A0A077YYY7_TRITR Loading...

receptor protein-tyrosine kinase

AlphaFold DB , UniProt , Accession A0A077YYY7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,259 aa.

						>A0A077YYY7_TRITR|A0A077YYY7
MSRLLENAQHESKLHGESLLEKLLNDVCSGFDIRNSPRHFYERLSNRAREQWRRCSVVEGDVRLILMTREGLTQEDFELAAMPNVREITGSLLVFQVVGLQSLGTVFPNLRIIRGNSLVYNYALVLFQNPHLREIGLSNLTEISKGGVRIFNNAELCYVNTVDWVKLCREDFAHVVVEGNKDPNLCSEKCTNQSKFCVKHRASGVKDSFINACWNHDTCQTACPKECTERGLACNTTMEPWFCCHPMCAGGCTGPHDTDCYACQHVHYEGRCLKRCPVGLYELSNRRCISRQECVSRGVVKDEVTGDDLYYKALEAEGVCVLRCPPNYEEDPNDPRKCIPCKGICLRKCFGGDVRSLSEASQFKGCNIVIGALDIMMQSGLDSKQLCLAAVQFHYAIVVVGNFAGKLEEYLGDIREITHYLKVSFSPSFVSLNMLKNLRVIRGQELWNEKYAISVIENQHLSKLWNFTNGAGKLKIEQGKLQFHNNPHLCYRYIVELALTTGLSGELHEFDVSPMSNGNKAVCETFVTLTREELEIEIDCHFVGSDTVVLRWDSFNTTMMDHRMFLGYQLYYRPVEMENVSIVENRDACHDSWKMLFYQSQERGAFLTDLKPYTLYAFYITTLMVNSPGARGGISKVVYVRTAFGHPSPVVVRNVESPSASTITIRWEPPVLPNGEVTHYMVSYVEEGRPPATDRNYCDEPPDYSVSSDRLPMTADTHSTGASVATLHITRGSGRPTAGNHLASPDGSCDQLKCCKCPADGSLGVANNGTVLPDHEALAAEQKERAVFENIIHNIVFVSSRHKRRSNGDPSNVKNKYVVTQEPSGLSFLALNNSRSFTTSSPRKAAVPVVVNVTGTNFTLENLRHFTMYEIKIWACQNQSITENFCSKREVRILKSTLPVESKDDIDETTVQVYNASDSSNDRFISWNPPDDPNGALVAYEIEYGRNLDSEQKPKRDCITQADFERNLGFVIRDLPPGNYSFRIRALSLAQRGSWTSYFTLLIADAPKMAETIVILIAVGCSAFAVLFGVLLVTAVYRRKFKKKLPEYLLNVFSANPEYISQLEVYKPDEWELRREDIELVNEIGRGTFGTVYAGRAKNVRSVCGVVFGECAVKTVSEKASIYDRWHFLIEASVMKKFDTAFIVKLYGVVSEGQPALVVMEMMACGNLKDYLRARCLFAAKRESVVRKFLEEENRKTSPRLSRPSVPLCKNNRVALPKANAGHGWMKLTSPDWLELRPSDVDSPEGNGALLNEQSNSFD
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42	Very low	41	Very low	198 Å²	198	130 Å²	130	98%	0.975	65%	0.648	S	S	*	*				0	-64.3	0	-88.4	168.3	162.3	0	0	112.4	R3 L4 L5	M1-R3 PolarHBondContact O-N 3.22Å; M1-L4 WeakPolarHBondContact O-CA 3.45Å; M1-L4 WeakPolarHBondContact O-CB 3.4Å; M1-L4 PolarHBondContact O-N 3.2Å; M1-L5 PolarHBondContact O-N 2.85Å
2	S	41.7	Very low	40.3	Very low	88 Å²	88	125.5 Å²	125.5	62%	0.615	64%	0.639	S	S	*	*	H	α-helix	trans	-50.1	-49.5	-173.8	-40	0	0	0	0	114.8	L4 L5 E6	S2-L4 PolarHBondContact O-N 2.87Å; S2-L4 VanDerWaalsContact O-N 3.13Å; S2-L5 CarbonylContact O-C 3.59Å; S2-L5 WeakPolarHBondContact O-CA 3.42Å; S2-L5 WeakPolarHBondContact O-CB 3.22Å; S2-L5 PolarHBondContact O-N 2.92Å; S2-E6 PolarHBondContact O-N 3.48Å
3	R	41.9	Very low	39.6	Very low	207 Å²	207	129.2 Å²	129.2	78%	0.781	65%	0.647	S	S	*	*	H	α-helix	trans	-62.6	-18.8	175.9	-73	-174.9	177.5	175.2	-0.7	115.9	M1 E6 N7	M1-R3 PolarHBondContact O-N 3.22Å; R3-E6 WeakPolarHBondContact CA-OE2 3.36Å; R3-E6 PolarHBondContact N-OE2 3.5Å; R3-N7 PolarHBondContact O-N 3.13Å; R3-N7 PolarHBondContact O-OD1 2.96Å
4	L	43.9	Very low	39	Very low	135 Å²	135	129.5 Å²	129.5	71%	0.707	65%	0.651	S	S	*	*	H	α-helix	trans	-84.5	-28.3	171.6	-69.9	167.6	0	0	0	111.5	M1 S2 A8	M1-L4 WeakPolarHBondContact O-CA 3.45Å; M1-L4 WeakPolarHBondContact O-CB 3.4Å; M1-L4 PolarHBondContact O-N 3.2Å; S2-L4 PolarHBondContact O-N 2.87Å; S2-L4 VanDerWaalsContact O-N 3.13Å; L4-A8 WeakPolarHBondContact O-CB 3.44Å; L4-A8 PolarHBondContact O-N 3.03Å
5	L	43.7	Very low	38.4	Very low	114 Å²	114	133.1 Å²	133.1	60%	0.597	66%	0.664	S	S	*	*	H	α-helix	trans	-75	-39	171	-73.3	162.5	0	0	0	111.5	M1 S2 A8 Q9	M1-L5 PolarHBondContact O-N 2.85Å; S2-L5 CarbonylContact O-C 3.59Å; S2-L5 WeakPolarHBondContact O-CA 3.42Å; S2-L5 WeakPolarHBondContact O-CB 3.22Å; S2-L5 PolarHBondContact O-N 2.92Å; L5-A8 PolarHBondContact O-N 3.11Å; L5-Q9 WeakPolarHBondContact O-CB 3.22Å; L5-Q9 WeakPolarHBondContact O-CG 3.46Å; L5-Q9 PolarHBondContact O-N 3.42Å
6	E	44.4	Very low	37.8	Very low	113 Å²	113	128.6 Å²	128.6	53%	0.528	66%	0.663	S	S	.	*	H	α-helix	trans	-62.6	-44.5	174.8	-69.3	170.5	118.4	0	0	111.5	S2 R3 Q9 H10	S2-E6 PolarHBondContact O-N 3.48Å; R3-E6 WeakPolarHBondContact CA-OE2 3.36Å; R3-E6 PolarHBondContact N-OE2 3.5Å; E6-Q9 PolarHBondContact O-N 3.33Å; E6-H10 PolarHBondContact O-N 3.32Å; E6-H10 VanDerWaalsContact O-N 3.11Å
7	N	44.1	Very low	37.3	Very low	104 Å²	104	130.1 Å²	130.1	56%	0.556	67%	0.666	S	S	*	*	H	α-helix	trans	-65.5	-44	173.1	-76.3	14.8	0	0	0	111.8	R3 Q9 H10 E11	R3-N7 PolarHBondContact O-N 3.13Å; R3-N7 PolarHBondContact O-OD1 2.96Å; N7-Q9 VanDerWaalsContact C-N 3.29Å; N7-Q9 PolarHBondContact O-N 2.84Å; N7-H10 CarbonylContact O-C 3.58Å; N7-H10 WeakPolarHBondContact O-CA 3.4Å; N7-H10 PolarHBondContact O-N 2.88Å; N7-E11 PolarHBondContact O-N 3.33Å
8	A	39.6	Very low	37.2	Very low	49 Å²	49	126.2 Å²	126.2	41%	0.405	65%	0.652	S	S	.	*	H	α-helix	trans	-60.9	-35.1	176.8	0	0	0	0	0	112.8	L4 L5 H10 S12	L4-A8 WeakPolarHBondContact O-CB 3.44Å; L4-A8 PolarHBondContact O-N 3.03Å; L5-A8 PolarHBondContact O-N 3.11Å; A8-H10 VanDerWaalsContact C-N 3.31Å; A8-S12 VanDerWaalsContact O-CB 3.22Å; A8-S12 WeakPolarHBondContact O-CB 3.46Å; A8-S12 PolarHBondContact O-N 2.86Å; A8-S12 PolarHBondContact O-OG 3.32Å
9	Q	39.2	Very low	37	Very low	138 Å²	138	126.6 Å²	126.6	65%	0.645	66%	0.655	S	S	*	*	H	α-helix	trans	-75.1	-17.9	173.3	-73.5	-172.7	-54.8	0	0	113.7	L5 E6 N7	L5-Q9 WeakPolarHBondContact O-CB 3.22Å; L5-Q9 WeakPolarHBondContact O-CG 3.46Å; L5-Q9 PolarHBondContact O-N 3.42Å; E6-Q9 PolarHBondContact O-N 3.33Å; N7-Q9 VanDerWaalsContact C-N 3.29Å; N7-Q9 PolarHBondContact O-N 2.84Å
10	H	34.9	Very low	36.9	Very low	138 Å²	138	125.9 Å²	125.9	64%	0.639	65%	0.652	S	S	*	*	H	α-helix	trans	-87.5	-29.8	172.9	-145.9	-46.9	0	0	0	112.5	E6 N7 A8	E6-H10 PolarHBondContact O-N 3.32Å; E6-H10 VanDerWaalsContact O-N 3.11Å; N7-H10 CarbonylContact O-C 3.58Å; N7-H10 WeakPolarHBondContact O-CA 3.4Å; N7-H10 PolarHBondContact O-N 2.88Å; A8-H10 VanDerWaalsContact C-N 3.31Å
11	E	35.4	Very low	36.8	Very low	146 Å²	146	124.3 Å²	124.3	68%	0.682	64%	0.641	S	S	*	*	H	α-helix	trans	-81.6	-35.6	172.8	-69	179.4	148.3	0	0	112.1	N7 K13 L14	N7-E11 PolarHBondContact O-N 3.33Å; E11-K13 PolarHBondContact O-N 2.92Å; E11-K13 VanDerWaalsContact O-N 3.09Å; E11-L14 PolarHBondContact O-N 3.09Å
12	S	32.5	Very low	36.4	Very low	76 Å²	76	121.9 Å²	121.9	53%	0.531	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.1	-13.5	174.2	78	0	0	0	0	113.4	A8 L14	A8-S12 VanDerWaalsContact O-CB 3.22Å; A8-S12 WeakPolarHBondContact O-CB 3.46Å; A8-S12 PolarHBondContact O-N 2.86Å; A8-S12 PolarHBondContact O-OG 3.32Å; S12-L14 VanDerWaalsContact C-N 3.29Å
13	K	31.9	Very low	36.4	Very low	173 Å²	173	123 Å²	123	75%	0.752	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-6.4	169.9	-89.6	-179	172.5	177.5	0	114.3	E11	E11-K13 PolarHBondContact O-N 2.92Å; E11-K13 VanDerWaalsContact O-N 3.09Å
14	L	31.4	Very low	36.8	Very low	134 Å²	134	117 Å²	117	70%	0.702	61%	0.606	S	S	*	*	S	Bend	trans	-104.4	-6.2	173.9	-88.5	75.8	0	0	0	114.1	E11 S12	E11-L14 PolarHBondContact O-N 3.09Å; S12-L14 VanDerWaalsContact C-N 3.29Å
15	H	30.2	Very low	37.4	Very low	183 Å²	183	113 Å²	113	85%	0.847	59%	0.586	S	S	*	*	S	Bend	trans	-125.9	31.7	176.5	-82.1	-19.6	0	0	0	113.1
16	G	28.2	Very low	39.1	Very low	62 Å²	62	110.4 Å²	110.4	64%	0.639	57%	0.573	S	S	*	*			trans	-92.7	13.8	176.7	0	0	0	0	0	115.7	S18	G16-S18 PolarHBondContact O-N 2.8Å
17	E	29.9	Very low	41	Very low	153 Å²	153	106.2 Å²	106.2	72%	0.715	56%	0.555	S	S	*	*			trans	-62	101.8	177	-68.5	-171.1	162	0	0	110
18	S	34.8	Very low	43.1	Very low	60 Å²	60	101.9 Å²	101.9	42%	0.42	53%	0.533	S	S	.	.			trans	-71.8	165.8	-168.8	73.2	0	0	0	0	112.9	G16 L20 E21	G16-S18 PolarHBondContact O-N 2.8Å; S18-L20 PolarHBondContact O-N 2.99Å; S18-L20 VanDerWaalsContact OG-CB 3.27Å; S18-L20 WeakPolarHBondContact OG-CB 3.35Å; S18-L20 PolarHBondContact OG-N 2.93Å; S18-E21 PolarHBondContact O-N 2.85Å; S18-E21 VanDerWaalsContact O-N 3.11Å
19	L	32.6	Very low	45.2	Very low	135 Å²	135	103.8 Å²	103.8	71%	0.707	54%	0.543	S	S	*	.	H	α-helix	trans	-55.7	-20.6	170.3	-90.8	73.9	0	0	0	113	K22 L23	L19-K22 WeakPolarHBondContact O-CB 3.39Å; L19-K22 PolarHBondContact O-N 2.84Å; L19-L23 PolarHBondContact O-N 3.48Å
20	L	34.8	Very low	47.4	Very low	112 Å²	112	98.4 Å²	98.4	59%	0.586	52%	0.524	S	S	*	.	H	α-helix	trans	-66.5	-37.4	177.9	-143.7	73.9	0	0	0	112.4	S18 K22 L23	S18-L20 PolarHBondContact O-N 2.99Å; S18-L20 VanDerWaalsContact OG-CB 3.27Å; S18-L20 WeakPolarHBondContact OG-CB 3.35Å; S18-L20 PolarHBondContact OG-N 2.93Å; L20-K22 VanDerWaalsContact C-N 3.29Å; L20-K22 PolarHBondContact O-N 2.95Å; L20-L23 PolarHBondContact O-N 2.9Å
21	E	36	Very low	50	Low	93 Å²	93	93 Å²	93	44%	0.435	50%	0.499	S	S	.	.	H	α-helix	trans	-70.4	-27.7	174.4	-78.7	-177.5	107	0	0	111.9	S18 L23 L24 N25	S18-E21 PolarHBondContact O-N 2.85Å; S18-E21 VanDerWaalsContact O-N 3.11Å; E21-L23 VanDerWaalsContact C-N 3.27Å; E21-L23 PolarHBondContact O-N 3.21Å; E21-L24 PolarHBondContact O-N 2.88Å; E21-N25 PolarHBondContact O-ND2 2.98Å
22	K	34.2	Very low	52.4	Low	146 Å²	146	88.3 Å²	88.3	64%	0.635	48%	0.479	S	S	*	.	H	α-helix	trans	-67.4	-28.8	173.7	-64	-178.4	179.6	175.8	0	112.3	L19 L20	L19-K22 WeakPolarHBondContact O-CB 3.39Å; L19-K22 PolarHBondContact O-N 2.84Å; L20-K22 VanDerWaalsContact C-N 3.29Å; L20-K22 PolarHBondContact O-N 2.95Å
23	L	41.2	Very low	55	Low	113 Å²	113	85 Å²	85	59%	0.592	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-10.3	179.9	-72.4	163.7	0	0	0	114.7	L19 L20 E21	L19-L23 PolarHBondContact O-N 3.48Å; L20-L23 PolarHBondContact O-N 2.9Å; E21-L23 VanDerWaalsContact C-N 3.27Å; E21-L23 PolarHBondContact O-N 3.21Å
24	L	50.6	Low	57.6	Low	79 Å²	79	80.1 Å²	80.1	41%	0.414	43%	0.432	S	S	.	.	S	Bend	trans	-97.4	-8.2	-179.2	-80.3	165.4	0	0	0	114.5	E21	E21-L24 PolarHBondContact O-N 2.88Å
25	N	56.4	Low	59.9	Low	52 Å²	52	78.6 Å²	78.6	28%	0.278	42%	0.424	S	S	.	.	S	Bend	trans	-80.6	-18.5	-170.6	-80.3	-57.8	0	0	0	115.6	E21 V27	E21-N25 PolarHBondContact O-ND2 2.98Å; N25-V27 VanDerWaalsContact C-N 3.26Å; N25-V27 PolarHBondContact O-N 2.97Å
26	D	78.2	Confident	62.5	Low	60 Å²	60	70.6 Å²	70.6	32%	0.321	39%	0.389	S	S	.	.	S	Bend	trans	-90.7	22.4	-166.6	-57.3	-11.5	0	0	0	113.7	S56 V57	D26-S56 PolarHBondContact O-N 3.24Å; D26-S56 PolarHBondContact O-OG 2.94Å; D26-V57 PolarHBondContact O-N 3.13Å
27	V	84.3	Confident	65.2	Low	24 Å²	24	67.8 Å²	67.8	15%	0.145	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	132.4	-177.4	-171.9	0	0	0	0	110.5	N25 Q51 V57 E59	N25-V27 VanDerWaalsContact C-N 3.26Å; N25-V27 PolarHBondContact O-N 2.97Å; V27-Q51 PolarHBondContact O-NE2 3.27Å; V27-V57 WeakPolarHBondContact CA-O 3.29Å; V27-E59 HydrophobicContact CG1-CB 4.4Å; V27-E59 HydrophobicContact CG1-CG 3.76Å
28	C	87.9	Confident	67.8	Low	14 Å²	14	65.8 Å²	65.8	10%	0.095	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	159	172.5	-55.9	0	0	0	0	111.1	C55 V57 E59	C28-C55 HydrophobicContact CB-CB 4.48Å; C28-C55 WeakPolarHBondContact CB-SG 3.32Å; C28-C55 PolarHBondContact N-SG 3.14Å; C28-C55 WeakPolarHBondContact SG-CB 3.46Å; C28-C55 CovalentContact SG-SG 2.03Å; C28-C55 PolarHBondContact SG-SG 3.17Å; C28-V57 PolarHBondContact N-O 2.95Å; C28-E59 PolarHBondContact O-N 2.69Å
29	S	84.8	Confident	70.1	Confident	89 Å²	89	68.6 Å²	68.6	62%	0.622	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	162.1	158.1	61.2	0	0	0	0	110.7	E59	S29-E59 CarbonylContact C-O 3.39Å
30	G	85.2	Confident	72.7	Confident	25 Å²	25	63.5 Å²	63.5	26%	0.258	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.6	154.1	159.9	0	0	0	0	0	112.7	E59 D61	G30-E59 PolarHBondContact N-O 3.25Å; G30-D61 CarbonylContact C-O 3.49Å; G30-D61 WeakPolarHBondContact CA-O 3.2Å
