Q940	S939-I942 VanDerWaalsContact O-CG1 3.28Å; S939-I942 WeakPolarHBondContact O-CG1 3.37Å; Q940-I942 PolarHBondContact O-N 3.14Å
943	G	59.9	Low	58.4	Low	45 Å²	45	114.3 Å²	114.3	46%	0.464	62%	0.624	S	S	.	*	S	Bend	trans	134.9	161.8	-178.2	0	0	0	0	0	111.8	W910	W910-G943 WeakPolarHBondContact CH2-O 3.02Å; W910-G943 WeakPolarHBondContact CZ2-O 3.46Å
944	N	63.2	Low	57.6	Low	130 Å²	130	117 Å²	117	70%	0.695	64%	0.635	S	S	*	*			trans	-73.8	140.6	-179.9	-66	2.5	0	0	0	111.2	T946	N944-T946 VanDerWaalsContact C-N 3.35Å; N944-T946 WeakPolarHBondContact CB-O 3.39Å
945	S	68.4	Low	57	Low	61 Å²	61	116.4 Å²	116.4	43%	0.427	63%	0.632	S	S	.	*	S	Bend	trans	-80.9	-13.6	173.2	50	0	0	0	0	113.5	S928 R929	S928-S945 CarbonylContact C-O 3.54Å; S928-S945 VanDerWaalsContact CA-O 3.22Å; S928-S945 WeakPolarHBondContact CA-O 3.21Å; S928-S945 WeakPolarHBondContact CB-O 3.05Å; R929-S945 PolarHBondContact N-O 3.3Å; R929-S945 WeakPolarHBondContact O-CB 3.19Å
946	T	72.3	Confident	56.8	Low	52 Å²	52	117.8 Å²	117.8	32%	0.319	63%	0.63	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.9	146.3	173.6	50.3	0	0	0	0	111	R927 N944	R927-T946 WeakPolarHBondContact O-CA 3.48Å; N944-T946 VanDerWaalsContact C-N 3.35Å; N944-T946 WeakPolarHBondContact CB-O 3.39Å
947	Q	78.5	Confident	56.1	Low	72 Å²	72	117.2 Å²	117.2	34%	0.336	63%	0.626	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.2	140	173.3	-166.3	-177.7	13.4	0	0	109	W913 W916 Y926 R927	W913-Q947 HydrophobicContact CE3-CB 4.49Å; W913-Q947 HydrophobicContact CH2-CB 3.78Å; W913-Q947 HydrophobicContact CZ2-CB 4.42Å; W913-Q947 HydrophobicContact CZ3-CB 3.81Å; W916-Q947 HydrophobicContact CH2-CB 4.23Å; W916-Q947 HydrophobicContact CH2-CG 3.94Å; W916-Q947 WeakPolarHBondContact CZ3-O 3.43Å; Y926-Q947 CarbonylContact C-O 3.59Å; Y926-Q947 VanDerWaalsContact CA-O 3.26Å; Y926-Q947 WeakPolarHBondContact CA-O 3.34Å; R927-Q947 HydrophobicContact CG-CB 4.16Å; R927-Q947 PolarHBondContact N-O 3.33Å; R927-Q947 PolarHBondContact O-N 3.02Å
948	Y	79.4	Confident	55.6	Low	147 Å²	147	115.8 Å²	115.8	58%	0.576	62%	0.623	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-115.4	148	175.6	-58.6	-90.1	0	0	0	109	I924 Q925 Y926	I924-Y948 HydrophobicContact CG2-CD1 4.08Å; Q925-Y948 CarbonylContact O-C 3.58Å; Q925-Y948 WeakPolarHBondContact O-CA 3.37Å; Y926-Y948 HydrophobicContact CG-CE1 4.3Å
949	Q	71.9	Confident	55	Low	94 Å²	94	117.9 Å²	117.9	44%	0.439	62%	0.624	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-152.5	138.7	176.1	178.6	174.3	-26.3	0	0	110.5	W916 Q925	W916-Q949 HydrophobicContact CE3-CB 4.43Å; W916-Q949 HydrophobicContact CH2-CB 3.34Å; W916-Q949 HydrophobicContact CH2-CG 4.48Å; W916-Q949 HydrophobicContact CZ2-CB 3.85Å; W916-Q949 VanDerWaalsContact CZ2-OE1 3.24Å; W916-Q949 HydrophobicContact CZ3-CB 3.67Å; Q925-Q949 PolarHBondContact N-O 3.08Å; Q925-Q949 PolarHBondContact O-N 3.43Å
950	D	70.3	Confident	53.8	Low	116 Å²	116	120.9 Å²	120.9	62%	0.62	63%	0.631	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.5	144.8	-179	-47.5	-46.3	0	0	0	112.3	L952	D950-L952 PolarHBondContact O-N 3.26Å
951	C	68.1	Low	52.7	Low	46 Å²	46	117.6 Å²	117.6	31%	0.311	63%	0.626	S	S	.	*			trans	-74.6	108.9	-179.8	-57.7	0	0	0	0	111.3	C919 G923 Q925 Y953	C919-C951 HydrophobicContact CB-CB 4.26Å; C919-C951 WeakPolarHBondContact CB-SG 3.42Å; C919-C951 WeakPolarHBondContact SG-CB 3.25Å; C919-C951 CovalentContact SG-SG 2.03Å; C919-C951 PolarHBondContact SG-SG 2.96Å; G923-C951 VanDerWaalsContact C-SG 3.59Å; G923-C951 WeakPolarHBondContact O-CB 3.33Å; G923-C951 PolarHBondContact O-N 2.93Å; G923-C951 PolarHBondContact O-SG 3.47Å; Q925-C951 VanDerWaalsContact CG-SG 3.53Å; C951-Y953 PolarHBondContact O-N 2.65Å
952	L	54.5	Low	51.2	Low	166 Å²	166	120.1 Å²	120.1	87%	0.869	65%	0.649	S	S	*	*			trans	-78	111.8	171.5	-83.6	158.4	0	0	0	111.1	D950	D950-L952 PolarHBondContact O-N 3.26Å
953	Y	48.7	Very low	49.9	Very low	224 Å²	224	118.2 Å²	118.2	88%	0.878	65%	0.649	S	S	*	*			trans	-135.2	135	165.6	-134.5	-84.3	0	0	0	110.3	C951	C951-Y953 PolarHBondContact O-N 2.65Å
954	N	38.2	Very low	48.3	Very low	157 Å²	157	120.9 Å²	120.9	84%	0.84	66%	0.661	S	S	*	*			trans	-123.7	101.3	176.2	-126.3	-3.9	0	0	0	108
955	E	33.8	Very low	46.8	Very low	166 Å²	166	121.2 Å²	121.2	78%	0.776	66%	0.661	S	S	*	*			trans	-178.6	110.2	134.1	-98.9	-174.5	-160.8	0	0	111.6
956	I	31.1	Very low	45.3	Very low	144 Å²	144	124.9 Å²	124.9	74%	0.738	68%	0.676	S	S	*	*				57.8	137.4	128.9	-54.4	169.7	0	0	0	118.9
957	P	35.3	Very low	43.5	Very low	100 Å²	100	131.6 Å²	131.6	65%	0.649	70%	0.704	S	S	*	*			cis	-142.5	179.7	-28.9	41	-21.1	0	0	0	115.9
958	V	27.2	Very low	41.4	Very low	136 Å²	136	133.8 Å²	133.8	82%	0.824	73%	0.727	S	S	*	*			trans	58.3	150.7	164.8	-105.6	0	0	0	0	118.2