31	F	88.4	Confident	75.1	Confident	23 Å²	23	59 Å²	59	10%	0.101	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	158	-171.8	62.1	-102.6	0	0	0	113.2	I33 W52 V58 D61 V62 R63 L64 M82 F107	F31-I33 HydrophobicContact CD2-CD1 4.15Å; F31-I33 HydrophobicContact CD2-CG1 3.85Å; F31-I33 HydrophobicContact CE2-CD1 3.95Å; F31-I33 HydrophobicContact CE2-CG1 4.1Å; F31-W52 HydrophobicContact CB-CH2 4.37Å; F31-W52 HydrophobicContact CB-CZ3 4.43Å; F31-W52 AromaticContact CD1-CH2 3.85Å; F31-W52 HydrophobicContact CD1-CH2 3.85Å; F31-W52 HydrophobicContact CD1-CZ3 4.09Å; F31-W52 AromaticContact CD2-CH2 3.71Å; F31-W52 HydrophobicContact CD2-CH2 3.71Å; F31-W52 AromaticContact CE1-CH2 3.95Å; F31-W52 HydrophobicContact CE1-CH2 3.95Å; F31-W52 HydrophobicContact CE1-CZ3 4.46Å; F31-W52 AromaticContact CE2-CH2 3.82Å; F31-W52 HydrophobicContact CE2-CH2 3.82Å; F31-W52 HydrophobicContact CE2-CZ2 4.27Å; F31-W52 AromaticContact CG-CH2 3.72Å; F31-W52 HydrophobicContact CG-CH2 3.72Å; F31-W52 HydrophobicContact CG-CZ3 4.13Å; F31-W52 AromaticContact CZ-CH2 3.94Å; F31-W52 HydrophobicContact CZ-CH2 3.94Å; F31-W52 HydrophobicContact CZ-CZ2 4.27Å; F31-V58 HydrophobicContact CD1-CG1 4.09Å; F31-V58 HydrophobicContact CE1-CG1 4.06Å; F31-V58 HydrophobicContact CE1-CG2 3.96Å; F31-D61 PolarHBondContact N-O 3.36Å; F31-V62 HydrophobicContact CD1-CG2 4.46Å; F31-V62 HydrophobicContact CD2-CG1 4.47Å; F31-V62 HydrophobicContact CE1-CG2 3.87Å; F31-V62 HydrophobicContact CE2-CG1 3.68Å; F31-V62 HydrophobicContact CE2-CG2 4.41Å; F31-V62 HydrophobicContact CZ-CB 4.37Å; F31-V62 HydrophobicContact CZ-CG1 3.71Å; F31-V62 HydrophobicContact CZ-CG2 3.85Å; F31-R63 PolarHBondContact O-N 2.73Å; F31-L64 HydrophobicContact CE2-CD2 4.43Å; F31-M82 HydrophobicContact CE1-CE 4.13Å; F31-M82 HydrophobicContact CE1-SD 3.49Å; F31-M82 WeakPolarHBondContact CE1-SD 3.13Å; F31-M82 HydrophobicContact CE2-SD 4.44Å; F31-M82 HydrophobicContact CZ-SD 3.41Å; F31-M82 WeakPolarHBondContact CZ-SD 3.28Å; F31-F107 HydrophobicContact CZ-CE1 4.13Å; F31-F107 HydrophobicContact CZ-CZ 4.07Å
32	D	87.2	Confident	77.4	Confident	49 Å²	49	58.8 Å²	58.8	26%	0.262	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	108.5	-175.5	-169.1	-36.2	0	0	0	109	R34 R63 I65	D32-R34 VanDerWaalsContact CG-NE 3.28Å; D32-R34 WeakPolarHBondContact OD1-CD 3.48Å; D32-R34 WeakPolarHBondContact OD1-CG 3.25Å; D32-R34 IonicContact OD1-CZ 3.91Å; D32-R34 IonicContact OD1-NE 2.72Å; D32-R34 PolarHBondContact OD1-NE 3.36Å; D32-R34 IonicContact OD1-NH2 3.59Å; D32-R34 IonicContact OD2-CZ 3.93Å; D32-R34 IonicContact OD2-NE 2.65Å; D32-R34 PolarHBondContact OD2-NE 3.26Å; D32-R34 IonicContact OD2-NH2 3.71Å; D32-R34 PolarHBondContact OD2-NH2 3.32Å; D32-R63 WeakPolarHBondContact CA-O 3.36Å; D32-R63 HydrophobicContact CB-CB 4.2Å; D32-I65 WeakPolarHBondContact OD1-CD1 3.38Å
33	I	87.2	Confident	79.9	Confident	6 Å²	6	60.7 Å²	60.7	3%	0.031	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	126	179.9	-50.2	-173.3	0	0	0	108.2	F31 P37 F40 W52 R63 L64 I65 M67	F31-I33 HydrophobicContact CD2-CD1 4.15Å; F31-I33 HydrophobicContact CD2-CG1 3.85Å; F31-I33 HydrophobicContact CE2-CD1 3.95Å; F31-I33 HydrophobicContact CE2-CG1 4.1Å; I33-P37 HydrophobicContact CG2-CB 4.43Å; I33-F40 HydrophobicContact CD1-CD1 3.99Å; I33-F40 HydrophobicContact CD1-CE1 3.97Å; I33-F40 HydrophobicContact CD1-CZ 4.45Å; I33-F40 HydrophobicContact CG1-CD1 4.15Å; I33-F40 HydrophobicContact CG1-CD2 4.26Å; I33-F40 HydrophobicContact CG1-CE1 4.11Å; I33-F40 HydrophobicContact CG1-CE2 4.19Å; I33-F40 HydrophobicContact CG1-CG 4.25Å; I33-F40 HydrophobicContact CG1-CZ 4.13Å; I33-F40 HydrophobicContact CG2-CB 3.88Å; I33-F40 HydrophobicContact CG2-CD1 4.32Å; I33-F40 HydrophobicContact CG2-CD2 4.31Å; I33-F40 HydrophobicContact CG2-CG 3.93Å; I33-W52 HydrophobicContact CD1-CH2 4.09Å; I33-W52 HydrophobicContact CD1-CZ2 3.92Å; I33-R63 PolarHBondContact N-O 3.4Å; I33-L64 HydrophobicContact CB-CD2 3.95Å; I33-L64 HydrophobicContact CD1-CD2 3.75Å; I33-L64 HydrophobicContact CG1-CD2 3.96Å; I33-I65 PolarHBondContact O-N 3.14Å; I33-M67 HydrophobicContact CB-CE 3.75Å; I33-M67 HydrophobicContact CG2-CE 3.56Å; I33-M67 HydrophobicContact CG2-SD 4.42Å; I33-M67 WeakPolarHBondContact O-CE 3.47Å
34	R	85.3	Confident	81.9	Confident	71 Å²	71	56.9 Å²	56.9	27%	0.268	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	150.1	-175.8	-50.3	-169.3	179.8	-157.2	-6.9	113.3	D32 S36 I65 V796	D32-R34 VanDerWaalsContact CG-NE 3.28Å; D32-R34 WeakPolarHBondContact OD1-CD 3.48Å; D32-R34 WeakPolarHBondContact OD1-CG 3.25Å; D32-R34 IonicContact OD1-CZ 3.91Å; D32-R34 IonicContact OD1-NE 2.72Å; D32-R34 PolarHBondContact OD1-NE 3.36Å; D32-R34 IonicContact OD1-NH2 3.59Å; D32-R34 IonicContact OD2-CZ 3.93Å; D32-R34 IonicContact OD2-NE 2.65Å; D32-R34 PolarHBondContact OD2-NE 3.26Å; D32-R34 IonicContact OD2-NH2 3.71Å; D32-R34 PolarHBondContact OD2-NH2 3.32Å; R34-S36 PolarHBondContact O-N 3.11Å; R34-I65 VanDerWaalsContact CA-O 3.32Å; R34-I65 WeakPolarHBondContact CA-O 3.33Å; R34-I65 HydrophobicContact CG-CD1 4.47Å; R34-I65 HydrophobicContact CG-CG1 3.9Å; R34-V796 PolarHBondContact NH1-O 3.01Å; R34-V796 PolarHBondContact NH2-O 3.23Å
35	N	80.3	Confident	83.6	Confident	101 Å²	101	56.6 Å²	56.6	54%	0.54	29%	0.286	S	S	.	.	S	Bend	trans	67.1	-43.6	174.4	-44.4	-89.4	0	0	0	116.4	L66	N35-L66 WeakPolarHBondContact CA-O 3.43Å; N35-L66 PolarHBondContact N-O 2.89Å
36	S	84.5	Confident	84.9	Confident	15 Å²	15	59.8 Å²	59.8	11%	0.105	30%	0.303	C	S	.	.			trans	-160.7	125	177.9	169.6	0	0	0	0	110.8	R34 H39 F40	R34-S36 PolarHBondContact O-N 3.11Å; S36-H39 PolarHBondContact OG-N 3.13Å; S36-H39 VanDerWaalsContact OG-N 3.16Å; S36-F40 PolarHBondContact O-N 2.59Å; S36-F40 VanDerWaalsContact O-N 3.16Å
37	P	85.4	Confident	85.1	Confident	3 Å²	3	66 Å²	66	2%	0.019	32%	0.322	C	S	.	.	H	α-helix	trans	-69	-41.4	178.6	28.1	-31.7	0	0	0	111	I33 F40 Y41 M67 D76 F77 A80	I33-P37 HydrophobicContact CG2-CB 4.43Å; P37-F40 WeakPolarHBondContact O-CB 3.26Å; P37-F40 PolarHBondContact O-N 2.71Å; P37-Y41 PolarHBondContact O-N 2.96Å; P37-M67 HydrophobicContact CB-SD 4.23Å; P37-M67 HydrophobicContact CG-SD 4.15Å; P37-D76 HydrophobicContact CG-CB 4.1Å; P37-D76 VanDerWaalsContact CG-O 3.29Å; P37-D76 WeakPolarHBondContact CG-O 3.38Å; P37-F77 HydrophobicContact CB-CD1 4.24Å; P37-F77 HydrophobicContact CB-CE1 4.43Å; P37-F77 HydrophobicContact CG-CD1 3.94Å; P37-F77 HydrophobicContact CG-CE1 3.92Å; P37-F77 HydrophobicContact CG-CG 4.27Å; P37-F77 HydrophobicContact CG-CZ 4.2Å; P37-A80 HydrophobicContact CB-CB 4.02Å
38	R	84.1	Confident	85	Confident	111 Å²	111	66.2 Å²	66.2	42%	0.419	33%	0.326	S	S	.	.	H	α-helix	trans	-56.3	-53	174	179.8	172.4	179.4	160.1	4.4	112.8	F40 Y41 E42 L79	R38-F40 VanDerWaalsContact C-N 3.28Å; R38-F40 PolarHBondContact O-N 2.76Å; R38-Y41 PolarHBondContact O-N 3.38Å; R38-E42 HydrophobicContact CG-CG 4.27Å; R38-E42 WeakPolarHBondContact CG-OE1 3.46Å; R38-E42 IonicContact CZ-OE1 2.74Å; R38-E42 IonicContact NE-OE1 2.76Å; R38-E42 PolarHBondContact NE-OE1 2.87Å; R38-E42 IonicContact NH2-OE1 3.86Å; R38-E42 PolarHBondContact NH2-OE1 2.86Å; R38-E42 WeakPolarHBondContact O-CB 3.28Å; R38-E42 WeakPolarHBondContact O-CG 3.35Å; R38-E42 PolarHBondContact O-N 2.89Å; R38-L79 HydrophobicContact CG-CD1 4.27Å
39	H	83.8	Confident	84.9	Confident	120 Å²	120	68.9 Å²	68.9	56%	0.556	34%	0.335	S	S	*	.	H	α-helix	trans	-65.3	-31.6	178.9	179.5	-91.5	0	0	0	112.5	S36 R43	S36-H39 PolarHBondContact OG-N 3.13Å; S36-H39 VanDerWaalsContact OG-N 3.16Å; H39-R43 VanDerWaalsContact O-CB 3.26Å; H39-R43 WeakPolarHBondContact O-CB 3.29Å; H39-R43 PolarHBondContact O-N 2.81Å; H39-R43 VanDerWaalsContact O-N 3.1Å
40	F	86.2	Confident	84.9	Confident	27 Å²	27	69.1 Å²	69.1	12%	0.118	33%	0.326	C	S	.	.	H	α-helix	trans	-61.4	-51.4	171.4	170.2	-85.9	0	0	0	111.1	I33 S36 P37 R38 R43 L44 W52	I33-F40 HydrophobicContact CD1-CD1 3.99Å; I33-F40 HydrophobicContact CD1-CE1 3.97Å; I33-F40 HydrophobicContact CD1-CZ 4.45Å; I33-F40 HydrophobicContact CG1-CD1 4.15Å; I33-F40 HydrophobicContact CG1-CD2 4.26Å; I33-F40 HydrophobicContact CG1-CE1 4.11Å; I33-F40 HydrophobicContact CG1-CE2 4.19Å; I33-F40 HydrophobicContact CG1-CG 4.25Å; I33-F40 HydrophobicContact CG1-CZ 4.13Å; I33-F40 HydrophobicContact CG2-CB 3.88Å; I33-F40 HydrophobicContact CG2-CD1 4.32Å; I33-F40 HydrophobicContact CG2-CD2 4.31Å; I33-F40 HydrophobicContact CG2-CG 3.93Å; S36-F40 PolarHBondContact O-N 2.59Å; S36-F40 VanDerWaalsContact O-N 3.16Å; P37-F40 WeakPolarHBondContact O-CB 3.26Å; P37-F40 PolarHBondContact O-N 2.71Å; R38-F40 VanDerWaalsContact C-N 3.28Å; R38-F40 PolarHBondContact O-N 2.76Å; F40-R43 PolarHBondContact O-N 2.95Å; F40-L44 HydrophobicContact CE1-CD1 4.16Å; F40-L44 HydrophobicContact CE1-CD2 4.42Å; F40-L44 HydrophobicContact CE1-CG 4.45Å; F40-L44 HydrophobicContact CZ-CD2 4.39Å; F40-L44 PolarHBondContact O-N 2.89Å; F40-W52 HydrophobicContact CE1-CE3 4.27Å; F40-W52 AromaticContact CE1-CH2 3.41Å; F40-W52 HydrophobicContact CE1-CH2 3.41Å; F40-W52 VanDerWaalsContact CE1-CH2 3.41Å; F40-W52 AromaticContact CE1-CZ2 3.7Å; F40-W52 HydrophobicContact CE1-CZ2 3.7Å; F40-W52 AromaticContact CE1-CZ3 3.72Å; F40-W52 HydrophobicContact CE1-CZ3 3.72Å; F40-W52 AromaticContact CZ-CH2 3.61Å; F40-W52 HydrophobicContact CZ-CH2 3.61Å; F40-W52 HydrophobicContact CZ-CZ2 4.36Å; F40-W52 AromaticContact CZ-CZ3 3.69Å; F40-W52 HydrophobicContact CZ-CZ3 3.69Å
41	Y	85.3	Confident	84.7	Confident	18 Å²	18	71.8 Å²	71.8	7%	0.071	33%	0.331	C	S	.	.	H	α-helix	trans	-68.2	-39.5	-178.8	-178.2	-95.7	0	0	0	112.9	P37 R38 R43 L44 R49 R53 L79	P37-Y41 PolarHBondContact O-N 2.96Å; R38-Y41 PolarHBondContact O-N 3.38Å; Y41-R43 VanDerWaalsContact C-N 3.25Å; Y41-R43 PolarHBondContact O-N 3.02Å; Y41-L44 HydrophobicContact CD2-CD1 4.07Å; Y41-L44 WeakPolarHBondContact O-CB 3.4Å; Y41-L44 PolarHBondContact O-N 2.82Å; Y41-L44 VanDerWaalsContact O-N 3.15Å; Y41-R49 HydrophobicContact CE1-CG 4.48Å; Y41-R49 HydrophobicContact CE2-CB 4.3Å; Y41-R49 HydrophobicContact CE2-CG 4.05Å; Y41-R49 PolarHBondContact O-NE 3.05Å; Y41-R53 VanDerWaalsContact OH-CZ 3.29Å; Y41-R53 PolarHBondContact OH-NE 3.47Å; Y41-R53 PolarHBondContact OH-NH2 3.02Å; Y41-R53 VanDerWaalsContact OH-NH2 3.13Å; Y41-L79 HydrophobicContact CD1-CD2 3.79Å; Y41-L79 WeakPolarHBondContact CD1-O 3.41Å; Y41-L79 HydrophobicContact CE1-CD2 3.99Å
42	E	85.5	Confident	84.6	Confident	89 Å²	89	71.7 Å²	71.7	42%	0.416	33%	0.33	S	S	.	.	H	α-helix	trans	-63	-30.4	173.5	-74.1	174.8	173.2	0	0	111.9	R38 R49	R38-E42 HydrophobicContact CG-CG 4.27Å; R38-E42 WeakPolarHBondContact CG-OE1 3.46Å; R38-E42 IonicContact CZ-OE1 2.74Å; R38-E42 IonicContact NE-OE1 2.76Å; R38-E42 PolarHBondContact NE-OE1 2.87Å; R38-E42 IonicContact NH2-OE1 3.86Å; R38-E42 PolarHBondContact NH2-OE1 2.86Å; R38-E42 WeakPolarHBondContact O-CB 3.28Å; R38-E42 WeakPolarHBondContact O-CG 3.35Å; R38-E42 PolarHBondContact O-N 2.89Å; E42-R49 PolarHBondContact O-NH2 3.25Å
43	R	86.5	Confident	84.6	Confident	185 Å²	185	76.7 Å²	76.7	70%	0.698	35%	0.346	S	S	*	.	H	α-helix	trans	-78	-15.8	175.1	-167.4	-179.7	65.4	146.7	2.6	114	H39 F40 Y41	H39-R43 VanDerWaalsContact O-CB 3.26Å; H39-R43 WeakPolarHBondContact O-CB 3.29Å; H39-R43 PolarHBondContact O-N 2.81Å; H39-R43 VanDerWaalsContact O-N 3.1Å; F40-R43 PolarHBondContact O-N 2.95Å; Y41-R43 VanDerWaalsContact C-N 3.25Å; Y41-R43 PolarHBondContact O-N 3.02Å