959	I	31.3	Very low	39.4	Very low	155 Å²	155	133.3 Å²	133.3	80%	0.795	74%	0.74	S	S	*	*			cis	-131.9	157.1	8.8	-54.6	175.3	0	0	0	110.5
960	L	29.1	Very low	37.4	Very low	158 Å²	158	136 Å²	136	83%	0.827	76%	0.757	S	S	*	*			trans	-51.8	165.1	169.9	-71.2	163	0	0	0	115.4
961	P	33.9	Very low	35.5	Very low	115 Å²	115	136 Å²	136	75%	0.747	77%	0.765	S	S	*	*			cis	-141.5	161.1	21.9	40.9	-22.2	0	0	0	119.8
962	A	26.5	Very low	34	Very low	91 Å²	91	137.9 Å²	137.9	75%	0.752	79%	0.792	S	S	*	*			trans	43.9	125	150.7	0	0	0	0	0	120.6
963	S	26.4	Very low	33.1	Very low	107 Å²	107	132.8 Å²	132.8	75%	0.748	78%	0.779	S	S	*	*				174.3	158.8	58.5	40.1	0	0	0	0	112.7
964	S	26.3	Very low	32.8	Very low	102 Å²	102	130.5 Å²	130.5	71%	0.713	77%	0.774	S	S	*	*			trans	58.3	127.4	169	32.1	0	0	0	0	118.8
965	I	32.4	Very low	33.4	Very low	137 Å²	137	125.7 Å²	125.7	70%	0.703	75%	0.753	S	S	*	*				68.2	125.9	56.2	-62.3	172.8	0	0	0	111.8
966	D	35.2	Very low	34.3	Very low	138 Å²	138	123.9 Å²	123.9	74%	0.738	75%	0.748	S	S	*	*			cis	-169.3	159.9	-13.5	-111.7	-35.4	0	0	0	108.2
967	E	35.8	Very low	35.4	Very low	193 Å²	193	122.3 Å²	122.3	90%	0.902	74%	0.74	S	S	*	*				169.8	149.6	126.5	-97.4	-160.1	154.7	0	0	114.7
968	S	33.7	Very low	36	Very low	118 Å²	118	123.6 Å²	123.6	83%	0.825	74%	0.737	S	S	*	*			trans	-150.5	154.7	155.6	64.8	0	0	0	0	111.2
969	T	37.2	Very low	37.4	Very low	137 Å²	137	121.9 Å²	121.9	84%	0.84	72%	0.723	S	S	*	*			trans	-74.1	134.8	-157.7	-36.1	0	0	0	0	115.3
970	N	30.6	Very low	39	Very low	150 Å²	150	118.6 Å²	118.6	80%	0.802	71%	0.706	S	S	*	*			trans	-162.6	168.8	147.3	-119.8	-61	0	0	0	116.7	G972	N970-G972 PolarHBondContact O-N 2.7Å; N970-G972 VanDerWaalsContact O-N 3.15Å
971	C	29.8	Very low	40.5	Very low	117 Å²	117	113.6 Å²	113.6	79%	0.791	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-44.1	104.6	-172.6	-60.9	0	0	0	0	116.1	G973	C971-G973 PolarHBondContact O-N 3.14Å
972	G	37.7	Very low	42	Very low	85 Å²	85	111.9 Å²	111.9	88%	0.876	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	49.3	28.6	154.5	0	0	0	0	0	116.7	N970	N970-G972 PolarHBondContact O-N 2.7Å; N970-G972 VanDerWaalsContact O-N 3.15Å
973	G	34.4	Very low	44.1	Very low	58 Å²	58	109.2 Å²	109.2	60%	0.598	66%	0.656	S	S	*	*			trans	-72.9	137.8	-166.7	0	0	0	0	0	112.3	C971 S975	C971-G973 PolarHBondContact O-N 3.14Å; G973-S975 VanDerWaalsContact C-N 3.29Å; G973-S975 PolarHBondContact O-N 2.9Å
974	F	42.1	Very low	46.3	Very low	177 Å²	177	108 Å²	108	78%	0.776	64%	0.641	S	S	*	*			trans	-61.3	99.2	155.7	-78.7	-90.3	0	0	0	107.3	L976 L979	F974-L976 PolarHBondContact O-N 3.24Å; F974-L979 HydrophobicContact CB-CD1 4.27Å
975	S	50.5	Low	48.5	Very low	55 Å²	55	107.2 Å²	107.2	39%	0.385	64%	0.635	S	S	.	*			trans	-45.9	139.4	-179.2	169	0	0	0	0	110.1	G973 I977 H978 L979	G973-S975 VanDerWaalsContact C-N 3.29Å; G973-S975 PolarHBondContact O-N 2.9Å; S975-I977 PolarHBondContact O-N 3.17Å; S975-I977 VanDerWaalsContact O-N 3.07Å; S975-I977 PolarHBondContact OG-N 2.77Å; S975-H978 CarbonylContact O-C 3.46Å; S975-H978 WeakPolarHBondContact O-CA 3.37Å; S975-H978 WeakPolarHBondContact O-CB 3.22Å; S975-H978 PolarHBondContact O-N 3.29Å; S975-L979 PolarHBondContact O-N 3.33Å
976	L	53.8	Low	50.5	Low	128 Å²	128	104.5 Å²	104.5	67%	0.67	63%	0.627	S	S	*	*	H	α-helix	trans	-55.6	-30.2	177.6	-167.5	71	0	0	0	110.8	F974 L979 I980	F974-L976 PolarHBondContact O-N 3.24Å; L976-L979 PolarHBondContact O-N 3.47Å; L976-I980 HydrophobicContact CD1-CD1 4.34Å; L976-I980 HydrophobicContact CD2-CD1 4.15Å; L976-I980 HydrophobicContact CG-CD1 3.76Å; L976-I980 HydrophobicContact CG-CG1 4.3Å; L976-I980 WeakPolarHBondContact O-CB 3.44Å; L976-I980 WeakPolarHBondContact O-CG1 3.38Å; L976-I980 PolarHBondContact O-N 2.73Å
977	I	53.6	Low	52.5	Low	111 Å²	111	105.1 Å²	105.1	57%	0.569	62%	0.624	S	S	*	*	H	α-helix	trans	-69.3	-37.6	173.1	-59.8	174.7	0	0	0	111.6	S975 A981	S975-I977 PolarHBondContact O-N 3.17Å; S975-I977 VanDerWaalsContact O-N 3.07Å; S975-I977 PolarHBondContact OG-N 2.77Å; I977-A981 WeakPolarHBondContact O-CA 3.23Å; I977-A981 WeakPolarHBondContact O-CB 3.15Å; I977-A981 PolarHBondContact O-N 2.8Å
978	H	48.7	Very low	54.5	Low	128 Å²	128	102.9 Å²	102.9	59%	0.593	61%	0.611	S	S	*	*	H	α-helix	trans	-69.3	-38.7	172.3	-91.7	-65.4	0	0	0	112.4	S975 A981 T982	S975-H978 CarbonylContact O-C 3.46Å; S975-H978 WeakPolarHBondContact O-CA 3.37Å; S975-H978 WeakPolarHBondContact O-CB 3.22Å; S975-H978 PolarHBondContact O-N 3.29Å; H978-A981 PolarHBondContact O-N 2.95Å; H978-T982 WeakPolarHBondContact O-CB 3.36Å; H978-T982 WeakPolarHBondContact O-CG2 3.26Å; H978-T982 PolarHBondContact O-N 2.92Å; H978-T982 PolarHBondContact O-OG1 2.77Å
979	L	55.8	Low	56.9	Low	100 Å²	100	99 Å²	99	52%	0.524	59%	0.59	S	S	.	*	H	α-helix	trans	-71.1	-35.7	177.2	-115	167.4	0	0	0	112.4	F974 S975 L976 T982 G983	F974-L979 HydrophobicContact CB-CD1 4.27Å; S975-L979 PolarHBondContact O-N 3.33Å; L976-L979 PolarHBondContact O-N 3.47Å; L979-T982 PolarHBondContact O-OG1 2.75Å; L979-G983 WeakPolarHBondContact O-CA 3.34Å; L979-G983 PolarHBondContact O-N 3.23Å
980	I	65.4	Low	58.7	Low	86 Å²	86	95.8 Å²	95.8	44%	0.441	57%	0.573	S	S	.	*	H	α-helix	trans	-77	-34	172.4	-70.3	175.3	0	0	0	111	L976 G983 I984	L976-I980 HydrophobicContact CD1-CD1 4.34Å; L976-I980 HydrophobicContact CD2-CD1 4.15Å; L976-I980 HydrophobicContact CG-CD1 3.76Å; L976-I980 HydrophobicContact CG-CG1 4.3Å; L976-I980 WeakPolarHBondContact O-CB 3.44Å; L976-I980 WeakPolarHBondContact O-CG1 3.38Å; L976-I980 PolarHBondContact O-N 2.73Å; I980-G983 CarbonylContact O-C 3.12Å; I980-G983 PolarHBondContact O-N 2.76Å; I980-I984 HydrophobicContact CG2-CD1 3.48Å; I980-I984 VanDerWaalsContact CG2-CD1 3.48Å; I980-I984 HydrophobicContact CG2-CG1 4.03Å; I980-I984 WeakPolarHBondContact O-CB 3.4Å; I980-I984 VanDerWaalsContact O-CG1 3.23Å; I980-I984 WeakPolarHBondContact O-CG1 3.41Å; I980-I984 PolarHBondContact O-N 2.9Å
981	A	60.4	Low	60.9	Low	53 Å²	53	91 Å²	91	44%	0.438	55%	0.551	S	S	.	*	H	α-helix	trans	-73.7	-40.2	176.6	0	0	0	0	0	111.9	I977 H978 S985	I977-A981 WeakPolarHBondContact O-CA 3.23Å; I977-A981 WeakPolarHBondContact O-CB 3.15Å; I977-A981 PolarHBondContact O-N 2.8Å; H978-A981 PolarHBondContact O-N 2.95Å; A981-S985 WeakPolarHBondContact O-CA 3.26Å; A981-S985 WeakPolarHBondContact O-CB 3.28Å; A981-S985 PolarHBondContact O-N 3.11Å
982	T	65.1	Low	63.4	Low	78 Å²	78	90.9 Å²	90.9	48%	0.479	54%	0.542	S	S	.	.	H	α-helix	trans	-68.3	-39.2	167.8	58.3	0	0	0	0	110.6	H978 L979 S985 C986	H978-T982 WeakPolarHBondContact O-CB 3.36Å; H978-T982 WeakPolarHBondContact O-CG2 3.26Å; H978-T982 PolarHBondContact O-N 2.92Å; H978-T982 PolarHBondContact O-OG1 2.77Å; L979-T982 PolarHBondContact O-OG1 2.75Å; T982-S985 PolarHBondContact O-N 3.4Å; T982-C986 WeakPolarHBondContact O-CB 3.49Å; T982-C986 PolarHBondContact O-N 3.47Å; T982-C986 PolarHBondContact O-SG 3.06Å
983	G	70.3	Confident	65.4	Low	36 Å²	36	91.9 Å²	91.9	37%	0.371	53%	0.527	S	S	.	.	H	α-helix	trans	-57.7	-49.8	174.5	0	0	0	0	0	113.1	L979 I980 C986 F987	L979-G983 WeakPolarHBondContact O-CA 3.34Å; L979-G983 PolarHBondContact O-N 3.23Å; I980-G983 CarbonylContact O-C 3.12Å; I980-G983 PolarHBondContact O-N 2.76Å; G983-C986 CarbonylContact O-C 3.35Å; G983-C986 PolarHBondContact O-N 3.38Å; G983-F987 VanDerWaalsContact O-CB 3.28Å; G983-F987 WeakPolarHBondContact O-CB 3.05Å; G983-F987 PolarHBondContact O-N 3.41Å
984	I	74.5	Confident	67.7	Low	82 Å²	82	93.2 Å²	93.2	42%	0.421	52%	0.523	S	S	.	.	H	α-helix	trans	-76.2	-34.9	179.4	-71	178.5	0	0	0	111.5	I980 C986 F987 F988	I980-I984 HydrophobicContact CG2-CD1 3.48Å; I980-I984 VanDerWaalsContact CG2-CD1 3.48Å; I980-I984 HydrophobicContact CG2-CG1 4.03Å; I980-I984 WeakPolarHBondContact O-CB 3.4Å; I980-I984 VanDerWaalsContact O-CG1 3.23Å; I980-I984 WeakPolarHBondContact O-CG1 3.41Å; I980-I984 PolarHBondContact O-N 2.9Å; I984-C986 VanDerWaalsContact C-N 3.32Å; I984-F987 PolarHBondContact O-N 2.93Å; I984-F988 HydrophobicContact CG2-CD2 3.39Å; I984-F988 HydrophobicContact CG2-CE2 3.51Å; I984-F988 WeakPolarHBondContact O-CB 3.5Å; I984-F988 PolarHBondContact O-N 3.39Å
985	S	70.8	Confident	69.5	Low	84 Å²	84	90.6 Å²	90.6	59%	0.587	51%	0.512	S	S	*	.	H	α-helix	trans	-66.9	-34.7	170.8	-174.7	0	0	0	0	111.4	A981 T982 G989	A981-S985 WeakPolarHBondContact O-CA 3.26Å; A981-S985 WeakPolarHBondContact O-CB 3.28Å; A981-S985 PolarHBondContact O-N 3.11Å; T982-S985 PolarHBondContact O-N 3.4Å; S985-G989 WeakPolarHBondContact O-CA 3.17Å; S985-G989 PolarHBondContact O-N 2.63Å
986	C	74.5	Confident	70.9	Confident	80 Å²	80	92 Å²	92	54%	0.541	52%	0.517	S	S	.	.	H	α-helix	trans	-75.3	-31.1	168.4	-71	0	0	0	0	112.1	T982 G983 I984 S990	T982-C986 WeakPolarHBondContact O-CB 3.49Å; T982-C986 PolarHBondContact O-N 3.47Å; T982-C986 PolarHBondContact O-SG 3.06Å; G983-C986 CarbonylContact O-C 3.35Å; G983-C986 PolarHBondContact O-N 3.38Å; I984-C986 VanDerWaalsContact C-N 3.32Å; C986-S990 WeakPolarHBondContact O-CA 3.47Å; C986-S990 WeakPolarHBondContact O-CB 3.29Å; C986-S990 PolarHBondContact O-N 3.45Å; C986-S990 PolarHBondContact O-OG 3.34Å
987	F	77.4	Confident	72.1	Confident	152 Å²	152	90 Å²	90	67%	0.667	51%	0.507	S	S	*	.	H	α-helix	trans	-76.6	-47.1	179.9	-152.8	-85.7	0	0	0	111.4	G983 I984 S991	G983-F987 VanDerWaalsContact O-CB 3.28Å; G983-F987 WeakPolarHBondContact O-CB 3.05Å; G983-F987 PolarHBondContact O-N 3.41Å; I984-F987 PolarHBondContact O-N 2.93Å; F987-S991 WeakPolarHBondContact O-CA 3.25Å; F987-S991 WeakPolarHBondContact O-CB 3.3Å; F987-S991 PolarHBondContact O-N 3.05Å; F987-S991 PolarHBondContact O-OG 2.79Å