44	L	83.5	Confident	84.6	Confident	33 Å²	33	81.8 Å²	81.8	17%	0.173	37%	0.365	C	S	.	.	S	Bend	trans	-66.7	137.2	173	-62.3	178.8	0	0	0	110.4	F40 Y41 A48 R49 W52	F40-L44 HydrophobicContact CE1-CD1 4.16Å; F40-L44 HydrophobicContact CE1-CD2 4.42Å; F40-L44 HydrophobicContact CE1-CG 4.45Å; F40-L44 HydrophobicContact CZ-CD2 4.39Å; F40-L44 PolarHBondContact O-N 2.89Å; Y41-L44 HydrophobicContact CD2-CD1 4.07Å; Y41-L44 WeakPolarHBondContact O-CB 3.4Å; Y41-L44 PolarHBondContact O-N 2.82Å; Y41-L44 VanDerWaalsContact O-N 3.15Å; L44-A48 HydrophobicContact CB-CB 4.12Å; L44-A48 HydrophobicContact CD2-CB 4.32Å; L44-R49 HydrophobicContact CB-CG 3.59Å; L44-R49 HydrophobicContact CD1-CG 4.34Å; L44-R49 PolarHBondContact O-NE 3.46Å; L44-R49 VanDerWaalsContact O-NE 3.09Å; L44-R49 PolarHBondContact O-NH2 3.08Å; L44-W52 HydrophobicContact CD1-CB 4.22Å; L44-W52 HydrophobicContact CD1-CD2 4.01Å; L44-W52 HydrophobicContact CD1-CE3 4.08Å; L44-W52 HydrophobicContact CD1-CG 4.09Å
45	S	84.9	Confident	84.9	Confident	74 Å²	74	78.5 Å²	78.5	52%	0.517	35%	0.352	S	S	.	.			trans	-66.7	160.2	170.7	70	0	0	0	0	111	R47 A48 R49	S45-R47 VanDerWaalsContact C-N 3.31Å; S45-R47 PolarHBondContact O-N 2.73Å; S45-A48 CarbonylContact O-C 3.58Å; S45-A48 WeakPolarHBondContact O-CA 3.14Å; S45-A48 WeakPolarHBondContact O-CB 3.22Å; S45-A48 PolarHBondContact O-N 2.7Å; S45-A48 WeakPolarHBondContact OG-CB 3.5Å; S45-A48 PolarHBondContact OG-N 2.78Å; S45-R49 PolarHBondContact O-N 3.45Å
46	N	85.3	Confident	85.4	Confident	119 Å²	119	74.1 Å²	74.1	64%	0.636	33%	0.329	S	S	*	.	H	α-helix	trans	-54.5	-44.7	-178.2	-67.7	-10.8	0	0	0	112.5	A48 R49 E50	N46-A48 VanDerWaalsContact C-N 3.35Å; N46-A48 PolarHBondContact O-N 2.81Å; N46-R49 PolarHBondContact O-N 3.24Å; N46-E50 PolarHBondContact O-N 3.44Å
47	R	82.3	Confident	85.8	Confident	190 Å²	190	73.6 Å²	73.6	72%	0.717	33%	0.326	S	S	*	.	H	α-helix	trans	-61	-40.5	174.4	-173	177.2	-176.8	163.3	6.3	112.3	S45 E50 Q51	S45-R47 VanDerWaalsContact C-N 3.31Å; S45-R47 PolarHBondContact O-N 2.73Å; R47-E50 PolarHBondContact O-N 3.42Å; R47-Q51 PolarHBondContact O-N 2.79Å
48	A	82.2	Confident	86.1	Confident	28 Å²	28	73.4 Å²	73.4	23%	0.231	33%	0.325	C	S	.	.	H	α-helix	trans	-69	-34.6	176.8	0	0	0	0	0	112.4	L44 S45 N46 Q51 W52	L44-A48 HydrophobicContact CB-CB 4.12Å; L44-A48 HydrophobicContact CD2-CB 4.32Å; S45-A48 CarbonylContact O-C 3.58Å; S45-A48 WeakPolarHBondContact O-CA 3.14Å; S45-A48 WeakPolarHBondContact O-CB 3.22Å; S45-A48 PolarHBondContact O-N 2.7Å; S45-A48 WeakPolarHBondContact OG-CB 3.5Å; S45-A48 PolarHBondContact OG-N 2.78Å; N46-A48 VanDerWaalsContact C-N 3.35Å; N46-A48 PolarHBondContact O-N 2.81Å; A48-Q51 PolarHBondContact O-N 2.86Å; A48-W52 VanDerWaalsContact O-CB 3.27Å; A48-W52 WeakPolarHBondContact O-CB 3.21Å; A48-W52 PolarHBondContact O-N 3.16Å
49	R	85.1	Confident	86.3	Confident	71 Å²	71	70.7 Å²	70.7	27%	0.268	32%	0.317	S	S	.	.	H	α-helix	trans	-68.8	-36.7	173	-65.9	-176.6	-166.6	152.7	6.8	112.4	Y41 E42 L44 S45 N46 W52 R53	Y41-R49 HydrophobicContact CE1-CG 4.48Å; Y41-R49 HydrophobicContact CE2-CB 4.3Å; Y41-R49 HydrophobicContact CE2-CG 4.05Å; Y41-R49 PolarHBondContact O-NE 3.05Å; E42-R49 PolarHBondContact O-NH2 3.25Å; L44-R49 HydrophobicContact CB-CG 3.59Å; L44-R49 HydrophobicContact CD1-CG 4.34Å; L44-R49 PolarHBondContact O-NE 3.46Å; L44-R49 VanDerWaalsContact O-NE 3.09Å; L44-R49 PolarHBondContact O-NH2 3.08Å; S45-R49 PolarHBondContact O-N 3.45Å; N46-R49 PolarHBondContact O-N 3.24Å; R49-W52 PolarHBondContact O-N 3.07Å; R49-R53 WeakPolarHBondContact O-CG 3.29Å; R49-R53 PolarHBondContact O-N 3.29Å; R49-R53 VanDerWaalsContact O-N 3.07Å
50	E	83.7	Confident	86.5	Confident	93 Å²	93	66 Å²	66	44%	0.435	30%	0.3	S	S	.	.	H	α-helix	trans	-64	-45.7	171.9	-74.8	-170.3	96.6	0	0	111.7	N46 R47 R53 R54	N46-E50 PolarHBondContact O-N 3.44Å; R47-E50 PolarHBondContact O-N 3.42Å; E50-R53 PolarHBondContact O-N 3.07Å; E50-R54 WeakPolarHBondContact O-CG 3.21Å; E50-R54 PolarHBondContact O-N 2.98Å; E50-R54 IonicContact OE1-CZ 3.64Å; E50-R54 IonicContact OE1-NH1 3.94Å; E50-R54 IonicContact OE1-NH2 2.71Å; E50-R54 PolarHBondContact OE1-NH2 3.5Å
51	Q	82.5	Confident	86.7	Confident	81 Å²	81	65.7 Å²	65.7	38%	0.379	30%	0.3	S	S	.	.	H	α-helix	trans	-61.7	-44.4	174.9	-171.6	178.5	-0.1	0	0	111.5	V27 R47 A48 R53 R54 C55	V27-Q51 PolarHBondContact O-NE2 3.27Å; R47-Q51 PolarHBondContact O-N 2.79Å; A48-Q51 PolarHBondContact O-N 2.86Å; Q51-R53 VanDerWaalsContact C-N 3.27Å; Q51-R53 PolarHBondContact O-N 3.29Å; Q51-R54 PolarHBondContact O-N 3.42Å; Q51-R54 VanDerWaalsContact O-N 3.16Å; Q51-C55 WeakPolarHBondContact O-CB 3.42Å; Q51-C55 PolarHBondContact O-N 2.99Å
52	W	86.5	Confident	87.2	Confident	21 Å²	21	64.8 Å²	64.8	8%	0.08	30%	0.297	C	S	.	.	H	α-helix	trans	-54.6	-42.1	175.8	-166.8	-92.2	0	0	0	112.3	F31 I33 F40 L44 A48 R49 C55 A80 M82	F31-W52 HydrophobicContact CB-CH2 4.37Å; F31-W52 HydrophobicContact CB-CZ3 4.43Å; F31-W52 AromaticContact CD1-CH2 3.85Å; F31-W52 HydrophobicContact CD1-CH2 3.85Å; F31-W52 HydrophobicContact CD1-CZ3 4.09Å; F31-W52 AromaticContact CD2-CH2 3.71Å; F31-W52 HydrophobicContact CD2-CH2 3.71Å; F31-W52 AromaticContact CE1-CH2 3.95Å; F31-W52 HydrophobicContact CE1-CH2 3.95Å; F31-W52 HydrophobicContact CE1-CZ3 4.46Å; F31-W52 AromaticContact CE2-CH2 3.82Å; F31-W52 HydrophobicContact CE2-CH2 3.82Å; F31-W52 HydrophobicContact CE2-CZ2 4.27Å; F31-W52 AromaticContact CG-CH2 3.72Å; F31-W52 HydrophobicContact CG-CH2 3.72Å; F31-W52 HydrophobicContact CG-CZ3 4.13Å; F31-W52 AromaticContact CZ-CH2 3.94Å; F31-W52 HydrophobicContact CZ-CH2 3.94Å; F31-W52 HydrophobicContact CZ-CZ2 4.27Å; I33-W52 HydrophobicContact CD1-CH2 4.09Å; I33-W52 HydrophobicContact CD1-CZ2 3.92Å; F40-W52 HydrophobicContact CE1-CE3 4.27Å; F40-W52 AromaticContact CE1-CH2 3.41Å; F40-W52 HydrophobicContact CE1-CH2 3.41Å; F40-W52 VanDerWaalsContact CE1-CH2 3.41Å; F40-W52 AromaticContact CE1-CZ2 3.7Å; F40-W52 HydrophobicContact CE1-CZ2 3.7Å; F40-W52 AromaticContact CE1-CZ3 3.72Å; F40-W52 HydrophobicContact CE1-CZ3 3.72Å; F40-W52 AromaticContact CZ-CH2 3.61Å; F40-W52 HydrophobicContact CZ-CH2 3.61Å; F40-W52 HydrophobicContact CZ-CZ2 4.36Å; F40-W52 AromaticContact CZ-CZ3 3.69Å; F40-W52 HydrophobicContact CZ-CZ3 3.69Å; L44-W52 HydrophobicContact CD1-CB 4.22Å; L44-W52 HydrophobicContact CD1-CD2 4.01Å; L44-W52 HydrophobicContact CD1-CE3 4.08Å; L44-W52 HydrophobicContact CD1-CG 4.09Å; A48-W52 VanDerWaalsContact O-CB 3.27Å; A48-W52 WeakPolarHBondContact O-CB 3.21Å; A48-W52 PolarHBondContact O-N 3.16Å; R49-W52 PolarHBondContact O-N 3.07Å; W52-C55 WeakPolarHBondContact O-CB 3.41Å; W52-A80 PolarHBondContact NE1-O 2.99Å; W52-M82 HydrophobicContact CD2-CE 3.85Å; W52-M82 HydrophobicContact CD2-SD 4.24Å; W52-M82 HydrophobicContact CE3-CE 4.13Å; W52-M82 HydrophobicContact CG-CE 4.25Å; W52-M82 HydrophobicContact CH2-CE 4.36Å; W52-M82 HydrophobicContact CH2-SD 3.92Å; W52-M82 HydrophobicContact CZ2-CE 4.12Å; W52-M82 HydrophobicContact CZ2-CG 3.96Å; W52-M82 HydrophobicContact CZ2-SD 3.44Å; W52-M82 WeakPolarHBondContact CZ2-SD 3.42Å; W52-M82 HydrophobicContact CZ3-CE 4.38Å
53	R	86.4	Confident	87.5	Confident	154 Å²	154	63.7 Å²	63.7	58%	0.581	29%	0.289	S	S	*	.	H	α-helix	trans	-74.5	-32.9	178	-73.1	175.9	172.4	-161.8	-8.1	113.9	Y41 R49 E50 Q51 N84	Y41-R53 VanDerWaalsContact OH-CZ 3.29Å; Y41-R53 PolarHBondContact OH-NE 3.47Å; Y41-R53 PolarHBondContact OH-NH2 3.02Å; Y41-R53 VanDerWaalsContact OH-NH2 3.13Å; R49-R53 WeakPolarHBondContact O-CG 3.29Å; R49-R53 PolarHBondContact O-N 3.29Å; R49-R53 VanDerWaalsContact O-N 3.07Å; E50-R53 PolarHBondContact O-N 3.07Å; Q51-R53 VanDerWaalsContact C-N 3.27Å; Q51-R53 PolarHBondContact O-N 3.29Å; R53-N84 PolarHBondContact O-ND2 3.48Å
54	R	87.7	Confident	87.8	Confident	114 Å²	114	55 Å²	55	43%	0.43	26%	0.256	S	S	.	.	H	α-helix	trans	-81.6	-17.9	177.1	-68.3	179.9	-169.3	142.1	16	113.4	E50 Q51 S56	E50-R54 WeakPolarHBondContact O-CG 3.21Å; E50-R54 PolarHBondContact O-N 2.98Å; E50-R54 IonicContact OE1-CZ 3.64Å; E50-R54 IonicContact OE1-NH1 3.94Å; E50-R54 IonicContact OE1-NH2 2.71Å; E50-R54 PolarHBondContact OE1-NH2 3.5Å; Q51-R54 PolarHBondContact O-N 3.42Å; Q51-R54 VanDerWaalsContact O-N 3.16Å; R54-S56 PolarHBondContact O-N 3.38Å
55	C	91.2	Very high	88.1	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.007	25%	0.248	C	C	.	.			trans	-51.9	119.6	-177.4	-158.7	0	0	0	0	112.9	C28 Q51 W52 M82 N84 V85	C28-C55 HydrophobicContact CB-CB 4.48Å; C28-C55 WeakPolarHBondContact CB-SG 3.32Å; C28-C55 PolarHBondContact N-SG 3.14Å; C28-C55 WeakPolarHBondContact SG-CB 3.46Å; C28-C55 CovalentContact SG-SG 2.03Å; C28-C55 PolarHBondContact SG-SG 3.17Å; Q51-C55 WeakPolarHBondContact O-CB 3.42Å; Q51-C55 PolarHBondContact O-N 2.99Å; W52-C55 WeakPolarHBondContact O-CB 3.41Å; C55-M82 HydrophobicContact CB-CE 3.67Å; C55-N84 CarbonylContact O-C 3.57Å; C55-N84 VanDerWaalsContact O-C 3.32Å; C55-N84 WeakPolarHBondContact O-CB 3.04Å; C55-V85 HydrophobicContact CB-CG2 4.33Å; C55-V85 WeakPolarHBondContact O-CG2 3.41Å; C55-V85 PolarHBondContact O-N 3.22Å
56	S	91.7	Very high	88.1	Confident	9 Å²	9	51.1 Å²	51.1	6%	0.063	23%	0.23	C	C	.	.			trans	-111.6	-22.6	174.7	79.1	0	0	0	0	113.5	D26 R54 N84 V85 R86 E87	D26-S56 PolarHBondContact O-N 3.24Å; D26-S56 PolarHBondContact O-OG 2.94Å; R54-S56 PolarHBondContact O-N 3.38Å; S56-N84 VanDerWaalsContact CA-O 3.27Å; S56-N84 WeakPolarHBondContact CA-O 3.49Å; S56-N84 WeakPolarHBondContact CB-O 3.49Å; S56-V85 WeakPolarHBondContact O-CA 3.23Å; S56-R86 WeakPolarHBondContact O-CG 3.46Å; S56-R86 PolarHBondContact O-N 3.44Å; S56-R86 PolarHBondContact OG-NE 3.44Å; S56-R86 PolarHBondContact OG-NH2 2.87Å; S56-E87 PolarHBondContact O-N 3.5Å
57	V	91.6	Very high	88.2	Confident	4 Å²	4	45.5 Å²	45.5	2%	0.024	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	132.9	178.1	-176.1	0	0	0	0	111.2	D26 V27 C28 E59 E87 T89	D26-V57 PolarHBondContact O-N 3.13Å; V27-V57 WeakPolarHBondContact CA-O 3.29Å; C28-V57 PolarHBondContact N-O 2.95Å; V57-E59 HydrophobicContact CG1-CG 4.49Å; V57-E87 WeakPolarHBondContact CA-O 3.33Å; V57-E87 HydrophobicContact CB-CB 4.43Å; V57-E87 HydrophobicContact CG1-CB 3.99Å; V57-E87 HydrophobicContact CG1-CG 3.89Å; V57-E87 VanDerWaalsContact CG1-OE2 3.26Å; V57-E87 WeakPolarHBondContact CG1-OE2 3.33Å; V57-E87 HydrophobicContact CG2-CB 4.07Å; V57-E87 WeakPolarHBondContact CG2-OE2 3.18Å; V57-T89 HydrophobicContact CG1-CG2 4.34Å
58	V	92.4	Very high	88.3	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	104	174.8	-173.9	0	0	0	0	109.5	F31 G60 V62 V85 E87 I88 T89	F31-V58 HydrophobicContact CD1-CG1 4.09Å; F31-V58 HydrophobicContact CE1-CG1 4.06Å; F31-V58 HydrophobicContact CE1-CG2 3.96Å; V58-G60 VanDerWaalsContact C-N 3.33Å; V58-G60 PolarHBondContact O-N 3.03Å; V58-G60 VanDerWaalsContact O-N 3.08Å; V58-V62 HydrophobicContact CB-CG2 4.29Å; V58-V62 HydrophobicContact CG1-CG2 3.78Å; V58-V62 HydrophobicContact CG2-CG2 4.37Å; V58-V85 HydrophobicContact CG2-CG1 4.04Å; V58-V85 HydrophobicContact CG2-CG2 4.07Å; V58-E87 PolarHBondContact N-O 2.72Å; V58-I88 HydrophobicContact CB-CG1 4.33Å; V58-I88 HydrophobicContact CG2-CG1 4.47Å; V58-T89 PolarHBondContact O-N 3.12Å; V58-T89 PolarHBondContact O-OG1 3.3Å
59	E	88.8	Confident	88.1	Confident	53 Å²	53	46.8 Å²	46.8	25%	0.248	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	78.6	173.1	-71.5	-178.7	176.5	0	0	109.7	V27 C28 S29 G30 V57 T89 R286 R287	V27-E59 HydrophobicContact CG1-CB 4.4Å; V27-E59 HydrophobicContact CG1-CG 3.76Å; C28-E59 PolarHBondContact O-N 2.69Å; S29-E59 CarbonylContact C-O 3.39Å; G30-E59 PolarHBondContact N-O 3.25Å; V57-E59 HydrophobicContact CG1-CG 4.49Å; E59-T89 WeakPolarHBondContact CA-OG1 3.28Å; E59-T89 HydrophobicContact CG-CG2 4.35Å; E59-R286 IonicContact OE1-CZ 2.82Å; E59-R286 VanDerWaalsContact OE1-CZ 3.25Å; E59-R286 IonicContact OE1-NE 3.38Å; E59-R286 PolarHBondContact OE1-NE 3.22Å; E59-R286 IonicContact OE1-NH2 3.51Å; E59-R286 PolarHBondContact OE1-NH2 2.91Å; E59-R287 IonicContact OE1-CZ 2.72Å; E59-R287 IonicContact OE1-NE 2.78Å; E59-R287 PolarHBondContact OE1-NE 3.5Å; E59-R287 IonicContact OE1-NH2 3.56Å; E59-R287 PolarHBondContact OE1-NH2 2.85Å; E59-R287 IonicContact OE2-CZ 3.61Å; E59-R287 IonicContact OE2-NH2 2.93Å; E59-R287 PolarHBondContact OE2-NH2 3.3Å
60	G	87.7	Confident	87.3	Confident	21 Å²	21	52.5 Å²	52.5	22%	0.216	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	154.4	-167.1	175.4	0	0	0	0	0	113.3	V58 T89 G90	V58-G60 VanDerWaalsContact C-N 3.33Å; V58-G60 PolarHBondContact O-N 3.03Å; V58-G60 VanDerWaalsContact O-N 3.08Å; G60-T89 PolarHBondContact N-OG1 2.86Å; G60-G90 WeakPolarHBondContact O-CA 3.49Å; G60-G90 PolarHBondContact O-N 3.09Å
61	D	90.7	Very high	87	Confident	21 Å²	21	51.5 Å²	51.5	11%	0.112	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	152.6	170.4	-70.6	-30.2	0	0	0	111.9	G30 F31 R63 S91 S117	G30-D61 CarbonylContact C-O 3.49Å; G30-D61 WeakPolarHBondContact CA-O 3.2Å; F31-D61 PolarHBondContact N-O 3.36Å; D61-R63 HydrophobicContact CB-CG 4.39Å; D61-R63 IonicContact OD2-CZ 2.73Å; D61-R63 IonicContact OD2-NE 2.69Å; D61-R63 IonicContact OD2-NH2 2.77Å; D61-R63 PolarHBondContact OD2-NH2 2.8Å; D61-S91 CarbonylContact C-O 3.52Å; D61-S91 WeakPolarHBondContact CA-O 3.5Å; D61-S91 VanDerWaalsContact CG-OG 3.27Å; D61-S91 PolarHBondContact OD1-N 3.28Å; D61-S91 PolarHBondContact OD1-OG 3.26Å; D61-S117 WeakPolarHBondContact OD1-CB 3.37Å; D61-S117 PolarHBondContact OD1-OG 3.15Å; D61-S117 PolarHBondContact OD2-OG 3.07Å
62	V	94.4	Very high	87	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	122.9	168.1	172.6	0	0	0	0	109	F31 V58 I88 S91 L92 L93 F107	F31-V62 HydrophobicContact CD1-CG2 4.46Å; F31-V62 HydrophobicContact CD2-CG1 4.47Å; F31-V62 HydrophobicContact CE1-CG2 3.87Å; F31-V62 HydrophobicContact CE2-CG1 3.68Å; F31-V62 HydrophobicContact CE2-CG2 4.41Å; F31-V62 HydrophobicContact CZ-CB 4.37Å; F31-V62 HydrophobicContact CZ-CG1 3.71Å; F31-V62 HydrophobicContact CZ-CG2 3.85Å; V58-V62 HydrophobicContact CB-CG2 4.29Å; V58-V62 HydrophobicContact CG1-CG2 3.78Å; V58-V62 HydrophobicContact CG2-CG2 4.37Å; V62-I88 HydrophobicContact CB-CD1 4.25Å; V62-I88 HydrophobicContact CG2-CD1 3.79Å; V62-I88 HydrophobicContact CG2-CG1 3.99Å; V62-I88 HydrophobicContact CG2-CG2 4.04Å; V62-S91 PolarHBondContact N-O 3.37Å; V62-L92 HydrophobicContact CB-CD1 3.88Å; V62-L92 HydrophobicContact CG1-CD1 3.5Å; V62-L92 WeakPolarHBondContact O-CA 3.31Å; V62-L93 PolarHBondContact O-N 2.8Å; V62-F107 HydrophobicContact CG1-CE2 4.14Å; V62-F107 HydrophobicContact CG1-CZ 3.71Å
63	R	92.8	Very high	87	Confident	65 Å²	65	50.4 Å²	50.4	25%	0.245	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	118.9	-178.3	-53.6	-178	-173.6	166.2	3.1	110.3	F31 D32 I33 D61 I65 L93	F31-R63 PolarHBondContact O-N 2.73Å; D32-R63 WeakPolarHBondContact CA-O 3.36Å; D32-R63 HydrophobicContact CB-CB 4.2Å; I33-R63 PolarHBondContact N-O 3.4Å; D61-R63 HydrophobicContact CB-CG 4.39Å; D61-R63 IonicContact OD2-CZ 2.73Å; D61-R63 IonicContact OD2-NE 2.69Å; D61-R63 IonicContact OD2-NH2 2.77Å; D61-R63 PolarHBondContact OD2-NH2 2.8Å; R63-I65 HydrophobicContact CB-CD1 4.44Å; R63-I65 HydrophobicContact CB-CG2 4.4Å; R63-L93 WeakPolarHBondContact CA-O 3.43Å; R63-L93 HydrophobicContact CG-CB 4.39Å
64	L	91.9	Very high	86.9	Confident	4 Å²	4	44.2 Å²	44.2	2%	0.021	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	94.4	174.8	-60.4	-176.8	0	0	0	107.8	F31 I33 M67 L93 V94 F95 V97 L103 F107	F31-L64 HydrophobicContact CE2-CD2 4.43Å; I33-L64 HydrophobicContact CB-CD2 3.95Å; I33-L64 HydrophobicContact CD1-CD2 3.75Å; I33-L64 HydrophobicContact CG1-CD2 3.96Å; L64-M67 HydrophobicContact CB-CE 3.98Å; L64-M67 HydrophobicContact CD2-CE 4.1Å; L64-L93 PolarHBondContact N-O 3.21Å; L64-V94 HydrophobicContact CB-CG1 4.26Å; L64-V94 HydrophobicContact CB-CG2 4.46Å; L64-V94 HydrophobicContact CD1-CG2 4.47Å; L64-V94 WeakPolarHBondContact O-CA 3.14Å; L64-F95 PolarHBondContact O-N 2.78Å; L64-V97 HydrophobicContact CB-CG2 4.29Å; L64-V97 WeakPolarHBondContact O-CG2 3.33Å; L64-L103 HydrophobicContact CD1-CD2 4.12Å; L64-F107 HydrophobicContact CD1-CE2 4Å; L64-F107 HydrophobicContact CD1-CZ 4.46Å
65	I	90.1	Very high	86.8	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	148.2	-163.2	63.1	-179.9	0	0	0	114.2	D32 I33 R34 R63 M67 L93 F95 V796	D32-I65 WeakPolarHBondContact OD1-CD1 3.38Å; I33-I65 PolarHBondContact O-N 3.14Å; R34-I65 VanDerWaalsContact CA-O 3.32Å; R34-I65 WeakPolarHBondContact CA-O 3.33Å; R34-I65 HydrophobicContact CG-CD1 4.47Å; R34-I65 HydrophobicContact CG-CG1 3.9Å; R63-I65 HydrophobicContact CB-CD1 4.44Å; R63-I65 HydrophobicContact CB-CG2 4.4Å; I65-M67 PolarHBondContact O-N 3.14Å; I65-L93 HydrophobicContact CG2-CD2 4.16Å; I65-L93 HydrophobicContact CG2-CG 4.04Å; I65-F95 CarbonylContact C-O 3.02Å; I65-F95 VanDerWaalsContact CA-O 3.25Å; I65-F95 WeakPolarHBondContact CA-O 3.27Å; I65-F95 HydrophobicContact CB-CB 4.45Å; I65-F95 HydrophobicContact CG2-CB 3.87Å; I65-V796 HydrophobicContact CB-CG2 4.4Å; I65-V796 HydrophobicContact CD1-CB 4.34Å; I65-V796 HydrophobicContact CD1-CG1 4.3Å; I65-V796 HydrophobicContact CD1-CG2 3.94Å; I65-V796 HydrophobicContact CG2-CG2 4.34Å
66	L	85.9	Confident	86.6	Confident	25 Å²	25	46.6 Å²	46.6	13%	0.131	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	52.8	54.1	177.5	-56.6	178.3	0	0	0	113.1	N35 F95 V796 F797	N35-L66 WeakPolarHBondContact CA-O 3.43Å; N35-L66 PolarHBondContact N-O 2.89Å; L66-F95 HydrophobicContact CD2-CD1 4.32Å; L66-F95 HydrophobicContact CD2-CE1 3.98Å; L66-F95 PolarHBondContact N-O 2.66Å; L66-V796 HydrophobicContact CD1-CG1 3.49Å; L66-V796 VanDerWaalsContact CD1-CG1 3.49Å; L66-V796 HydrophobicContact CD2-CG1 3.81Å; L66-V796 HydrophobicContact CG-CG1 3.53Å; L66-F797 HydrophobicContact CD1-CD1 4.2Å; L66-F797 HydrophobicContact CD1-CE1 3.63Å; L66-F797 HydrophobicContact CD1-CZ 4.19Å; L66-F797 HydrophobicContact CD2-CE1 4.07Å; L66-F797 HydrophobicContact CD2-CZ 3.81Å; L66-F797 HydrophobicContact CG-CE1 4.49Å
67	M	87.8	Confident	86.5	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	64.7	172.7	-53	-164.9	-150.3	0	0	108.9	I33 P37 L64 I65 L72 F77 Q96 V97 V98	I33-M67 HydrophobicContact CB-CE 3.75Å; I33-M67 HydrophobicContact CG2-CE 3.56Å; I33-M67 HydrophobicContact CG2-SD 4.42Å; I33-M67 WeakPolarHBondContact O-CE 3.47Å; P37-M67 HydrophobicContact CB-SD 4.23Å; P37-M67 HydrophobicContact CG-SD 4.15Å; L64-M67 HydrophobicContact CB-CE 3.98Å; L64-M67 HydrophobicContact CD2-CE 4.1Å; I65-M67 PolarHBondContact O-N 3.14Å; M67-L72 HydrophobicContact CB-CD1 3.96Å; M67-F77 HydrophobicContact CE-CE1 4.44Å; M67-F77 HydrophobicContact SD-CE1 3.59Å; M67-F77 VanDerWaalsContact SD-CE1 3.59Å; M67-F77 HydrophobicContact SD-CZ 4.1Å; M67-Q96 CarbonylContact C-O 3.59Å; M67-Q96 PolarHBondContact N-O 3.14Å; M67-V97 HydrophobicContact CB-CG1 4.21Å; M67-V97 HydrophobicContact SD-CG1 4.4Å; M67-V98 VanDerWaalsContact O-CB 3.32Å; M67-V98 WeakPolarHBondContact O-CB 3.37Å; M67-V98 PolarHBondContact O-N 3.4Å
68	T	83.1	Confident	86.2	Confident	78 Å²	78	51.3 Å²	51.3	48%	0.479	27%	0.267	S	S	.	.			trans	-98.4	13.6	-168.8	52.2	0	0	0	0	114.2	Q96	T68-Q96 HydrophobicContact CG2-CB 3.9Å
69	R	77.6	Confident	85.8	Confident	167 Å²	167	54.7 Å²	54.7	63%	0.63	28%	0.284	S	S	*	.			trans	-73.8	129.2	176	-76.5	-176.1	167.2	-164.3	-4.2	110.7	L72	R69-L72 HydrophobicContact CB-CD1 4.08Å; R69-L72 HydrophobicContact CB-CG 4.18Å; R69-L72 WeakPolarHBondContact O-CG 3.44Å
70	E	68.9	Low	85.5	Confident	192 Å²	192	52.4 Å²	52.4	90%	0.897	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	148.4	166	-64.6	-179	176.9	0	0	110.7	L72	E70-L72 VanDerWaalsContact C-N 3.32Å; E70-L72 PolarHBondContact O-N 2.87Å
71	G	77.4	Confident	85.6	Confident	71 Å²	71	52.4 Å²	52.4	73%	0.732	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	-0.5	-178.4	0	0	0	0	0	115.7	T73	G71-T73 PolarHBondContact O-N 3.18Å
72	L	83.7	Confident	85.6	Confident	19 Å²	19	51.5 Å²	51.5	10%	0.099	27%	0.268	C	S	.	.			trans	-65.9	128	167.8	-74.9	173.7	0	0	0	110.7	M67 R69 E70 D76 G99	M67-L72 HydrophobicContact CB-CD1 3.96Å; R69-L72 HydrophobicContact CB-CD1 4.08Å; R69-L72 HydrophobicContact CB-CG 4.18Å; R69-L72 WeakPolarHBondContact O-CG 3.44Å; E70-L72 VanDerWaalsContact C-N 3.32Å; E70-L72 PolarHBondContact O-N 2.87Å; L72-D76 HydrophobicContact CD2-CB 4.23Å; L72-G99 VanDerWaalsContact O-CA 3.29Å; L72-G99 WeakPolarHBondContact O-CA 3.43Å
73	T	85.8	Confident	85.4	Confident	61 Å²	61	54.3 Å²	54.3	37%	0.374	29%	0.286	S	S	.	.			trans	-111.5	169	-178.4	65.6	0	0	0	0	111.4	G71 E75 D76 F77	G71-T73 PolarHBondContact O-N 3.18Å; T73-E75 PolarHBondContact O-N 2.81Å; T73-E75 PolarHBondContact OG1-N 2.88Å; T73-D76 PolarHBondContact N-OD2 3.25Å; T73-D76 WeakPolarHBondContact O-CB 3.46Å; T73-D76 PolarHBondContact O-N 3.37Å; T73-D76 PolarHBondContact OG1-N 3.22Å; T73-D76 PolarHBondContact OG1-OD2 3.35Å; T73-F77 WeakPolarHBondContact O-CD2 3.41Å
74	Q	84.7	Confident	85.4	Confident	24 Å²	24	55.3 Å²	55.3	11%	0.112	30%	0.296	C	S	.	.	H	α-helix	trans	-62	-32.5	172.5	-179.4	53.2	73.3	0	0	111.9	D76 F77 E78 T105	Q74-D76 VanDerWaalsContact C-N 3.29Å; Q74-D76 PolarHBondContact O-N 2.98Å; Q74-F77 PolarHBondContact O-N 2.68Å; Q74-F77 VanDerWaalsContact O-N 3.11Å; Q74-E78 PolarHBondContact O-N 2.91Å; Q74-E78 VanDerWaalsContact O-N 3.15Å; Q74-T105 PolarHBondContact NE2-OG1 2.81Å
75	E	85.9	Confident	85.5	Confident	143 Å²	143	55.1 Å²	55.1	67%	0.668	30%	0.295	S	S	*	.	H	α-helix	trans	-61.7	-34	176.2	-57.6	176.3	-162.5	0	0	112.5	T73 F77 E78 L79	T73-E75 PolarHBondContact O-N 2.81Å; T73-E75 PolarHBondContact OG1-N 2.88Å; E75-F77 PolarHBondContact O-N 2.8Å; E75-E78 PolarHBondContact O-N 2.92Å; E75-L79 PolarHBondContact O-N 2.62Å; E75-L79 VanDerWaalsContact O-N 3.08Å
76	D	86.8	Confident	85.7	Confident	21 Å²	21	59.1 Å²	59.1	11%	0.112	31%	0.31	C	S	.	.	H	α-helix	trans	-64.9	-27.4	176.6	-67.5	-76.2	0	0	0	112.6	P37 L72 T73 Q74	P37-D76 HydrophobicContact CG-CB 4.1Å; P37-D76 VanDerWaalsContact CG-O 3.29Å; P37-D76 WeakPolarHBondContact CG-O 3.38Å; L72-D76 HydrophobicContact CD2-CB 4.23Å; T73-D76 PolarHBondContact N-OD2 3.25Å; T73-D76 WeakPolarHBondContact O-CB 3.46Å; T73-D76 PolarHBondContact O-N 3.37Å; T73-D76 PolarHBondContact OG1-N 3.22Å; T73-D76 PolarHBondContact OG1-OD2 3.35Å; Q74-D76 VanDerWaalsContact C-N 3.29Å; Q74-D76 PolarHBondContact O-N 2.98Å