988	F	78.3	Confident	73.3	Confident	146 Å²	146	91.1 Å²	91.1	64%	0.64	51%	0.505	S	S	*	.	H	α-helix	trans	-70.5	-32.5	168.3	-72.4	-54.6	0	0	0	111.9	I984 S991 L992	I984-F988 HydrophobicContact CG2-CD2 3.39Å; I984-F988 HydrophobicContact CG2-CE2 3.51Å; I984-F988 WeakPolarHBondContact O-CB 3.5Å; I984-F988 PolarHBondContact O-N 3.39Å; F988-S991 PolarHBondContact O-N 3.32Å; F988-L992 WeakPolarHBondContact O-CA 3.49Å; F988-L992 WeakPolarHBondContact O-CB 3.33Å; F988-L992 PolarHBondContact O-N 3.36Å
989	G	83.1	Confident	74.5	Confident	37 Å²	37	87.5 Å²	87.5	38%	0.381	49%	0.492	S	S	.	.	H	α-helix	trans	-63.7	-46.8	172.7	0	0	0	0	0	111.9	S985 L993	S985-G989 WeakPolarHBondContact O-CA 3.17Å; S985-G989 PolarHBondContact O-N 2.63Å; G989-L993 WeakPolarHBondContact O-CB 3.3Å; G989-L993 PolarHBondContact O-N 3.34Å
990	S	76.8	Confident	75.4	Confident	69 Å²	69	90.4 Å²	90.4	48%	0.483	50%	0.497	S	S	.	.	H	α-helix	trans	-72.3	-29.9	173.5	-64.9	0	0	0	0	112.7	C986 T994	C986-S990 WeakPolarHBondContact O-CA 3.47Å; C986-S990 WeakPolarHBondContact O-CB 3.29Å; C986-S990 PolarHBondContact O-N 3.45Å; C986-S990 PolarHBondContact O-OG 3.34Å; S990-T994 VanDerWaalsContact O-CB 3.28Å; S990-T994 WeakPolarHBondContact O-CB 3.35Å; S990-T994 VanDerWaalsContact O-CG2 3.3Å; S990-T994 WeakPolarHBondContact O-CG2 3.48Å; S990-T994 PolarHBondContact O-N 3.28Å; S990-T994 PolarHBondContact O-OG1 3.46Å
991	S	75.9	Confident	75.4	Confident	48 Å²	48	89 Å²	89	34%	0.336	49%	0.494	S	S	.	.	H	α-helix	trans	-74	-36.4	173.4	-61.2	0	0	0	0	111.7	F987 F988 T994 F995	F987-S991 WeakPolarHBondContact O-CA 3.25Å; F987-S991 WeakPolarHBondContact O-CB 3.3Å; F987-S991 PolarHBondContact O-N 3.05Å; F987-S991 PolarHBondContact O-OG 2.79Å; F988-S991 PolarHBondContact O-N 3.32Å; S991-T994 WeakPolarHBondContact CA-OG1 3.38Å; S991-T994 PolarHBondContact O-OG1 2.04Å; S991-F995 WeakPolarHBondContact O-CA 3.45Å; S991-F995 WeakPolarHBondContact O-CB 3.16Å; S991-F995 PolarHBondContact O-N 3.4Å
992	L	81.9	Confident	75.4	Confident	115 Å²	115	90.9 Å²	90.9	60%	0.602	49%	0.493	S	S	*	.	H	α-helix	trans	-74.8	-36.9	173.7	-164.6	79.7	0	0	0	110.3	F988 F995 V996	F988-L992 WeakPolarHBondContact O-CA 3.49Å; F988-L992 WeakPolarHBondContact O-CB 3.33Å; F988-L992 PolarHBondContact O-N 3.36Å; L992-F995 PolarHBondContact O-N 3.01Å; L992-V996 WeakPolarHBondContact O-CB 3.2Å; L992-V996 WeakPolarHBondContact O-CG2 3.04Å; L992-V996 PolarHBondContact O-N 3.38Å
993	L	80.8	Confident	75	Confident	107 Å²	107	96.7 Å²	96.7	56%	0.56	51%	0.507	S	S	*	.	H	α-helix	trans	-66.9	-44.7	172.9	-170.8	74.7	0	0	0	110.7	G989 V996 I997	G989-L993 WeakPolarHBondContact O-CB 3.3Å; G989-L993 PolarHBondContact O-N 3.34Å; L993-V996 PolarHBondContact O-N 3.2Å; L993-I997 HydrophobicContact CD1-CD1 4.49Å; L993-I997 HydrophobicContact CD2-CD1 4.41Å; L993-I997 HydrophobicContact CG-CD1 3.91Å; L993-I997 VanDerWaalsContact O-CB 3.24Å; L993-I997 WeakPolarHBondContact O-CB 3.42Å; L993-I997 WeakPolarHBondContact O-CG1 2.99Å; L993-I997 PolarHBondContact O-N 2.92Å
994	T	81.3	Confident	74.1	Confident	85 Å²	85	98.2 Å²	98.2	52%	0.521	51%	0.511	S	S	.	.	H	α-helix	trans	-71.4	-29.5	174.3	52.2	0	0	0	0	112.4	S990 S991 Y998	S990-T994 VanDerWaalsContact O-CB 3.28Å; S990-T994 WeakPolarHBondContact O-CB 3.35Å; S990-T994 VanDerWaalsContact O-CG2 3.3Å; S990-T994 WeakPolarHBondContact O-CG2 3.48Å; S990-T994 PolarHBondContact O-N 3.28Å; S990-T994 PolarHBondContact O-OG1 3.46Å; S991-T994 WeakPolarHBondContact CA-OG1 3.38Å; S991-T994 PolarHBondContact O-OG1 2.04Å; T994-Y998 WeakPolarHBondContact O-CA 3.5Å; T994-Y998 WeakPolarHBondContact O-CB 3.35Å; T994-Y998 PolarHBondContact O-N 3.28Å
995	F	79.8	Confident	72.8	Confident	123 Å²	123	101.5 Å²	101.5	54%	0.539	52%	0.524	S	S	.	.	H	α-helix	trans	-71	-40	170.6	-176.4	-101.2	0	0	0	112.1	S991 L992 Y998 V999	S991-F995 WeakPolarHBondContact O-CA 3.45Å; S991-F995 WeakPolarHBondContact O-CB 3.16Å; S991-F995 PolarHBondContact O-N 3.4Å; L992-F995 PolarHBondContact O-N 3.01Å; F995-Y998 PolarHBondContact O-N 2.77Å; F995-V999 HydrophobicContact CD1-CG2 4.2Å; F995-V999 HydrophobicContact CD2-CG2 4.49Å; F995-V999 HydrophobicContact CE1-CG2 3.86Å; F995-V999 HydrophobicContact CE2-CG2 4.17Å; F995-V999 HydrophobicContact CZ-CG2 3.85Å; F995-V999 VanDerWaalsContact O-CB 3.3Å; F995-V999 WeakPolarHBondContact O-CB 3.27Å; F995-V999 VanDerWaalsContact O-CG2 3.25Å; F995-V999 WeakPolarHBondContact O-CG2 3.23Å; F995-V999 PolarHBondContact O-N 3.39Å