77	F	88	Confident	86.1	Confident	5 Å²	5	58.1 Å²	58.1	2%	0.022	31%	0.305	C	S	.	.	H	α-helix	trans	-83.4	-38.5	175.6	-65.1	-86.8	0	0	0	111.9	P37 M67 T73 Q74 E75 L79 A80 A81 V97 V98 L100 V106	P37-F77 HydrophobicContact CB-CD1 4.24Å; P37-F77 HydrophobicContact CB-CE1 4.43Å; P37-F77 HydrophobicContact CG-CD1 3.94Å; P37-F77 HydrophobicContact CG-CE1 3.92Å; P37-F77 HydrophobicContact CG-CG 4.27Å; P37-F77 HydrophobicContact CG-CZ 4.2Å; M67-F77 HydrophobicContact CE-CE1 4.44Å; M67-F77 HydrophobicContact SD-CE1 3.59Å; M67-F77 VanDerWaalsContact SD-CE1 3.59Å; M67-F77 HydrophobicContact SD-CZ 4.1Å; T73-F77 WeakPolarHBondContact O-CD2 3.41Å; Q74-F77 PolarHBondContact O-N 2.68Å; Q74-F77 VanDerWaalsContact O-N 3.11Å; E75-F77 PolarHBondContact O-N 2.8Å; F77-L79 PolarHBondContact O-N 2.89Å; F77-A80 CarbonylContact O-C 3.57Å; F77-A80 PolarHBondContact O-N 2.94Å; F77-A81 PolarHBondContact O-N 2.92Å; F77-A81 VanDerWaalsContact O-N 3.07Å; F77-V97 HydrophobicContact CE1-CG1 3.38Å; F77-V97 HydrophobicContact CE2-CG1 4.49Å; F77-V97 HydrophobicContact CZ-CG1 3.38Å; F77-V98 WeakPolarHBondContact CE2-O 3.35Å; F77-V98 WeakPolarHBondContact CZ-O 3.36Å; F77-L100 HydrophobicContact CB-CD1 4.22Å; F77-L100 HydrophobicContact CD1-CB 4.23Å; F77-L100 HydrophobicContact CD1-CD1 4.13Å; F77-L100 HydrophobicContact CD2-CB 4.08Å; F77-L100 HydrophobicContact CD2-CD1 4.45Å; F77-L100 HydrophobicContact CE1-CB 4.04Å; F77-L100 HydrophobicContact CE2-CB 3.92Å; F77-L100 VanDerWaalsContact CE2-N 3.34Å; F77-L100 HydrophobicContact CG-CB 4.27Å; F77-L100 HydrophobicContact CG-CD1 4Å; F77-L100 HydrophobicContact CZ-CB 3.9Å; F77-V106 HydrophobicContact CB-CG2 4.22Å
78	E	86.2	Confident	86.4	Confident	108 Å²	108	58.1 Å²	58.1	51%	0.505	31%	0.305	S	S	.	.	H	α-helix	trans	-58.4	-36.8	173.5	-69.7	170.3	-158.2	0	0	111.7	Q74 E75 A80 A81	Q74-E78 PolarHBondContact O-N 2.91Å; Q74-E78 VanDerWaalsContact O-N 3.15Å; E75-E78 PolarHBondContact O-N 2.92Å; E78-A80 PolarHBondContact O-N 2.9Å; E78-A80 VanDerWaalsContact O-N 3.17Å; E78-A81 WeakPolarHBondContact O-CB 3.31Å; E78-A81 PolarHBondContact O-N 3.22Å; E78-A81 VanDerWaalsContact O-N 3.14Å
79	L	83.6	Confident	86.9	Confident	70 Å²	70	55.3 Å²	55.3	37%	0.366	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-25.7	174.2	-126.9	161.4	0	0	0	113.7	R38 Y41 E75 F77	R38-L79 HydrophobicContact CG-CD1 4.27Å; Y41-L79 HydrophobicContact CD1-CD2 3.79Å; Y41-L79 WeakPolarHBondContact CD1-O 3.41Å; Y41-L79 HydrophobicContact CE1-CD2 3.99Å; E75-L79 PolarHBondContact O-N 2.62Å; E75-L79 VanDerWaalsContact O-N 3.08Å; F77-L79 PolarHBondContact O-N 2.89Å
80	A	83.7	Confident	87.5	Confident	5 Å²	5	47.4 Å²	47.4	4%	0.041	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	2.4	179.2	0	0	0	0	0	113.9	P37 W52 F77 E78	P37-A80 HydrophobicContact CB-CB 4.02Å; W52-A80 PolarHBondContact NE1-O 2.99Å; F77-A80 CarbonylContact O-C 3.57Å; F77-A80 PolarHBondContact O-N 2.94Å; E78-A80 PolarHBondContact O-N 2.9Å; E78-A80 VanDerWaalsContact O-N 3.17Å
81	A	88.6	Confident	88.7	Confident	21 Å²	21	38.3 Å²	38.3	17%	0.174	22%	0.216	C	C	.	.			trans	-59.7	152.4	-173.3	0	0	0	0	0	113.6	F77 E78 P83 T105	F77-A81 PolarHBondContact O-N 2.92Å; F77-A81 VanDerWaalsContact O-N 3.07Å; E78-A81 WeakPolarHBondContact O-CB 3.31Å; E78-A81 PolarHBondContact O-N 3.22Å; E78-A81 VanDerWaalsContact O-N 3.14Å; A81-P83 VanDerWaalsContact C-CD 3.47Å; A81-P83 VanDerWaalsContact O-CD 3.3Å; A81-P83 WeakPolarHBondContact O-CD 3.45Å; A81-T105 WeakPolarHBondContact CB-O 3.32Å
82	M	91.2	Very high	89.6	Confident	2 Å²	2	35 Å²	35	1%	0.01	18%	0.181	C	C	.	.			trans	-121.2	69	-176.6	-59.1	-169.7	81	0	0	110.4	F31 W52 C55 N84 V85 V106 F107	F31-M82 HydrophobicContact CE1-CE 4.13Å; F31-M82 HydrophobicContact CE1-SD 3.49Å; F31-M82 WeakPolarHBondContact CE1-SD 3.13Å; F31-M82 HydrophobicContact CE2-SD 4.44Å; F31-M82 HydrophobicContact CZ-SD 3.41Å; F31-M82 WeakPolarHBondContact CZ-SD 3.28Å; W52-M82 HydrophobicContact CD2-CE 3.85Å; W52-M82 HydrophobicContact CD2-SD 4.24Å; W52-M82 HydrophobicContact CE3-CE 4.13Å; W52-M82 HydrophobicContact CG-CE 4.25Å; W52-M82 HydrophobicContact CH2-CE 4.36Å; W52-M82 HydrophobicContact CH2-SD 3.92Å; W52-M82 HydrophobicContact CZ2-CE 4.12Å; W52-M82 HydrophobicContact CZ2-CG 3.96Å; W52-M82 HydrophobicContact CZ2-SD 3.44Å; W52-M82 WeakPolarHBondContact CZ2-SD 3.42Å; W52-M82 HydrophobicContact CZ3-CE 4.38Å; C55-M82 HydrophobicContact CB-CE 3.67Å; M82-N84 PolarHBondContact O-N 3.03Å; M82-V85 HydrophobicContact CB-CB 4.22Å; M82-V85 HydrophobicContact CB-CG2 3.67Å; M82-V85 HydrophobicContact CE-CG2 3.91Å; M82-V85 PolarHBondContact O-N 2.59Å; M82-V85 HydrophobicContact SD-CG2 4.24Å; M82-V106 PolarHBondContact N-O 2.99Å; M82-F107 HydrophobicContact CB-CD1 4.17Å; M82-F107 HydrophobicContact CB-CE1 4.14Å; M82-F107 HydrophobicContact CG-CE1 4.28Å; M82-F107 HydrophobicContact SD-CE1 4.06Å
83	P	90.6	Very high	90.1	Very high	59 Å²	59	34 Å²	34	38%	0.383	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-19.8	-167.7	25.8	-36.1	0	0	0	114.5	A81 P108 N109	A81-P83 VanDerWaalsContact C-CD 3.47Å; A81-P83 VanDerWaalsContact O-CD 3.3Å; A81-P83 WeakPolarHBondContact O-CD 3.45Å; P83-P108 HydrophobicContact CB-CG 4.15Å; P83-N109 PolarHBondContact O-ND2 3.03Å
84	N	92.5	Very high	90.6	Very high	86 Å²	86	31.1 Å²	31.1	46%	0.46	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-10.4	179.4	-69.7	-43.7	0	0	0	113.8	R53 C55 S56 M82 R86	R53-N84 PolarHBondContact O-ND2 3.48Å; C55-N84 CarbonylContact O-C 3.57Å; C55-N84 VanDerWaalsContact O-C 3.32Å; C55-N84 WeakPolarHBondContact O-CB 3.04Å; S56-N84 VanDerWaalsContact CA-O 3.27Å; S56-N84 WeakPolarHBondContact CA-O 3.49Å; S56-N84 WeakPolarHBondContact CB-O 3.49Å; M82-N84 PolarHBondContact O-N 3.03Å; N84-R86 PolarHBondContact O-N 2.7Å
85	V	94.3	Very high	91	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.153	C	C	.	.			trans	-68.5	120.8	-178.1	169.7	0	0	0	0	110.6	C55 S56 V58 M82 I88 F107 N109 L110	C55-V85 HydrophobicContact CB-CG2 4.33Å; C55-V85 WeakPolarHBondContact O-CG2 3.41Å; C55-V85 PolarHBondContact O-N 3.22Å; S56-V85 WeakPolarHBondContact O-CA 3.23Å; V58-V85 HydrophobicContact CG2-CG1 4.04Å; V58-V85 HydrophobicContact CG2-CG2 4.07Å; M82-V85 HydrophobicContact CB-CB 4.22Å; M82-V85 HydrophobicContact CB-CG2 3.67Å; M82-V85 HydrophobicContact CE-CG2 3.91Å; M82-V85 PolarHBondContact O-N 2.59Å; M82-V85 HydrophobicContact SD-CG2 4.24Å; V85-I88 HydrophobicContact CG1-CG1 4.33Å; V85-F107 HydrophobicContact CB-CD1 4.43Å; V85-F107 HydrophobicContact CG1-CD1 4.38Å; V85-N109 CarbonylContact O-C 3.54Å; V85-L110 HydrophobicContact CG1-CD1 4.44Å; V85-L110 WeakPolarHBondContact O-CA 3.02Å; V85-L110 PolarHBondContact O-N 3.2Å; V85-L110 VanDerWaalsContact O-N 3.14Å
86	R	93.4	Very high	91.1	Very high	84 Å²	84	24.6 Å²	24.6	32%	0.317	13%	0.128	S	C	.	.			trans	-118.6	-22.2	-177.8	47.4	170.5	172.6	-177.1	-14.2	113.5	S56 N84 N109 R111 I112 Y261	S56-R86 WeakPolarHBondContact O-CG 3.46Å; S56-R86 PolarHBondContact O-N 3.44Å; S56-R86 PolarHBondContact OG-NE 3.44Å; S56-R86 PolarHBondContact OG-NH2 2.87Å; N84-R86 PolarHBondContact O-N 2.7Å; R86-N109 WeakPolarHBondContact CA-O 3Å; R86-R111 PolarHBondContact O-N 3.2Å; R86-I112 PolarHBondContact O-N 3.34Å; R86-I112 VanDerWaalsContact O-N 3.13Å; R86-Y261 WeakPolarHBondContact CD-O 3.47Å; R86-Y261 PolarHBondContact NH1-O 3.15Å
87	E	93.9	Very high	91.3	Very high	5 Å²	5	23.6 Å²	23.6	2%	0.023	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	127.9	-176.1	176.5	179.6	-143	0	0	110.6	S56 V57 V58 I112 R114 R286	S56-E87 PolarHBondContact O-N 3.5Å; V57-E87 WeakPolarHBondContact CA-O 3.33Å; V57-E87 HydrophobicContact CB-CB 4.43Å; V57-E87 HydrophobicContact CG1-CB 3.99Å; V57-E87 HydrophobicContact CG1-CG 3.89Å; V57-E87 VanDerWaalsContact CG1-OE2 3.26Å; V57-E87 WeakPolarHBondContact CG1-OE2 3.33Å; V57-E87 HydrophobicContact CG2-CB 4.07Å; V57-E87 WeakPolarHBondContact CG2-OE2 3.18Å; V58-E87 PolarHBondContact N-O 2.72Å; E87-I112 WeakPolarHBondContact CA-O 3.41Å; E87-R114 HydrophobicContact CG-CG 4.47Å; E87-R114 IonicContact OE1-CZ 3.93Å; E87-R114 IonicContact OE1-NE 3.4Å; E87-R114 PolarHBondContact OE1-NE 3.47Å; E87-R114 IonicContact OE1-NH2 3.33Å; E87-R114 PolarHBondContact OE1-NH2 2.89Å; E87-R286 IonicContact OE2-NH1 3.23Å; E87-R286 PolarHBondContact OE2-NH1 2.78Å
88	I	95.1	Very high	91.5	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	125.6	166.9	-65.3	169.1	0	0	0	107.4	V58 V62 V85 L92 L110 I112 I113 R114	V58-I88 HydrophobicContact CB-CG1 4.33Å; V58-I88 HydrophobicContact CG2-CG1 4.47Å; V62-I88 HydrophobicContact CB-CD1 4.25Å; V62-I88 HydrophobicContact CG2-CD1 3.79Å; V62-I88 HydrophobicContact CG2-CG1 3.99Å; V62-I88 HydrophobicContact CG2-CG2 4.04Å; V85-I88 HydrophobicContact CG1-CG1 4.33Å; I88-L92 HydrophobicContact CD1-CB 4.46Å; I88-L92 HydrophobicContact CD1-CD2 4.41Å; I88-L110 HydrophobicContact CB-CD1 4.45Å; I88-L110 HydrophobicContact CD1-CD1 3.85Å; I88-L110 HydrophobicContact CD1-CD2 3.78Å; I88-L110 HydrophobicContact CG1-CD1 3.82Å; I88-I112 PolarHBondContact N-O 3.13Å; I88-I113 WeakPolarHBondContact O-CA 3.43Å; I88-R114 PolarHBondContact O-N 2.86Å
89	T	92.2	Very high	91.6	Very high	18 Å²	18	19.7 Å²	19.7	11%	0.11	11%	0.107	C	C	.	.	S	Bend	trans	-85.6	-26.6	-176.9	69.9	0	0	0	0	113.8	V57 V58 E59 G60 N116	V57-T89 HydrophobicContact CG1-CG2 4.34Å; V58-T89 PolarHBondContact O-N 3.12Å; V58-T89 PolarHBondContact O-OG1 3.3Å; E59-T89 WeakPolarHBondContact CA-OG1 3.28Å; E59-T89 HydrophobicContact CG-CG2 4.35Å; G60-T89 PolarHBondContact N-OG1 2.86Å; T89-N116 WeakPolarHBondContact O-CB 3.46Å; T89-N116 PolarHBondContact O-N 2.92Å
90	G	91	Very high	92	Very high	2 Å²	2	16.4 Å²	16.4	2%	0.021	9%	0.09	C	C	.	.	S	Bend	trans	-92.3	-139.5	175.3	0	0	0	0	0	112.3	G60 I113 G115 S117	G60-G90 WeakPolarHBondContact O-CA 3.49Å; G60-G90 PolarHBondContact O-N 3.09Å; G90-I113 WeakPolarHBondContact O-CG2 3.43Å; G90-G115 PolarHBondContact O-N 2.89Å; G90-S117 CarbonylContact C-O 3.46Å
91	S	93.5	Very high	92.5	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.007	10%	0.104	C	C	.	.			trans	-101.3	161.2	174.2	61.5	0	0	0	0	112.4	D61 V62 S117 A123	D61-S91 CarbonylContact C-O 3.52Å; D61-S91 WeakPolarHBondContact CA-O 3.5Å; D61-S91 VanDerWaalsContact CG-OG 3.27Å; D61-S91 PolarHBondContact OD1-N 3.28Å; D61-S91 PolarHBondContact OD1-OG 3.26Å; V62-S91 PolarHBondContact N-O 3.37Å; S91-S117 WeakPolarHBondContact CB-O 3.35Å; S91-S117 PolarHBondContact N-O 2.03Å; S91-A123 CarbonylContact C-O 3.44Å; S91-A123 VanDerWaalsContact CA-O 3.26Å; S91-A123 WeakPolarHBondContact CA-O 3.35Å; S91-A123 WeakPolarHBondContact CB-O 3.25Å
92	L	96.5	Very high	92.7	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	112.8	171.1	172	56.7	0	0	0	109.7	V62 I88 V94 F107 L110 I113 A123 L124 V125 L137	V62-L92 HydrophobicContact CB-CD1 3.88Å; V62-L92 HydrophobicContact CG1-CD1 3.5Å; V62-L92 WeakPolarHBondContact O-CA 3.31Å; I88-L92 HydrophobicContact CD1-CB 4.46Å; I88-L92 HydrophobicContact CD1-CD2 4.41Å; L92-V94 HydrophobicContact CD1-CG2 4.08Å; L92-V94 HydrophobicContact CG-CG2 4.38Å; L92-F107 HydrophobicContact CD1-CE2 4.21Å; L92-L110 HydrophobicContact CD2-CD2 4.23Å; L92-I113 HydrophobicContact CB-CD1 4.23Å; L92-I113 HydrophobicContact CD2-CD1 4.28Å; L92-A123 PolarHBondContact N-O 3.45Å; L92-L124 HydrophobicContact CB-CD1 4.07Å; L92-L124 HydrophobicContact CD2-CD1 3.81Å; L92-L124 HydrophobicContact CG-CD1 3.87Å; L92-V125 PolarHBondContact O-N 3.37Å; L92-L137 HydrophobicContact CD2-CD1 4.34Å
93	L	95.3	Very high	92.9	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	125.6	179.1	171.9	61.9	0	0	0	110.9	V62 R63 L64 I65 F95 V119 V125 I792 I795	V62-L93 PolarHBondContact O-N 2.8Å; R63-L93 WeakPolarHBondContact CA-O 3.43Å; R63-L93 HydrophobicContact CG-CB 4.39Å; L64-L93 PolarHBondContact N-O 3.21Å; I65-L93 HydrophobicContact CG2-CD2 4.16Å; I65-L93 HydrophobicContact CG2-CG 4.04Å; L93-F95 HydrophobicContact CD1-CB 4.31Å; L93-V119 HydrophobicContact CB-CG2 4.47Å; L93-V125 HydrophobicContact CD1-CB 3.75Å; L93-V125 HydrophobicContact CD1-CG1 3.51Å; L93-I792 HydrophobicContact CD1-CD1 3.98Å; L93-I795 HydrophobicContact CD2-CG2 3.89Å
94	V	94.9	Very high	92.9	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	111.9	176.9	-167.5	0	0	0	0	108.9	L64 L92 V97 L100 L103 V125 L126 F127 N129	L64-V94 HydrophobicContact CB-CG1 4.26Å; L64-V94 HydrophobicContact CB-CG2 4.46Å; L64-V94 HydrophobicContact CD1-CG2 4.47Å; L64-V94 WeakPolarHBondContact O-CA 3.14Å; L92-V94 HydrophobicContact CD1-CG2 4.08Å; L92-V94 HydrophobicContact CG-CG2 4.38Å; V94-V97 HydrophobicContact CG1-CB 4.32Å; V94-V97 HydrophobicContact CG1-CG2 3.77Å; V94-L100 HydrophobicContact CG1-CD2 4.26Å; V94-L103 HydrophobicContact CG1-CD2 4.46Å; V94-L103 HydrophobicContact CG2-CD1 4.08Å; V94-L103 HydrophobicContact CG2-CD2 3.94Å; V94-V125 PolarHBondContact N-O 3.19Å; V94-L126 HydrophobicContact CB-CD2 3.71Å; V94-L126 HydrophobicContact CG2-CD2 3.59Å; V94-F127 PolarHBondContact O-N 3.01Å; V94-N129 PolarHBondContact O-ND2 2.9Å
95	F	92.9	Very high	92.9	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	124	-171	172.7	-109	0	0	0	114	L64 I65 L66 L93 V97 F127 Q128 I792 V796	L64-F95 PolarHBondContact O-N 2.78Å; I65-F95 CarbonylContact C-O 3.02Å; I65-F95 VanDerWaalsContact CA-O 3.25Å; I65-F95 WeakPolarHBondContact CA-O 3.27Å; I65-F95 HydrophobicContact CB-CB 4.45Å; I65-F95 HydrophobicContact CG2-CB 3.87Å; L66-F95 HydrophobicContact CD2-CD1 4.32Å; L66-F95 HydrophobicContact CD2-CE1 3.98Å; L66-F95 PolarHBondContact N-O 2.66Å; L93-F95 HydrophobicContact CD1-CB 4.31Å; F95-V97 PolarHBondContact O-N 2.84Å; F95-F127 VanDerWaalsContact CA-O 3.31Å; F95-F127 WeakPolarHBondContact CA-O 3.39Å; F95-F127 HydrophobicContact CD2-CB 4.1Å; F95-F127 AromaticContact CD2-CD1 3.3Å; F95-F127 HydrophobicContact CD2-CD1 3.3Å; F95-F127 AromaticContact CD2-CE1 3.93Å; F95-F127 HydrophobicContact CD2-CE1 3.93Å; F95-F127 AromaticContact CD2-CG 3.94Å; F95-F127 HydrophobicContact CD2-CG 3.94Å; F95-F127 WeakPolarHBondContact CD2-O 3.42Å; F95-F127 AromaticContact CE2-CD1 3.34Å; F95-F127 HydrophobicContact CE2-CD1 3.34Å; F95-F127 AromaticContact CE2-CE1 3.43Å; F95-F127 HydrophobicContact CE2-CE1 3.43Å; F95-F127 VanDerWaalsContact CE2-CE1 3.43Å; F95-F127 HydrophobicContact CE2-CG 4.23Å; F95-F127 HydrophobicContact CE2-CZ 4.38Å; F95-F127 HydrophobicContact CG-CD1 4.5Å; F95-F127 HydrophobicContact CZ-CE1 4.42Å; F95-Q128 HydrophobicContact CD2-CB 4.49Å; F95-Q128 HydrophobicContact CE2-CB 4.36Å; F95-I792 HydrophobicContact CB-CG2 4.43Å; F95-I792 HydrophobicContact CD1-CG2 4.06Å; F95-I792 HydrophobicContact CD2-CG2 3.89Å; F95-I792 HydrophobicContact CE1-CG2 4.24Å; F95-I792 HydrophobicContact CE2-CG2 4.08Å; F95-I792 HydrophobicContact CG-CG2 3.86Å; F95-I792 HydrophobicContact CZ-CG2 4.23Å; F95-V796 HydrophobicContact CD1-CB 4.41Å; F95-V796 HydrophobicContact CD1-CG1 4.11Å; F95-V796 HydrophobicContact CD1-CG2 3.62Å; F95-V796 HydrophobicContact CE1-CB 4.44Å; F95-V796 HydrophobicContact CE1-CG1 4.04Å; F95-V796 HydrophobicContact CE1-CG2 4.06Å; F95-V796 HydrophobicContact CG-CG2 4.42Å
96	Q	89.7	Confident	92.8	Very high	29 Å²	29	15.4 Å²	15.4	14%	0.136	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	52.6	51.2	-179.2	-67.3	-177	-0.6	0	0	112.7	M67 T68 F127 Q128 N129	M67-Q96 CarbonylContact C-O 3.59Å; M67-Q96 PolarHBondContact N-O 3.14Å; T68-Q96 HydrophobicContact CG2-CB 3.9Å; Q96-F127 PolarHBondContact N-O 3.25Å; Q96-Q128 VanDerWaalsContact CA-O 3.28Å; Q96-Q128 WeakPolarHBondContact CA-O 3Å; Q96-Q128 HydrophobicContact CG-CB 4.03Å; Q96-Q128 PolarHBondContact N-O 3.44Å; Q96-N129 PolarHBondContact N-OD1 3.1Å
97	V	90.5	Very high	92.8	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	112.1	174.7	-175	0	0	0	0	110.1	L64 M67 F77 V94 F95 L100 N129	L64-V97 HydrophobicContact CB-CG2 4.29Å; L64-V97 WeakPolarHBondContact O-CG2 3.33Å; M67-V97 HydrophobicContact CB-CG1 4.21Å; M67-V97 HydrophobicContact SD-CG1 4.4Å; F77-V97 HydrophobicContact CE1-CG1 3.38Å; F77-V97 HydrophobicContact CE2-CG1 4.49Å; F77-V97 HydrophobicContact CZ-CG1 3.38Å; V94-V97 HydrophobicContact CG1-CB 4.32Å; V94-V97 HydrophobicContact CG1-CG2 3.77Å; F95-V97 PolarHBondContact O-N 2.84Å; V97-L100 HydrophobicContact CG1-CB 3.63Å; V97-L100 HydrophobicContact CG1-CD2 3.95Å; V97-L100 HydrophobicContact CG1-CG 4.45Å; V97-N129 WeakPolarHBondContact CB-OD1 3.22Å; V97-N129 PolarHBondContact N-OD1 2.81Å
98	V	90.8	Very high	92.8	Very high	29 Å²	29	13.1 Å²	13.1	18%	0.176	8%	0.079	C	C	.	.	S	Bend	trans	-92.4	141.9	175	-177	0	0	0	0	109.4	M67 F77 L100 P130	M67-V98 VanDerWaalsContact O-CB 3.32Å; M67-V98 WeakPolarHBondContact O-CB 3.37Å; M67-V98 PolarHBondContact O-N 3.4Å; F77-V98 WeakPolarHBondContact CE2-O 3.35Å; F77-V98 WeakPolarHBondContact CZ-O 3.36Å; V98-L100 PolarHBondContact O-N 2.92Å; V98-P130 HydrophobicContact CG2-CG 4.07Å
99	G	89.4	Confident	92.7	Very high	3 Å²	3	16.4 Å²	16.4	3%	0.031	10%	0.096	C	C	.	.	S	Bend	trans	93	-29.5	176.6	0	0	0	0	0	115.4	L72 H131	L72-G99 VanDerWaalsContact O-CA 3.29Å; L72-G99 WeakPolarHBondContact O-CA 3.43Å; G99-H131 PolarHBondContact N-ND1 2.92Å; G99-H131 VanDerWaalsContact N-ND1 3.16Å
100	L	92.7	Very high	92.9	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.005	9%	0.091	C	C	.	.			trans	-69.8	124.7	175.6	178.4	66.7	0	0	0	111.1	F77 V94 V97 V98 L103 V106 H131 L132	F77-L100 HydrophobicContact CB-CD1 4.22Å; F77-L100 HydrophobicContact CD1-CB 4.23Å; F77-L100 HydrophobicContact CD1-CD1 4.13Å; F77-L100 HydrophobicContact CD2-CB 4.08Å; F77-L100 HydrophobicContact CD2-CD1 4.45Å; F77-L100 HydrophobicContact CE1-CB 4.04Å; F77-L100 HydrophobicContact CE2-CB 3.92Å; F77-L100 VanDerWaalsContact CE2-N 3.34Å; F77-L100 HydrophobicContact CG-CB 4.27Å; F77-L100 HydrophobicContact CG-CD1 4Å; F77-L100 HydrophobicContact CZ-CB 3.9Å; V94-L100 HydrophobicContact CG1-CD2 4.26Å; V97-L100 HydrophobicContact CG1-CB 3.63Å; V97-L100 HydrophobicContact CG1-CD2 3.95Å; V97-L100 HydrophobicContact CG1-CG 4.45Å; V98-L100 PolarHBondContact O-N 2.92Å; L100-L103 HydrophobicContact CD2-CD2 3.79Å; L100-L103 HydrophobicContact CD2-CG 4.34Å; L100-V106 HydrophobicContact CD1-CG2 3.83Å; L100-H131 CarbonylContact O-C 3.57Å; L100-L132 HydrophobicContact CD2-CD1 4.14Å; L100-L132 HydrophobicContact CG-CD1 4Å; L100-L132 WeakPolarHBondContact O-CA 3.38Å; L100-L132 PolarHBondContact O-N 3.16Å
101	Q	92.6	Very high	93	Very high	71 Å²	71	15.9 Å²	15.9	33%	0.332	9%	0.092	S	C	.	.			trans	-105.1	-30.4	-178.5	-62.4	-175.8	47.9	0	0	113.9	H131 R133 E134	Q101-H131 WeakPolarHBondContact CA-O 3.42Å; Q101-R133 PolarHBondContact O-N 3Å; Q101-E134 PolarHBondContact O-N 2.77Å
102	S	93.9	Very high	93	Very high	11 Å²	11	15.9 Å²	15.9	8%	0.077	9%	0.091	C	C	.	.	B	Isolated β-bridge	trans	-151	134.1	178.9	177.7	0	0	0	0	110.9	G104 T105 E134	S102-G104 PolarHBondContact O-N 2.8Å; S102-G104 PolarHBondContact OG-N 3.01Å; S102-T105 PolarHBondContact O-N 3.3Å; S102-T105 PolarHBondContact O-OG1 2.64Å; S102-E134 WeakPolarHBondContact CB-OE1 3.3Å; S102-E134 PolarHBondContact OG-OE1 2.81Å
103	L	94.2	Very high	93	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.091	C	C	.	.	G	3₁₀ helix	trans	-72.1	-19.1	176.6	-73	161.2	0	0	0	112.5	L64 V94 L100 T105 V106 F107 L126 L132 I135 L137	L64-L103 HydrophobicContact CD1-CD2 4.12Å; V94-L103 HydrophobicContact CG1-CD2 4.46Å; V94-L103 HydrophobicContact CG2-CD1 4.08Å; V94-L103 HydrophobicContact CG2-CD2 3.94Å; L100-L103 HydrophobicContact CD2-CD2 3.79Å; L100-L103 HydrophobicContact CD2-CG 4.34Å; L103-T105 PolarHBondContact O-N 3.43Å; L103-T105 VanDerWaalsContact O-N 3.17Å; L103-V106 PolarHBondContact O-N 2.79Å; L103-F107 PolarHBondContact O-N 3.2Å; L103-L126 HydrophobicContact CD1-CD1 4.25Å; L103-L126 HydrophobicContact CD1-CD2 3.52Å; L103-L132 HydrophobicContact CG-CD1 4.39Å; L103-I135 WeakPolarHBondContact CB-O 3.35Å; L103-I135 PolarHBondContact N-O 3.11Å; L103-I135 VanDerWaalsContact N-O 3.15Å; L103-L137 HydrophobicContact CB-CD2 3.95Å; L103-L137 HydrophobicContact CB-CG 4.15Å
104	G	92.1	Very high	92.9	Very high	16 Å²	16	17.3 Å²	17.3	17%	0.165	10%	0.097	C	C	.	.	G	3₁₀ helix	trans	-57.3	-24.3	170.3	0	0	0	0	0	113.5	S102 P108 I135 G136	S102-G104 PolarHBondContact O-N 2.8Å; S102-G104 PolarHBondContact OG-N 3.01Å; G104-P108 VanDerWaalsContact O-CA 3.22Å; G104-P108 WeakPolarHBondContact O-CA 3.24Å; G104-P108 VanDerWaalsContact O-CB 3.25Å; G104-P108 WeakPolarHBondContact O-CB 3.17Å; G104-P108 WeakPolarHBondContact O-CD 3.35Å; G104-I135 PolarHBondContact N-O 2.75Å; G104-G136 VanDerWaalsContact CA-O 3.25Å; G104-G136 WeakPolarHBondContact CA-O 3.27Å
105	T	91	Very high	92.5	Very high	44 Å²	44	17.3 Å²	17.3	27%	0.27	10%	0.097	S	C	.	.	G	3₁₀ helix	trans	-72.6	-28.4	174.1	64.6	0	0	0	0	113.3	Q74 A81 S102 L103	Q74-T105 PolarHBondContact NE2-OG1 2.81Å; A81-T105 WeakPolarHBondContact CB-O 3.32Å; S102-T105 PolarHBondContact O-N 3.3Å; S102-T105 PolarHBondContact O-OG1 2.64Å; L103-T105 PolarHBondContact O-N 3.43Å; L103-T105 VanDerWaalsContact O-N 3.17Å
106	V	92.1	Very high	92.1	Very high	9 Å²	9	22.9 Å²	22.9	6%	0.055	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-39.4	-176.7	-171.9	0	0	0	0	111.1	F77 M82 L100 L103 P108	F77-V106 HydrophobicContact CB-CG2 4.22Å; M82-V106 PolarHBondContact N-O 2.99Å; L100-V106 HydrophobicContact CD1-CG2 3.83Å; L103-V106 PolarHBondContact O-N 2.79Å; V106-P108 VanDerWaalsContact C-CD 3.49Å
107	F	94.6	Very high	91.6	Very high	1 Å²	1	23.8 Å²	23.8	0%	0.004	14%	0.136	C	C	.	.			trans	-131.3	56.2	-174.6	-54.5	-62.7	0	0	0	112.7	F31 V62 L64 M82 V85 L92 L103 N109 L110 L137	F31-F107 HydrophobicContact CZ-CE1 4.13Å; F31-F107 HydrophobicContact CZ-CZ 4.07Å; V62-F107 HydrophobicContact CG1-CE2 4.14Å; V62-F107 HydrophobicContact CG1-CZ 3.71Å; L64-F107 HydrophobicContact CD1-CE2 4Å; L64-F107 HydrophobicContact CD1-CZ 4.46Å; M82-F107 HydrophobicContact CB-CD1 4.17Å; M82-F107 HydrophobicContact CB-CE1 4.14Å; M82-F107 HydrophobicContact CG-CE1 4.28Å; M82-F107 HydrophobicContact SD-CE1 4.06Å; V85-F107 HydrophobicContact CB-CD1 4.43Å; V85-F107 HydrophobicContact CG1-CD1 4.38Å; L92-F107 HydrophobicContact CD1-CE2 4.21Å; L103-F107 PolarHBondContact O-N 3.2Å; F107-N109 PolarHBondContact O-N 3.18Å; F107-N109 VanDerWaalsContact O-N 3.13Å; F107-L110 HydrophobicContact CB-CB 3.99Å; F107-L110 HydrophobicContact CB-CD2 4.34Å; F107-L110 WeakPolarHBondContact O-CB 3.44Å; F107-L110 PolarHBondContact O-N 2.83Å; F107-L137 HydrophobicContact CB-CD2 4.11Å
108	P	93.1	Very high	91.1	Very high	41 Å²	41	25.5 Å²	25.5	27%	0.266	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-30.1	-170.9	21.5	-33.5	0	0	0	114.5	P83 G104 V106 N139	P83-P108 HydrophobicContact CB-CG 4.15Å; G104-P108 VanDerWaalsContact O-CA 3.22Å; G104-P108 WeakPolarHBondContact O-CA 3.24Å; G104-P108 VanDerWaalsContact O-CB 3.25Å; G104-P108 WeakPolarHBondContact O-CB 3.17Å; G104-P108 WeakPolarHBondContact O-CD 3.35Å; V106-P108 VanDerWaalsContact C-CD 3.49Å; P108-N139 PolarHBondContact O-ND2 3.04Å
109	N	93.3	Very high	90.4	Very high	68 Å²	68	24.2 Å²	24.2	36%	0.364	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	11.6	-176	-71.9	-55.4	0	0	0	114	P83 V85 R86 F107 R111	P83-N109 PolarHBondContact O-ND2 3.03Å; V85-N109 CarbonylContact O-C 3.54Å; R86-N109 WeakPolarHBondContact CA-O 3Å; F107-N109 PolarHBondContact O-N 3.18Å; F107-N109 VanDerWaalsContact O-N 3.13Å; N109-R111 PolarHBondContact O-N 3.07Å