996	V	81.3	Confident	71.2	Confident	83 Å²	83	108.4 Å²	108.4	50%	0.503	54%	0.537	S	S	.	.	H	α-helix	trans	-68.3	-41.2	173.7	166.8	0	0	0	0	110.5	L992 L993 V999 Y1000	L992-V996 WeakPolarHBondContact O-CB 3.2Å; L992-V996 WeakPolarHBondContact O-CG2 3.04Å; L992-V996 PolarHBondContact O-N 3.38Å; L993-V996 PolarHBondContact O-N 3.2Å; V996-V999 PolarHBondContact O-N 3.37Å; V996-Y1000 WeakPolarHBondContact O-CA 3.36Å; V996-Y1000 WeakPolarHBondContact O-CB 3.38Å; V996-Y1000 PolarHBondContact O-N 2.88Å
997	I	79.5	Confident	69.4	Low	86 Å²	86	113 Å²	113	44%	0.441	55%	0.551	S	S	.	*	H	α-helix	trans	-64.5	-39.8	171.3	-71.3	167.3	0	0	0	110.2	L993 Y1000 C1001	L993-I997 HydrophobicContact CD1-CD1 4.49Å; L993-I997 HydrophobicContact CD2-CD1 4.41Å; L993-I997 HydrophobicContact CG-CD1 3.91Å; L993-I997 VanDerWaalsContact O-CB 3.24Å; L993-I997 WeakPolarHBondContact O-CB 3.42Å; L993-I997 WeakPolarHBondContact O-CG1 2.99Å; L993-I997 PolarHBondContact O-N 2.92Å; I997-Y1000 PolarHBondContact O-N 3.25Å; I997-C1001 WeakPolarHBondContact O-CB 3.2Å; I997-C1001 PolarHBondContact O-N 3.22Å; I997-C1001 PolarHBondContact O-SG 2.93Å
998	Y	77	Confident	67.2	Low	136 Å²	136	110.5 Å²	110.5	53%	0.533	55%	0.553	S	S	.	*	H	α-helix	trans	-67.7	-41.4	177.1	177.5	-101.9	0	0	0	111.9	T994 F995 Q1002	T994-Y998 WeakPolarHBondContact O-CA 3.5Å; T994-Y998 WeakPolarHBondContact O-CB 3.35Å; T994-Y998 PolarHBondContact O-N 3.28Å; F995-Y998 PolarHBondContact O-N 2.77Å; Y998-Q1002 HydrophobicContact CE1-CG 4.26Å; Y998-Q1002 VanDerWaalsContact CZ-NE2 3.33Å; Y998-Q1002 VanDerWaalsContact O-CB 3.29Å; Y998-Q1002 WeakPolarHBondContact O-CB 3.49Å; Y998-Q1002 WeakPolarHBondContact O-CG 3.38Å; Y998-Q1002 PolarHBondContact O-N 3.16Å; Y998-Q1002 PolarHBondContact OH-NE2 2.88Å; Y998-Q1002 VanDerWaalsContact OH-NE2 3.1Å
999	V	75.7	Confident	64.9	Low	52 Å²	52	113 Å²	113	32%	0.315	57%	0.566	S	S	.	*	H	α-helix	trans	-71.4	-33	174.7	169.2	0	0	0	0	111.6	F995 V996 R1003	F995-V999 HydrophobicContact CD1-CG2 4.2Å; F995-V999 HydrophobicContact CD2-CG2 4.49Å; F995-V999 HydrophobicContact CE1-CG2 3.86Å; F995-V999 HydrophobicContact CE2-CG2 4.17Å; F995-V999 HydrophobicContact CZ-CG2 3.85Å; F995-V999 VanDerWaalsContact O-CB 3.3Å; F995-V999 WeakPolarHBondContact O-CB 3.27Å; F995-V999 VanDerWaalsContact O-CG2 3.25Å; F995-V999 WeakPolarHBondContact O-CG2 3.23Å; F995-V999 PolarHBondContact O-N 3.39Å; V996-V999 PolarHBondContact O-N 3.37Å; V999-R1003 WeakPolarHBondContact O-CB 3.38Å; V999-R1003 PolarHBondContact O-N 2.9Å
1000	Y	73.8	Confident	62.4	Low	160 Å²	160	119.9 Å²	119.9	63%	0.627	59%	0.588	S	S	*	*	H	α-helix	trans	-68.9	-48.2	172.3	-177.1	-96.8	0	0	0	110.7	V996 I997 Q1002 R1003 C1004	V996-Y1000 WeakPolarHBondContact O-CA 3.36Å; V996-Y1000 WeakPolarHBondContact O-CB 3.38Å; V996-Y1000 PolarHBondContact O-N 2.88Å; I997-Y1000 PolarHBondContact O-N 3.25Å; Y1000-Q1002 PolarHBondContact O-N 3.47Å; Y1000-R1003 CarbonylContact O-C 3.5Å; Y1000-R1003 WeakPolarHBondContact O-CA 3.47Å; Y1000-R1003 WeakPolarHBondContact O-CB 3.44Å; Y1000-R1003 PolarHBondContact O-N 3.04Å; Y1000-R1003 VanDerWaalsContact O-N 3.11Å; Y1000-C1004 PolarHBondContact O-N 3.1Å; Y1000-C1004 PolarHBondContact O-SG 2.89Å; Y1000-C1004 VanDerWaalsContact O-SG 3.33Å
1001	C	64.6	Low	60.2	Low	57 Å²	57	121 Å²	121	39%	0.385	60%	0.596	S	S	.	*	H	α-helix	trans	-62.1	-38.9	172.8	-73.3	0	0	0	0	112	I997 C1004 Q1005	I997-C1001 WeakPolarHBondContact O-CB 3.2Å; I997-C1001 PolarHBondContact O-N 3.22Å; I997-C1001 PolarHBondContact O-SG 2.93Å; C1001-C1004 PolarHBondContact O-N 3.32Å; C1001-Q1005 VanDerWaalsContact O-CB 3.23Å; C1001-Q1005 WeakPolarHBondContact O-CB 3.4Å; C1001-Q1005 VanDerWaalsContact O-CG 3.27Å; C1001-Q1005 WeakPolarHBondContact O-CG 3.3Å; C1001-Q1005 PolarHBondContact O-N 3.14Å
1002	Q	62.2	Low	57.9	Low	92 Å²	92	125.5 Å²	125.5	43%	0.43	62%	0.622	S	S	.	*	H	α-helix	trans	-64.5	-39.1	171	-82.1	-166	-18.1	0	0	111.8	Y998 Y1000 R1006	Y998-Q1002 HydrophobicContact CE1-CG 4.26Å; Y998-Q1002 VanDerWaalsContact CZ-NE2 3.33Å; Y998-Q1002 VanDerWaalsContact O-CB 3.29Å; Y998-Q1002 WeakPolarHBondContact O-CB 3.49Å; Y998-Q1002 WeakPolarHBondContact O-CG 3.38Å; Y998-Q1002 PolarHBondContact O-N 3.16Å; Y998-Q1002 PolarHBondContact OH-NE2 2.88Å; Y998-Q1002 VanDerWaalsContact OH-NE2 3.1Å; Y1000-Q1002 PolarHBondContact O-N 3.47Å; Q1002-R1006 WeakPolarHBondContact O-CB 3.38Å; Q1002-R1006 PolarHBondContact O-N 2.89Å
1003	R	55.7	Low	55.5	Low	201 Å²	201	125.1 Å²	125.1	76%	0.758	62%	0.624	S	S	*	*	H	α-helix	trans	-65.2	-42.4	173.5	-90.4	-178.2	157.7	168.2	-4.9	112.2	V999 Y1000 R1006	V999-R1003 WeakPolarHBondContact O-CB 3.38Å; V999-R1003 PolarHBondContact O-N 2.9Å; Y1000-R1003 CarbonylContact O-C 3.5Å; Y1000-R1003 WeakPolarHBondContact O-CA 3.47Å; Y1000-R1003 WeakPolarHBondContact O-CB 3.44Å; Y1000-R1003 PolarHBondContact O-N 3.04Å; Y1000-R1003 VanDerWaalsContact O-N 3.11Å; R1003-R1006 PolarHBondContact O-N 3.16Å