110	L	95.9	Very high	89.6	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.005	14%	0.139	C	C	.	.			trans	-63.9	119.6	179	179.1	61.7	0	0	0	110.6	V85 I88 L92 F107 I112 I113 L137 N139 L140	V85-L110 HydrophobicContact CG1-CD1 4.44Å; V85-L110 WeakPolarHBondContact O-CA 3.02Å; V85-L110 PolarHBondContact O-N 3.2Å; V85-L110 VanDerWaalsContact O-N 3.14Å; I88-L110 HydrophobicContact CB-CD1 4.45Å; I88-L110 HydrophobicContact CD1-CD1 3.85Å; I88-L110 HydrophobicContact CD1-CD2 3.78Å; I88-L110 HydrophobicContact CG1-CD1 3.82Å; L92-L110 HydrophobicContact CD2-CD2 4.23Å; F107-L110 HydrophobicContact CB-CB 3.99Å; F107-L110 HydrophobicContact CB-CD2 4.34Å; F107-L110 WeakPolarHBondContact O-CB 3.44Å; F107-L110 PolarHBondContact O-N 2.83Å; L110-I112 WeakPolarHBondContact CD1-O 3.2Å; L110-I113 HydrophobicContact CD2-CD1 4.34Å; L110-I113 HydrophobicContact CD2-CG1 4.24Å; L110-L137 HydrophobicContact CD2-CD1 4.28Å; L110-L137 HydrophobicContact CD2-CD2 4.22Å; L110-N139 CarbonylContact O-C 3.59Å; L110-L140 HydrophobicContact CG-CD1 4.47Å; L110-L140 WeakPolarHBondContact O-CA 3.5Å; L110-L140 PolarHBondContact O-N 3.28Å; L110-L140 VanDerWaalsContact O-N 3.12Å
111	R	94.2	Very high	88.6	Confident	8 Å²	8	25.8 Å²	25.8	3%	0.03	14%	0.144	C	C	.	.			trans	-111.8	-31.7	-176.1	-76.9	168.9	174.3	-78.3	-7.8	113.5	R86 N109 N139 T141 E142 T236 G250 Y261	R86-R111 PolarHBondContact O-N 3.2Å; N109-R111 PolarHBondContact O-N 3.07Å; R111-N139 WeakPolarHBondContact CA-O 3.41Å; R111-N139 HydrophobicContact CG-CB 3.98Å; R111-N139 WeakPolarHBondContact CG-O 3.41Å; R111-N139 PolarHBondContact NH2-OD1 3.06Å; R111-T141 PolarHBondContact O-N 3.49Å; R111-T141 PolarHBondContact O-OG1 2.86Å; R111-E142 PolarHBondContact O-N 3.02Å; R111-T236 PolarHBondContact NH1-OG1 3.31Å; R111-T236 PolarHBondContact NH2-OG1 2.79Å; R111-G250 WeakPolarHBondContact CD-O 3.41Å; R111-G250 PolarHBondContact NH1-O 2.71Å; R111-Y261 VanDerWaalsContact CZ-CD2 3.46Å
112	I	94.2	Very high	88.2	Confident	1 Å²	1	22.6 Å²	22.6	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	133.9	-175.6	-47.8	-178.7	0	0	0	112	R86 E87 I88 L110 R114 E142 A249 A262	R86-I112 PolarHBondContact O-N 3.34Å; R86-I112 VanDerWaalsContact O-N 3.13Å; E87-I112 WeakPolarHBondContact CA-O 3.41Å; I88-I112 PolarHBondContact N-O 3.13Å; L110-I112 WeakPolarHBondContact CD1-O 3.2Å; I112-R114 HydrophobicContact CG2-CG 4.16Å; I112-E142 WeakPolarHBondContact CA-O 3.45Å; I112-E142 HydrophobicContact CG1-CB 4.29Å; I112-E142 HydrophobicContact CG2-CB 4.19Å; I112-E142 HydrophobicContact CG2-CG 4.4Å; I112-A249 HydrophobicContact CD1-CB 3.67Å; I112-A262 HydrophobicContact CD1-CB 3.66Å
113	I	96	Very high	88.1	Confident	0 Å²	0	22 Å²	22	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	112.7	161.3	-57.6	172.8	0	0	0	107.5	I88 G90 L92 L110 A123 L124 L140 E142 I143 S144	I88-I113 WeakPolarHBondContact O-CA 3.43Å; G90-I113 WeakPolarHBondContact O-CG2 3.43Å; L92-I113 HydrophobicContact CB-CD1 4.23Å; L92-I113 HydrophobicContact CD2-CD1 4.28Å; L110-I113 HydrophobicContact CD2-CD1 4.34Å; L110-I113 HydrophobicContact CD2-CG1 4.24Å; I113-A123 HydrophobicContact CG2-CB 4.08Å; I113-L124 HydrophobicContact CD1-CB 4.47Å; I113-L124 HydrophobicContact CD1-CD1 4.43Å; I113-L140 HydrophobicContact CD1-CD1 4.3Å; I113-L140 HydrophobicContact CD1-CD2 4.41Å; I113-L140 HydrophobicContact CG1-CD1 4.08Å; I113-E142 PolarHBondContact N-O 3.17Å; I113-I143 CarbonylContact O-C 3.5Å; I113-I143 VanDerWaalsContact O-CA 3.3Å; I113-I143 WeakPolarHBondContact O-CA 3.08Å; I113-S144 PolarHBondContact O-N 2.93Å
114	R	92	Very high	88.2	Confident	31 Å²	31	22 Å²	22	12%	0.117	13%	0.125	C	C	.	.			trans	-77.5	-27.5	-171.9	-59.1	-72.8	-167.7	162.5	11.1	114	E87 I88 I112 N116 S144 K145 C263	E87-R114 HydrophobicContact CG-CG 4.47Å; E87-R114 IonicContact OE1-CZ 3.93Å; E87-R114 IonicContact OE1-NE 3.4Å; E87-R114 PolarHBondContact OE1-NE 3.47Å; E87-R114 IonicContact OE1-NH2 3.33Å; E87-R114 PolarHBondContact OE1-NH2 2.89Å; I88-R114 PolarHBondContact O-N 2.86Å; I112-R114 HydrophobicContact CG2-CG 4.16Å; R114-N116 PolarHBondContact O-N 3.21Å; R114-S144 WeakPolarHBondContact CD-OG 3.28Å; R114-K145 WeakPolarHBondContact O-CB 3.27Å; R114-K145 PolarHBondContact O-N 2.03Å; R114-C263 PolarHBondContact NH2-O 3.06Å
115	G	87.8	Confident	88.3	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.117	C	C	.	.			trans	68.7	27.4	-179.8	0	0	0	0	0	114.9	G90 S117	G90-G115 PolarHBondContact O-N 2.89Å; G115-S117 CarbonylContact C-O 3.58Å; G115-S117 PolarHBondContact O-N 2.85Å
116	N	83.8	Confident	88.5	Confident	117 Å²	117	19.2 Å²	19.2	63%	0.626	11%	0.105	S	C	*	.	S	Bend	trans	-64.4	-23.6	175.1	-63.3	-17.3	0	0	0	112.1	T89 R114	T89-N116 WeakPolarHBondContact O-CB 3.46Å; T89-N116 PolarHBondContact O-N 2.92Å; R114-N116 PolarHBondContact O-N 3.21Å
117	S	80.4	Confident	88.5	Confident	47 Å²	47	18.8 Å²	18.8	33%	0.329	10%	0.102	S	C	.	.	S	Bend	trans	-122.6	144.6	166.1	172.2	0	0	0	0	107.3	D61 G90 S91 G115	D61-S117 WeakPolarHBondContact OD1-CB 3.37Å; D61-S117 PolarHBondContact OD1-OG 3.15Å; D61-S117 PolarHBondContact OD2-OG 3.07Å; G90-S117 CarbonylContact C-O 3.46Å; S91-S117 WeakPolarHBondContact CB-O 3.35Å; S91-S117 PolarHBondContact N-O 2.03Å; G115-S117 CarbonylContact C-O 3.58Å; G115-S117 PolarHBondContact O-N 2.85Å
118	L	79.7	Confident	88.4	Confident	36 Å²	36	21.7 Å²	21.7	19%	0.188	12%	0.116	C	C	.	.			trans	-133.5	145.2	-175.9	-62.2	179.7	0	0	0	110.9	Y120 A123 K145	L118-Y120 PolarHBondContact O-N 3Å; L118-A123 HydrophobicContact CD2-CB 3.7Å; L118-K145 HydrophobicContact CD1-CG 4.34Å
119	V	75.9	Confident	88.4	Confident	3 Å²	3	19.8 Å²	19.8	2%	0.018	10%	0.103	C	C	.	.	B	Isolated β-bridge	trans	-89	101.8	168.1	176.6	0	0	0	0	107.6	L93 N121 Y122 V125 F788 I792 I795	L93-V119 HydrophobicContact CB-CG2 4.47Å; V119-N121 PolarHBondContact O-N 3.34Å; V119-N121 VanDerWaalsContact O-N 3.13Å; V119-Y122 PolarHBondContact N-O 3.35Å; V119-Y122 WeakPolarHBondContact O-CD2 3.27Å; V119-Y122 PolarHBondContact O-N 3.11Å; V119-V125 HydrophobicContact CB-CG2 3.91Å; V119-V125 HydrophobicContact CG1-CG2 3.98Å; V119-F788 HydrophobicContact CG1-CE2 4.47Å; V119-I792 HydrophobicContact CG1-CD1 3.49Å; V119-I792 VanDerWaalsContact CG1-CD1 3.49Å; V119-I795 HydrophobicContact CG1-CD1 3.84Å; V119-I795 HydrophobicContact CG2-CD1 4.27Å
120	Y	71.5	Confident	88.2	Confident	14 Å²	14	19 Å²	19	6%	0.055	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	55	-112	-165.7	-166	-121.1	0	0	0	110.2	L118 Y122 R355 S358 S379 I791	L118-Y120 PolarHBondContact O-N 3Å; Y120-Y122 HydrophobicContact CD1-CE2 4.01Å; Y120-R355 HydrophobicContact CE2-CB 4.36Å; Y120-R355 PolarHBondContact OH-O 3.33Å; Y120-S358 WeakPolarHBondContact O-CB 3.41Å; Y120-S358 PolarHBondContact O-OG 2.67Å; Y120-S379 PolarHBondContact OH-OG 3.08Å; Y120-I791 HydrophobicContact CD2-CD1 3.44Å; Y120-I791 VanDerWaalsContact CD2-CD1 3.44Å; Y120-I791 HydrophobicContact CE2-CD1 3.93Å; Y120-I791 HydrophobicContact CG-CD1 3.96Å
121	N	72.7	Confident	88.1	Confident	23 Å²	23	23.1 Å²	23.1	12%	0.123	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	2.4	176.1	-67.6	-22.5	0	0	0	113.9	V119 G147 S356 S358	V119-N121 PolarHBondContact O-N 3.34Å; V119-N121 VanDerWaalsContact O-N 3.13Å; N121-G147 PolarHBondContact O-N 3.48Å; N121-S356 WeakPolarHBondContact OD1-CB 3.5Å; N121-S356 PolarHBondContact OD1-OG 3.15Å; N121-S358 PolarHBondContact OD1-OG 3.32Å
122	Y	83.3	Confident	88.1	Confident	3 Å²	3	22.8 Å²	22.8	1%	0.012	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	135.9	-163	-49.6	-74.8	0	0	0	113.3	V119 Y120 V125 G147 R149 H174 V176 F788	V119-Y122 PolarHBondContact N-O 3.35Å; V119-Y122 WeakPolarHBondContact O-CD2 3.27Å; V119-Y122 PolarHBondContact O-N 3.11Å; Y120-Y122 HydrophobicContact CD1-CE2 4.01Å; Y122-V125 HydrophobicContact CG-CG2 4.47Å; Y122-G147 CarbonylContact C-O 3.54Å; Y122-G147 WeakPolarHBondContact CA-O 3.26Å; Y122-R149 HydrophobicContact CD1-CB 3.82Å; Y122-R149 HydrophobicContact CD2-CB 3.97Å; Y122-R149 HydrophobicContact CE1-CB 3.98Å; Y122-R149 HydrophobicContact CE2-CB 4.13Å; Y122-R149 VanDerWaalsContact CE2-CD 3.41Å; Y122-R149 HydrophobicContact CE2-CG 4.43Å; Y122-R149 HydrophobicContact CG-CB 3.81Å; Y122-R149 PolarHBondContact OH-NH1 3.39Å; Y122-H174 HydrophobicContact CE1-CB 3.89Å; Y122-H174 WeakPolarHBondContact CE1-O 3.48Å; Y122-V176 HydrophobicContact CE1-CG2 4.2Å; Y122-F788 HydrophobicContact CD2-CD2 4.41Å; Y122-F788 AromaticContact CD2-CE2 3.81Å; Y122-F788 HydrophobicContact CD2-CE2 3.81Å; Y122-F788 HydrophobicContact CE2-CD2 4.12Å; Y122-F788 AromaticContact CE2-CE2 3.93Å; Y122-F788 HydrophobicContact CE2-CE2 3.93Å
123	A	91.9	Very high	88	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	-25.1	173.5	0	0	0	0	0	112.6	S91 L92 I113 L118 I143 K145 G147	S91-A123 CarbonylContact C-O 3.44Å; S91-A123 VanDerWaalsContact CA-O 3.26Å; S91-A123 WeakPolarHBondContact CA-O 3.35Å; S91-A123 WeakPolarHBondContact CB-O 3.25Å; L92-A123 PolarHBondContact N-O 3.45Å; I113-A123 HydrophobicContact CG2-CB 4.08Å; L118-A123 HydrophobicContact CD2-CB 3.7Å; A123-I143 HydrophobicContact CB-CG2 3.84Å; A123-K145 VanDerWaalsContact CB-O 3.27Å; A123-K145 WeakPolarHBondContact CB-O 3.5Å; A123-G147 PolarHBondContact N-O 3.36Å
124	L	95.9	Very high	87.9	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	123.4	173.1	176.9	61.3	0	0	0	109.9	L92 I113 L126 G147 V148 R149 W164	L92-L124 HydrophobicContact CB-CD1 4.07Å; L92-L124 HydrophobicContact CD2-CD1 3.81Å; L92-L124 HydrophobicContact CG-CD1 3.87Å; I113-L124 HydrophobicContact CD1-CB 4.47Å; I113-L124 HydrophobicContact CD1-CD1 4.43Å; L124-L126 HydrophobicContact CD1-CD2 4.03Å; L124-L126 HydrophobicContact CD1-CG 4.3Å; L124-G147 PolarHBondContact N-O 3.49Å; L124-V148 HydrophobicContact CB-CG1 4.27Å; L124-V148 HydrophobicContact CB-CG2 4.25Å; L124-V148 HydrophobicContact CD2-CG1 4.03Å; L124-V148 HydrophobicContact CG-CG1 4.24Å; L124-V148 WeakPolarHBondContact O-CA 3.35Å; L124-R149 PolarHBondContact O-N 3.33Å; L124-W164 HydrophobicContact CD2-CH2 4.29Å; L124-W164 HydrophobicContact CD2-CZ3 3.92Å
125	V	94.8	Very high	88	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	118.2	178	176.8	0	0	0	0	110.9	L92 L93 V94 V119 Y122 F127 R149 F788 I792	L92-V125 PolarHBondContact O-N 3.37Å; L93-V125 HydrophobicContact CD1-CB 3.75Å; L93-V125 HydrophobicContact CD1-CG1 3.51Å; V94-V125 PolarHBondContact N-O 3.19Å; V119-V125 HydrophobicContact CB-CG2 3.91Å; V119-V125 HydrophobicContact CG1-CG2 3.98Å; Y122-V125 HydrophobicContact CG-CG2 4.47Å; V125-F127 HydrophobicContact CG1-CB 4.31Å; V125-R149 WeakPolarHBondContact CA-O 3.22Å; V125-F788 HydrophobicContact CG1-CZ 3.76Å; V125-F788 HydrophobicContact CG2-CZ 4.33Å; V125-I792 HydrophobicContact CG1-CD1 4.15Å