1004	C	52.2	Low	53.3	Low	67 Å²	67	127.6 Å²	127.6	45%	0.453	64%	0.636	S	S	.	*	H	α-helix	trans	-67.6	-43.4	175.7	-67.2	0	0	0	0	112.2	Y1000 C1001 R1006 Q1007	Y1000-C1004 PolarHBondContact O-N 3.1Å; Y1000-C1004 PolarHBondContact O-SG 2.89Å; Y1000-C1004 VanDerWaalsContact O-SG 3.33Å; C1001-C1004 PolarHBondContact O-N 3.32Å; C1004-R1006 PolarHBondContact O-N 3.27Å; C1004-Q1007 PolarHBondContact O-N 3.4Å
1005	Q	45.3	Very low	50.7	Low	152 Å²	152	131.2 Å²	131.2	71%	0.71	65%	0.647	S	S	*	*	H	α-helix	trans	-64.4	-23.9	175.1	-78.2	-179	-23.5	0	0	112.8	C1001 Q1007	C1001-Q1005 VanDerWaalsContact O-CB 3.23Å; C1001-Q1005 WeakPolarHBondContact O-CB 3.4Å; C1001-Q1005 VanDerWaalsContact O-CG 3.27Å; C1001-Q1005 WeakPolarHBondContact O-CG 3.3Å; C1001-Q1005 PolarHBondContact O-N 3.14Å; Q1005-Q1007 PolarHBondContact O-N 2.83Å
1006	R	38.8	Very low	48.3	Very low	228 Å²	228	130.8 Å²	130.8	86%	0.86	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	5	177.9	-147.4	169.1	-171.9	168.7	3.1	114.4	Q1002 R1003 C1004	Q1002-R1006 WeakPolarHBondContact O-CB 3.38Å; Q1002-R1006 PolarHBondContact O-N 2.89Å; R1003-R1006 PolarHBondContact O-N 3.16Å; C1004-R1006 PolarHBondContact O-N 3.27Å
1007	Q	35.8	Very low	45.8	Very low	178 Å²	178	132.7 Å²	132.7	83%	0.832	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145	57.1	170.8	-152.8	162.4	6.9	0	0	115.2	C1004 Q1005	C1004-Q1007 PolarHBondContact O-N 3.4Å; Q1005-Q1007 PolarHBondContact O-N 2.83Å
1008	S	31.8	Very low	43.8	Very low	99 Å²	99	134.8 Å²	134.8	69%	0.692	69%	0.685	S	S	*	*			trans	-162.3	79	148.9	27.8	0	0	0	0	111.1	E1010	S1008-E1010 PolarHBondContact O-N 3.14Å
1009	Q	30.5	Very low	41.8	Very low	199 Å²	199	134.3 Å²	134.3	93%	0.93	70%	0.699	S	S	*	*			trans	-81.3	89.1	169.1	-81.1	-168.4	-75.5	0	0	110.9
1010	E	29.6	Very low	39.6	Very low	181 Å²	181	139 Å²	139	85%	0.846	72%	0.723	S	S	*	*			trans	-162.9	130.9	152.9	-109.5	173.2	-171.2	0	0	108.1	S1008	S1008-E1010 PolarHBondContact O-N 3.14Å
1011	S	31.4	Very low	37.5	Very low	91 Å²	91	139.4 Å²	139.4	64%	0.636	73%	0.73	S	S	*	*			cis	-171	70.7	-21.9	38	0	0	0	0	107.9	V1013	S1011-V1013 VanDerWaalsContact C-N 3.34Å; S1011-V1013 PolarHBondContact O-N 3.2Å
1012	T	27.6	Very low	35.8	Very low	143 Å²	143	144.7 Å²	144.7	88%	0.877	75%	0.753	S	S	*	*			trans	-71.1	86	-179.2	52.5	0	0	0	0	111.7	I1014	T1012-I1014 PolarHBondContact O-N 3.3Å; T1012-I1014 VanDerWaalsContact O-N 3.14Å
1013	V	30.7	Very low	34.1	Very low	108 Å²	108	148.4 Å²	148.4	66%	0.655	77%	0.77	S	S	*	*			trans	-71.2	103.2	174.5	177.4	0	0	0	0	109.7	S1011 H1015	S1011-V1013 VanDerWaalsContact C-N 3.34Å; S1011-V1013 PolarHBondContact O-N 3.2Å; V1013-H1015 HydrophobicContact CG1-CB 4.05Å
1014	I	35.8	Very low	32.8	Very low	158 Å²	158	147.9 Å²	147.9	81%	0.81	77%	0.77	S	S	*	*			trans	-80	119.6	155.6	-58.3	174.6	0	0	0	106.6	T1012	T1012-I1014 PolarHBondContact O-N 3.3Å; T1012-I1014 VanDerWaalsContact O-N 3.14Å
1015	H	25.2	Very low	31.6	Very low	161 Å²	161	152.4 Å²	152.4	75%	0.745	78%	0.782	S	S	*	*			trans	-130.9	152.7	169.5	-92.9	2.1	0	0	0	112.3	V1013	V1013-H1015 HydrophobicContact CG1-CB 4.05Å
1016	P	29.4	Very low	30.9	Very low	114 Å²	114	148.8 Å²	148.8	74%	0.74	79%	0.785	S	S	*	*			trans	-97	-175.1	-155.8	-1.6	24.3	0	0	0	112.7
1017	T	30.1	Very low	30.6	Very low	123 Å²	123	145.8 Å²	145.8	76%	0.755	79%	0.786	S	S	*	*	S	Bend	trans	-50.7	136.1	163.7	47.2	0	0	0	0	113.1
1018	T	37.4	Very low	30.4	Very low	130 Å²	130	144 Å²	144	80%	0.798	79%	0.787	S	S	*	*			trans	58.6	121.4	154.9	58	0	0	0	0	119.7
1019	P	35.4	Very low	30.4	Very low	127 Å²	127	145.4 Å²	145.4	83%	0.825	79%	0.792	S	S	*	*			trans	-99.8	128.7	156.7	34.4	-26.3	0	0	0	111.9
1020	N	29	Very low	30.7	Very low	151 Å²	151	141.4 Å²	141.4	81%	0.807	78%	0.783	S	S	*	*			trans	-93.1	150.8	160.2	-100.4	-31.4	0	0	0	109.9
1021	H	30	Very low	30.6	Very low	168 Å²	168	141.6 Å²	141.6	78%	0.778	78%	0.781	S	S	*	*			trans	3.9	126	163	-63.4	-99.6	0	0	0	119.5
1022	L	27.5	Very low	30.4	Very low	168 Å²	168	144.3 Å²	144.3	88%	0.88	79%	0.789	S	S	*	*				-174.2	165.3	107.3	-99.2	164.8	0	0	0	114.9
1023	H	28.2	Very low	30.4	Very low	170 Å²	170	144.2 Å²	144.2	79%	0.787	78%	0.778	S	S	*	*			trans	-60.9	158.4	-179.7	-79.1	-81.9	0	0	0	114.2
1024	Y	26.5	Very low	30.4	Very low	190 Å²	190	147.1 Å²	147.1	75%	0.745	78%	0.782	S	S	*	*				-162	-170.7	75.3	-159.7	-115.4	0	0	0	115.7
1025	K	28.3	Very low	29.9	Very low	162 Å²	162	150.6 Å²	150.6	70%	0.704	79%	0.786	S	S	*	*			trans	-86.5	155.2	-158.8	-54.5	168.4	-174.7	159.9	0	115.4
1026	G	30	Very low	30	Very low	75 Å²	75	148.6 Å²	148.6	77%	0.773	79%	0.786	S	S	*	*			trans	-176.2	112.3	158.4	0	0	0	0	0	113.1
1027	N	32.6	Very low	29.9	Very low	165 Å²	165	149 Å²	149	88%	0.882	79%	0.788	S	S	*	*			trans	-88.8	130.4	178.4	-82	-11	0	0	0	111.9
1028	T	31.9	Very low	29.8	Very low	142 Å²	142	151.6 Å²	151.6	87%	0.871	79%	0.794	S	S	*	*			trans	-169.9	136.8	133.8	10.7	0	0	0	0	111.6
1029	T	30.7	Very low	29.4	Very low	128 Å²	128	153.9 Å²	153.9	79%	0.785	80%	0.796	S	S	*	*			trans	-138.1	151	159	62	0	0	0	0	107.4
1030	P	37.3	Very low	29	Very low	114 Å²	114	157.6 Å²	157.6	74%	0.74	80%	0.799	S	S	*	*				-149.2	138.1	101.5	35.3	-17.5	0	0	0	117.1
1031	K	27.6	Very low	29	Very low	185 Å²	185	159.1 Å²	159.1	80%	0.804	80%	0.799	S	S	*	*				46.7	116.2	129.9	-57.2	-176.4	175	-175.6	0	121.8
1032	N	27.4	Very low	28.9	Very low	149 Å²	149	158 Å²	158	80%	0.797	80%	0.804	S	S	*	*				159.3	147.7	118.4	-81.9	-6.6	0	0	0	109.3
1033	E	28.7	Very low	29.1	Very low	141 Å²	141	157.7 Å²	157.7	66%	0.659	80%	0.802	S	S	*	*			cis	-160.6	152.2	-34.4	-147.6	-165.4	-116.2	0	0	106.7
1034	K	29	Very low	29	Very low	168 Å²	168	157.2 Å²	157.2	73%	0.73	81%	0.806	S	S	*	*			trans	46.6	107	168.7	-66.7	178.5	-178.8	106.2	0	120
1035	Y	25.8	Very low	29.2	Very low	231 Å²	231	156.2 Å²	156.2	91%	0.906	81%	0.805	S	S	*	*				-159.1	142	106.8	-125.8	-86.8	0	0	0	110.4
1036	T	27.7	Very low	29.4	Very low	119 Å²	119	155.1 Å²	155.1	73%	0.73	81%	0.807	S	S	*	*			trans	-108.9	126.2	-177.3	46.9	0	0	0	0	111.9
1037	P	27.9	Very low	29.4	Very low	123 Å²	123	158.6 Å²	158.6	80%	0.799	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-65.3	143.3	157.5	-13.7	29.5	0	0	0	109.9
1038	M	27.8	Very low	29.2	Very low	178 Å²	178	159 Å²	159	88%	0.877	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-87.1	119.6	171.3	-81.8	179.9	-83.2	0	0	110.4
1039	E	27.9	Very low	29.1	Very low	178 Å²	178	159.1 Å²	159.1	83%	0.832	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-74.4	128.1	167.9	-62.2	178.7	144.8	0	0	110.2	K1041	E1039-K1041 PolarHBondContact O-N 2.72Å
1040	F	27.4	Very low	29.5	Very low	205 Å²	205	158.2 Å²	158.2	90%	0.899	80%	0.799	S	S	*	*			trans	-81.9	111.8	164.6	-99	-91.9	0	0	0	109.3	T1042	F1040-T1042 PolarHBondContact O-N 3.14Å
1041	K	28.4	Very low	29	Very low	183 Å²	183	160.2 Å²	160.2	80%	0.796	80%	0.804	S	S	*	*			trans	-68.9	116.8	177.9	-69.1	175.7	177	175.1	0	110.8	E1039 L1043	E1039-K1041 PolarHBondContact O-N 2.72Å; K1041-L1043 PolarHBondContact O-N 2.66Å
1042	T	28.8	Very low	29.1	Very low	145 Å²	145	158 Å²	158	89%	0.89	80%	0.801	S	S	*	*			trans	-72.8	113.5	153.5	40.3	0	0	0	0	108.7	F1040	F1040-T1042 PolarHBondContact O-N 3.14Å
1043	L	30.4	Very low	29.2	Very low	160 Å²	160	161.7 Å²	161.7	84%	0.838	80%	0.803	S	S	*	*			trans	-85.6	113.2	169.6	-93.7	161.3	0	0	0	108.9	K1041	K1041-L1043 PolarHBondContact O-N 2.66Å
1044	N	26.8	Very low	29.1	Very low	161 Å²	161	159.9 Å²	159.9	86%	0.861	80%	0.802	S	S	*	*			trans	-139.3	157.7	143.3	-151.2	-9.4	0	0	0	110.1
1045	K	29.9	Very low	29	Very low	169 Å²	169	158.3 Å²	158.3	74%	0.735	80%	0.802	S	S	*	*			trans	-135.1	160	-160	-145.2	-172.6	-178.7	-177.1	0	110.9
1046	N	32.7	Very low	29.1	Very low	138 Å²	138	156.9 Å²	156.9	74%	0.738	80%	0.8	S	S	*	*			trans	76.7	106.1	168.1	-53.9	-12.8	0	0	0	116.2
1047	N	29.8	Very low	28.9	Very low	149 Å²	149	161.8 Å²	161.8	80%	0.797	81%	0.807	S	S	*	*			trans	-57.6	153.3	158.4	-46.3	-31.5	0	0	0	111
1048	L	29.2	Very low	29.7	Very low	174 Å²	174	160.5 Å²	160.5	91%	0.911	80%	0.799	S	S	*	*			trans	-151.3	137.7	138.6	-107.4	165.4	0	0	0	109.4
1049	I	29.8	Very low	29.5	Very low	144 Å²	144	159 Å²	159	74%	0.738	79%	0.794	S	S	*	*			trans	-153.7	149.4	-171.8	-62.3	178.1	0	0	0	105.6
1050	P	40.2	Very low	29.4	Very low	108 Å²	108	157.4 Å²	157.4	70%	0.701	79%	0.786	S	S	*	*			cis	-117.7	-171.8	-12.3	39.4	-25.6	0	0	0	112.1
1051	D	26.7	Very low	29.3	Very low	157 Å²	157	157.2 Å²	157.2	84%	0.84	79%	0.788	S	S	*	*				-154.6	159.6	109.6	-146.4	-15.8	0	0	0	111.1
1052	D	29	Very low	29.1	Very low	139 Å²	139	153.2 Å²	153.2	74%	0.743	78%	0.779	S	S	*	*			trans	-97.1	147.1	-177.2	-82.3	-54.1	0	0	0	112.7
1053	R	28.6	Very low	28.9	Very low	226 Å²	226	152.7 Å²	152.7	85%	0.853	77%	0.771	S	S	*	*				165.7	125.9	112.6	-90.7	-177.8	165.7	179.4	-4.9	117.3
1054	T	28.4	Very low	28.6	Very low	103 Å²	103	149.8 Å²	149.8	63%	0.632	76%	0.759	S	S	*	*			trans	59.9	107.6	136.8	62.5	0	0	0	0	123.5
1055	N	26.8	Very low	28.6	Very low	135 Å²	135	151.5 Å²	151.5	72%	0.722	76%	0.755	S	S	*	*				85.1	150.3	114.9	-59.7	-9.1	0	0	0	123.4
1056	F	27.9	Very low	28.3	Very low	200 Å²	200	148.8 Å²	148.8	88%	0.877	75%	0.753	S	S	*	*			trans	73.5	84.8	162.8	-68.8	-66.7	0	0	0	121.2
1057	Y	23.5	Very low	28	Very low	223 Å²	223	147.9 Å²	147.9	88%	0.875	75%	0.752	S	S	*	*			trans	-76	177.7	139.2	-95.1	-72.8	0	0	0	111.1
1058	P	43.4	Very low	27.8	Very low	95 Å²	95	147.3 Å²	147.3	62%	0.617	75%	0.754	S	S	*	*			cis	-138.8	-168.1	-8.4	34.8	-12.6	0	0	0	115.4
1059	L	24.6	Very low	27.8	Very low	148 Å²	148	148.6 Å²	148.6	78%	0.775	75%	0.749	S	S	*	*			trans	71	155.1	160.5	-62.7	162.7	0	0	0	115.3
1060	Q	25.5	Very low	27.6	Very low	144 Å²	144	152.4 Å²	152.4	67%	0.673	76%	0.755	S	S	*	*			cis	-148.5	146.7	-0	-147.5	157.7	13.8	0	0	110.1
1061	Q	24.7	Very low	27.7	Very low	201 Å²	201	152.6 Å²	152.6	94%	0.939	76%	0.757	S	S	*	*			trans	-135.8	124.9	153.3	-108.3	-172.1	-2	0	0	110.1
1062	T	24.4	Very low	27.7	Very low	98 Å²	98	150 Å²	150	60%	0.601	75%	0.751	S	S	*	*			trans	-121.9	146.8	-178.8	27.7	0	0	0	0	110
1063	N	25.2	Very low	27.8	Very low	135 Å²	135	148.9 Å²	148.9	72%	0.722	75%	0.749	S	S	*	*			trans	87.5	106.9	140.2	-70.3	4.2	0	0	0	123.7
1064	V	24.2	Very low	27.8	Very low	98 Å²	98	145 Å²	145	59%	0.594	74%	0.744	S	S	*	*				90.5	158.5	119.2	-174.4	0	0	0	0	118.5
1065	Y	26.1	Very low	27.7	Very low	197 Å²	197	146.3 Å²	146.3	77%	0.773	75%	0.748	S	S	*	*			trans	94.2	94	172.5	-55.3	-68.5	0	0	0	114.6
1066	T	24.6	Very low	27.8	Very low	113 Å²	113	146.8 Å²	146.8	69%	0.693	74%	0.743	S	S	*	*				75.2	155.3	74	67.6	0	0	0	0	112.5
1067	T	26.1	Very low	27.9	Very low	118 Å²	118	145.7 Å²	145.7	72%	0.724	74%	0.735	S	S	*	*			cis	-155.6	169.3	15.2	-24.4	0	0	0	0	110.1
1068	T	24.8	Very low	28	Very low	137 Å²	137	141 Å²	141	84%	0.84	73%	0.725	S	S	*	*			trans	-118.4	148.8	165.1	-46.6	0	0	0	0	110.4
1069	Y	28.9	Very low	27.1	Very low	202 Å²	202	145.1 Å²	145.1	79%	0.792	73%	0.729	S	S	*	*			trans	-114.6	152.8	-170.3	-110.8	-83.3	0	0	0	113.4
1070	Y	25.5	Very low	27.4	Very low	224 Å²	224	147.9 Å²	147.9	88%	0.878	73%	0.729	S	S	*	*			trans	-153.6	153.7	142.9	-89.2	-66.6	0	0	0	109.5
1071	P	42.6	Very low	28.4	Very low	112 Å²	112	146 Å²	146	73%	0.727	73%	0.729	S	S	*	*			trans	-97.4	-167.8	-172.1	43.8	-39.2	0	0	0	111.7
1072	S	27.6	Very low	28.6	Very low	103 Å²	103	145.7 Å²	145.7	72%	0.72	73%	0.728	S	S	*	*			cis	-160.7	-174.1	19.8	47.9	0	0	0	0	108.8
1073	T	29.8	Very low	28.9	Very low	115 Å²	115	145.3 Å²	145.3	71%	0.706	74%	0.735	S	S	*	*			cis	-154	-175.9	22.1	58.2	0	0	0	0	111.9
1074	L	28.9	Very low	29.1	Very low	143 Å²	143	144.5 Å²	144.5	75%	0.749	74%	0.74	S	S	*	*			trans	94	117.5	144.5	-123.4	80.4	0	0	0	123.2
1075	N	27.6	Very low	30.2	Very low	131 Å²	131	146 Å²	146	70%	0.701	75%	0.752	S	S	*	*			trans	78.3	110.3	139.7	-85.8	-11.2	0	0	0	125.1
1076	K	27.6	Very low	30.2	Very low	146 Å²	146	140.4 Å²	140.4	64%	0.635	75%	0.754	S	S	*	*				100.2	128.7	119.7	-101.8	-179.2	168.2	-156.6	0	122.4
1077	Y	29.5	Very low	30.6	Very low	177 Å²	177	146.3 Å²	146.3	69%	0.694	76%	0.763	S	S	*	*			trans	66.3	144.7	161.7	-57.2	-59.5	0	0	0	117.1
1078	D	25.9	Very low	30.8	Very low	124 Å²	124	146.2 Å²	146.2	66%	0.663	76%	0.763	S	S	*	*			cis	-154.1	176.3	-7.3	-129.9	-31.5	0	0	0	114.5
1079	Y	25.7	Very low	31	Very low	181 Å²	181	148.6 Å²	148.6	71%	0.71	76%	0.762	S	S	*	*			trans	-3.9	151.5	156.2	-91	-133.1	0	0	0	120.8
1080	R	29.6	Very low	31.4	Very low	206 Å²	206	144 Å²	144	78%	0.777	76%	0.755	S	S	*	*			cis	-163.2	-160.6	0.4	-130	-161.5	179.6	-179.6	2.5	110.9
1081	P	48.2	Very low	31.8	Very low	104 Å²	104	140.7 Å²	140.7	68%	0.675	75%	0.753	S	S	*	*			trans	-128.9	-179	-145	46.4	-27.6	0	0	0	117.2
1082	E	28.8	Very low	31.3	Very low	195 Å²	195	144.6 Å²	144.6	91%	0.911	78%	0.783	S	S	*	*			trans	174.1	157.5	145.1	-101.9	174.2	-148.4	0	0	108.2
1083	A	29.4	Very low	31.5	Very low	90 Å²	90	146.7 Å²	146.7	74%	0.744	79%	0.786	S	S	*	*			cis	-149.9	-177.3	-14	0	0	0	0	0	109.2
1084	S	30.2	Very low	31.6	Very low	119 Å²	119	148.4 Å²	148.4	83%	0.832	79%	0.79	S	S	*	*			trans	-98.3	-157.7	-171.7	-56.8	0	0	0	0	113.9
1085	P	46.5	Very low	31.7	Very low	130 Å²	130	148.7 Å²	148.7	84%	0.844	79%	0.792	S	S	*	*				-123.4	172.3	-88.4	38.7	-23.9	0	0	0	114.9
1086	G	27.4	Very low	32	Very low	79 Å²	79	149.7 Å²	149.7	81%	0.814	80%	0.798	S	S	*	*			trans	-134.6	150.7	172.4	0	0	0	0	0	113.6
1087	R	31.7	Very low	32.2	Very low	236 Å²	236	149.9 Å²	149.9	89%	0.891	81%	0.808	S	S	*	*			trans	-124.7	164.8	-178.2	-86.6	-177.2	169.1	-179.8	-3	111.5
1088	T	30.3	Very low	32.4	Very low	117 Å²	117	148.1 Å²	148.1	72%	0.718	82%	0.815	S	S	*	*			trans	66.6	157.5	158.1	38.8	0	0	0	0	117
1089	F	30	Very low	32.9	Very low	187 Å²	187	149.9 Å²	149.9	82%	0.82	83%	0.826	S	S	*	*			cis	-138.2	-156.2	1.7	-128.9	-58.5	0	0	0	111.1
1090	T	37.2	Very low	33.4	Very low	104 Å²	104	147.5 Å²	147.5	64%	0.638	84%	0.835	S	S	*	*			trans	-101.8	161.2	-164.7	47	0	0	0	0	115.6
1091	N	34.3	Very low	33.8	Very low	156 Å²	156	142.6 Å²	142.6	83%	0.834	84%	0.84	S	S	*	*			trans	62.5	114.1	150.7	-64.6	6.9	0	0	0	119.9
1092	S	31.5	Very low	32.5	Very low	194 Å²	194	146.1 Å²	146.1	100%	1.357	86%	0.855	S	S	*	*				-146.4	0	125.7	64.7	0	0	0	0	109

Retrieved 1,092 of 1,092 residues in 5269 ms (Link to these results)

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