126	L	95.7	Very high	88.1	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	103.1	175	-53.1	-176.5	0	0	0	109	V94 L103 L124 L132 I135 R149 I150 F151 N153	V94-L126 HydrophobicContact CB-CD2 3.71Å; V94-L126 HydrophobicContact CG2-CD2 3.59Å; L103-L126 HydrophobicContact CD1-CD1 4.25Å; L103-L126 HydrophobicContact CD1-CD2 3.52Å; L124-L126 HydrophobicContact CD1-CD2 4.03Å; L124-L126 HydrophobicContact CD1-CG 4.3Å; L126-L132 HydrophobicContact CD1-CD2 4.29Å; L126-I135 HydrophobicContact CD1-CD1 3.89Å; L126-I135 HydrophobicContact CD1-CG1 3.87Å; L126-I135 HydrophobicContact CD1-CG2 4.26Å; L126-R149 PolarHBondContact N-O 2.97Å; L126-I150 HydrophobicContact CB-CB 4.5Å; L126-I150 HydrophobicContact CB-CG1 4.21Å; L126-I150 HydrophobicContact CB-CG2 4.22Å; L126-I150 HydrophobicContact CD1-CD1 4.41Å; L126-I150 HydrophobicContact CD1-CG1 4.11Å; L126-I150 HydrophobicContact CD1-CG2 4.41Å; L126-I150 HydrophobicContact CG-CG1 4.21Å; L126-I150 CarbonylContact O-C 3.54Å; L126-I150 WeakPolarHBondContact O-CA 3.42Å; L126-F151 PolarHBondContact O-N 2.81Å; L126-N153 PolarHBondContact O-ND2 3.25Å
127	F	92.4	Very high	88.7	Confident	1 Å²	1	24.5 Å²	24.5	0%	0.004	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	127.7	-172.2	180	-139.6	0	0	0	112.8	V94 F95 Q96 V125 N129 F151 N152 E789 I792	V94-F127 PolarHBondContact O-N 3.01Å; F95-F127 VanDerWaalsContact CA-O 3.31Å; F95-F127 WeakPolarHBondContact CA-O 3.39Å; F95-F127 HydrophobicContact CD2-CB 4.1Å; F95-F127 AromaticContact CD2-CD1 3.3Å; F95-F127 HydrophobicContact CD2-CD1 3.3Å; F95-F127 AromaticContact CD2-CE1 3.93Å; F95-F127 HydrophobicContact CD2-CE1 3.93Å; F95-F127 AromaticContact CD2-CG 3.94Å; F95-F127 HydrophobicContact CD2-CG 3.94Å; F95-F127 WeakPolarHBondContact CD2-O 3.42Å; F95-F127 AromaticContact CE2-CD1 3.34Å; F95-F127 HydrophobicContact CE2-CD1 3.34Å; F95-F127 AromaticContact CE2-CE1 3.43Å; F95-F127 HydrophobicContact CE2-CE1 3.43Å; F95-F127 VanDerWaalsContact CE2-CE1 3.43Å; F95-F127 HydrophobicContact CE2-CG 4.23Å; F95-F127 HydrophobicContact CE2-CZ 4.38Å; F95-F127 HydrophobicContact CG-CD1 4.5Å; F95-F127 HydrophobicContact CZ-CE1 4.42Å; Q96-F127 PolarHBondContact N-O 3.25Å; V125-F127 HydrophobicContact CG1-CB 4.31Å; F127-N129 PolarHBondContact N-ND2 3.35Å; F127-N129 PolarHBondContact O-N 2.75Å; F127-N129 PolarHBondContact O-ND2 3.24Å; F127-F151 WeakPolarHBondContact CA-O 3.47Å; F127-F151 HydrophobicContact CD2-CB 4Å; F127-F151 AromaticContact CD2-CD1 3.69Å; F127-F151 HydrophobicContact CD2-CD1 3.69Å; F127-F151 HydrophobicContact CD2-CG 4.25Å; F127-F151 WeakPolarHBondContact CD2-O 3.4Å; F127-F151 AromaticContact CE2-CD1 3.45Å; F127-F151 HydrophobicContact CE2-CD1 3.45Å; F127-F151 VanDerWaalsContact CE2-CD1 3.45Å; F127-F151 HydrophobicContact CE2-CE1 4.07Å; F127-F151 HydrophobicContact CE2-CG 4.39Å; F127-F151 HydrophobicContact CZ-CD1 4.48Å; F127-N152 HydrophobicContact CD2-CB 4.44Å; F127-N152 HydrophobicContact CE2-CB 4.27Å; F127-E789 HydrophobicContact CE1-CG 4.12Å; F127-E789 HydrophobicContact CZ-CG 3.68Å; F127-I792 HydrophobicContact CD1-CB 4.42Å; F127-I792 HydrophobicContact CD1-CG1 4.16Å; F127-I792 HydrophobicContact CD1-CG2 4.16Å
128	Q	91	Very high	89.2	Confident	61 Å²	61	23.9 Å²	23.9	29%	0.285	12%	0.117	S	C	.	.	S	Bend	trans	53.5	46.2	176.7	-72.7	178.5	-6.6	0	0	114.7	F95 Q96 P130 F151 N152	F95-Q128 HydrophobicContact CD2-CB 4.49Å; F95-Q128 HydrophobicContact CE2-CB 4.36Å; Q96-Q128 VanDerWaalsContact CA-O 3.28Å; Q96-Q128 WeakPolarHBondContact CA-O 3Å; Q96-Q128 HydrophobicContact CG-CB 4.03Å; Q96-Q128 PolarHBondContact N-O 3.44Å; Q128-P130 VanDerWaalsContact O-CD 3.25Å; Q128-P130 WeakPolarHBondContact O-CD 3.39Å; Q128-F151 PolarHBondContact N-O 3.41Å; Q128-F151 VanDerWaalsContact N-O 3.08Å; Q128-N152 WeakPolarHBondContact CA-O 3.13Å; Q128-N152 HydrophobicContact CG-CB 4.02Å
129	N	93.5	Very high	89.8	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.005	12%	0.116	C	C	.	.			trans	-101.1	95.1	174.1	-55.4	-69.2	0	0	0	109.5	V94 Q96 V97 F127 H131 L132 N153	V94-N129 PolarHBondContact O-ND2 2.9Å; Q96-N129 PolarHBondContact N-OD1 3.1Å; V97-N129 WeakPolarHBondContact CB-OD1 3.22Å; V97-N129 PolarHBondContact N-OD1 2.81Å; F127-N129 PolarHBondContact N-ND2 3.35Å; F127-N129 PolarHBondContact O-N 2.75Å; F127-N129 PolarHBondContact O-ND2 3.24Å; N129-H131 VanDerWaalsContact C-N 3.32Å; N129-H131 PolarHBondContact O-N 3.35Å; N129-L132 HydrophobicContact CB-CB 3.87Å; N129-L132 HydrophobicContact CB-CD2 4.33Å; N129-L132 PolarHBondContact O-N 3.16Å; N129-N153 WeakPolarHBondContact CB-OD1 3.43Å; N129-N153 PolarHBondContact N-OD1 2.04Å; N129-N153 PolarHBondContact ND2-OD1 3.36Å
130	P	90	Very high	90.7	Very high	51 Å²	51	23.7 Å²	23.7	33%	0.331	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-22.6	-162.9	28.2	-37.3	0	0	0	114.3	V98 Q128	V98-P130 HydrophobicContact CG2-CG 4.07Å; Q128-P130 VanDerWaalsContact O-CD 3.25Å; Q128-P130 WeakPolarHBondContact O-CD 3.39Å
131	H	93.1	Very high	91.6	Very high	89 Å²	89	24.7 Å²	24.7	41%	0.412	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-3.4	-178.8	-65.9	-173.7	0	0	0	113.2	G99 L100 Q101 N129 R133	G99-H131 PolarHBondContact N-ND1 2.92Å; G99-H131 VanDerWaalsContact N-ND1 3.16Å; L100-H131 CarbonylContact O-C 3.57Å; Q101-H131 WeakPolarHBondContact CA-O 3.42Å; N129-H131 VanDerWaalsContact C-N 3.32Å; N129-H131 PolarHBondContact O-N 3.35Å; H131-R133 PolarHBondContact O-N 2.71Å
132	L	94.6	Very high	92.5	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.12	C	C	.	.			trans	-72	119.1	-179	-166.1	76.3	0	0	0	108.9	L100 L103 L126 N129 E155 L156	L100-L132 HydrophobicContact CD2-CD1 4.14Å; L100-L132 HydrophobicContact CG-CD1 4Å; L100-L132 WeakPolarHBondContact O-CA 3.38Å; L100-L132 PolarHBondContact O-N 3.16Å; L103-L132 HydrophobicContact CG-CD1 4.39Å; L126-L132 HydrophobicContact CD1-CD2 4.29Å; N129-L132 HydrophobicContact CB-CB 3.87Å; N129-L132 HydrophobicContact CB-CD2 4.33Å; N129-L132 PolarHBondContact O-N 3.16Å; L132-E155 CarbonylContact O-C 3.59Å; L132-E155 VanDerWaalsContact O-C 3.23Å; L132-L156 HydrophobicContact CD2-CD1 4.03Å; L132-L156 HydrophobicContact CD2-CD2 4.31Å; L132-L156 HydrophobicContact CG-CD1 4Å; L132-L156 WeakPolarHBondContact O-CA 3.44Å; L132-L156 WeakPolarHBondContact O-CB 2.96Å; L132-L156 PolarHBondContact O-N 2.71Å; L132-L156 VanDerWaalsContact O-N 3.1Å
133	R	93	Very high	92.9	Very high	135 Å²	135	23.9 Å²	23.9	51%	0.509	12%	0.119	S	C	.	.			trans	-103.6	-30.5	-173	-74.7	172.1	168.5	176.4	-8.8	113.5	Q101 H131 E155 C157	Q101-R133 PolarHBondContact O-N 3Å; H131-R133 PolarHBondContact O-N 2.71Å; R133-E155 HydrophobicContact CG-CB 4.34Å; R133-C157 PolarHBondContact O-N 2.71Å
134	E	92.4	Very high	92.8	Very high	44 Å²	44	25.2 Å²	25.2	21%	0.206	13%	0.128	C	C	.	.	B	Isolated β-bridge	trans	-147.3	164.5	176.3	52.2	160	-114.9	0	0	108.8	Q101 S102 G136 N215	Q101-E134 PolarHBondContact O-N 2.77Å; S102-E134 WeakPolarHBondContact CB-OE1 3.3Å; S102-E134 PolarHBondContact OG-OE1 2.81Å; E134-G136 WeakPolarHBondContact OE1-CA 3.39Å; E134-N215 PolarHBondContact OE1-ND2 3.45Å; E134-N215 WeakPolarHBondContact OE2-CB 3.39Å; E134-N215 PolarHBondContact OE2-ND2 2.89Å
135	I	94.6	Very high	92.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.143	C	C	.	.			trans	-85.1	-41.7	175.2	-57.3	177.6	0	0	0	109.8	L103 G104 L126 L137 I150 L156 V159 W164 W214	L103-I135 WeakPolarHBondContact CB-O 3.35Å; L103-I135 PolarHBondContact N-O 3.11Å; L103-I135 VanDerWaalsContact N-O 3.15Å; G104-I135 PolarHBondContact N-O 2.75Å; L126-I135 HydrophobicContact CD1-CD1 3.89Å; L126-I135 HydrophobicContact CD1-CG1 3.87Å; L126-I135 HydrophobicContact CD1-CG2 4.26Å; I135-L137 HydrophobicContact CG2-CB 4.31Å; I135-L137 HydrophobicContact CG2-CD1 4.02Å; I135-L137 HydrophobicContact CG2-CG 3.98Å; I135-L137 PolarHBondContact O-N 3.4Å; I135-I150 HydrophobicContact CD1-CD1 3.7Å; I135-L156 HydrophobicContact CG1-CD1 4.13Å; I135-L156 HydrophobicContact CG1-CD2 4.5Å; I135-V159 HydrophobicContact CD1-CG1 4.37Å; I135-W164 HydrophobicContact CD1-CH2 3.57Å; I135-W164 HydrophobicContact CD1-CZ2 3.59Å; I135-W214 HydrophobicContact CB-CE3 4.43Å; I135-W214 HydrophobicContact CB-CZ3 4.44Å; I135-W214 HydrophobicContact CG2-CE3 4.49Å; I135-W214 HydrophobicContact CG2-CZ3 4.11Å
136	G	90.9	Very high	91.5	Very high	6 Å²	6	28.6 Å²	28.6	6%	0.062	14%	0.144	C	C	.	.			trans	66	6.4	170.7	0	0	0	0	0	116.5	G104 E134 S138	G104-G136 VanDerWaalsContact CA-O 3.25Å; G104-G136 WeakPolarHBondContact CA-O 3.27Å; E134-G136 WeakPolarHBondContact OE1-CA 3.39Å; G136-S138 PolarHBondContact O-N 2.84Å
137	L	94.6	Very high	90.9	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	15%	0.145	C	C	.	.			trans	-76.3	56	176.7	-64.2	178.6	0	0	0	111.3	L92 L103 F107 L110 I135 N139 L140 W214	L92-L137 HydrophobicContact CD2-CD1 4.34Å; L103-L137 HydrophobicContact CB-CD2 3.95Å; L103-L137 HydrophobicContact CB-CG 4.15Å; F107-L137 HydrophobicContact CB-CD2 4.11Å; L110-L137 HydrophobicContact CD2-CD1 4.28Å; L110-L137 HydrophobicContact CD2-CD2 4.22Å; I135-L137 HydrophobicContact CG2-CB 4.31Å; I135-L137 HydrophobicContact CG2-CD1 4.02Å; I135-L137 HydrophobicContact CG2-CG 3.98Å; I135-L137 PolarHBondContact O-N 3.4Å; L137-N139 PolarHBondContact O-N 3.21Å; L137-N139 VanDerWaalsContact O-N 3.11Å; L137-L140 HydrophobicContact CB-CB 4.13Å; L137-L140 HydrophobicContact CD1-CD2 4.43Å; L137-L140 VanDerWaalsContact O-CB 3.22Å; L137-L140 WeakPolarHBondContact O-CB 3.45Å; L137-L140 PolarHBondContact O-N 2.83Å; L137-W214 HydrophobicContact CB-CZ3 4.43Å
138	S	91.4	Very high	90.8	Very high	34 Å²	34	28.6 Å²	28.6	24%	0.238	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-23.1	-166.6	55.1	0	0	0	0	115.4	G136 W214	G136-S138 PolarHBondContact O-N 2.84Å; S138-W214 VanDerWaalsContact CA-CD1 3.5Å; S138-W214 PolarHBondContact O-NE1 3.24Å
139	N	91.9	Very high	90.7	Very high	33 Å²	33	26 Å²	26	18%	0.176	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-7.5	174.5	-78.2	-69.8	0	0	0	114.1	P108 L110 R111 L137 T141	P108-N139 PolarHBondContact O-ND2 3.04Å; L110-N139 CarbonylContact O-C 3.59Å; R111-N139 WeakPolarHBondContact CA-O 3.41Å; R111-N139 HydrophobicContact CG-CB 3.98Å; R111-N139 WeakPolarHBondContact CG-O 3.41Å; R111-N139 PolarHBondContact NH2-OD1 3.06Å; L137-N139 PolarHBondContact O-N 3.21Å; L137-N139 VanDerWaalsContact O-N 3.11Å; N139-T141 PolarHBondContact O-N 2.85Å
140	L	94.8	Very high	90.6	Very high	1 Å²	1	26 Å²	26	1%	0.005	13%	0.132	C	C	.	.			trans	-67.6	119.2	-176.7	-175	67.1	0	0	0	110	L110 I113 L137 I143 L167 W214	L110-L140 HydrophobicContact CG-CD1 4.47Å; L110-L140 WeakPolarHBondContact O-CA 3.5Å; L110-L140 PolarHBondContact O-N 3.28Å; L110-L140 VanDerWaalsContact O-N 3.12Å; I113-L140 HydrophobicContact CD1-CD1 4.3Å; I113-L140 HydrophobicContact CD1-CD2 4.41Å; I113-L140 HydrophobicContact CG1-CD1 4.08Å; L137-L140 HydrophobicContact CB-CB 4.13Å; L137-L140 HydrophobicContact CD1-CD2 4.43Å; L137-L140 VanDerWaalsContact O-CB 3.22Å; L137-L140 WeakPolarHBondContact O-CB 3.45Å; L137-L140 PolarHBondContact O-N 2.83Å; L140-I143 HydrophobicContact CD2-CD1 4.41Å; L140-I143 HydrophobicContact CD2-CG1 4.43Å; L140-L167 HydrophobicContact CD2-CD1 4.46Å; L140-L167 WeakPolarHBondContact O-CD2 3.41Å; L140-W214 HydrophobicContact CB-CH2 4.18Å; L140-W214 HydrophobicContact CB-CZ2 3.99Å; L140-W214 HydrophobicContact CD2-CH2 4.06Å
141	T	91.5	Very high	90.5	Very high	36 Å²	36	23.7 Å²	23.7	22%	0.221	12%	0.117	C	C	.	.			trans	-125.4	-13.4	-174.7	40.5	0	0	0	0	113.2	R111 N139	R111-T141 PolarHBondContact O-N 3.49Å; R111-T141 PolarHBondContact O-OG1 2.86Å; N139-T141 PolarHBondContact O-N 2.85Å
142	E	91.3	Very high	90.3	Very high	9 Å²	9	21.3 Å²	21.3	4%	0.042	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	129.8	-179.6	-169.5	-176	149.1	0	0	112.7	R111 I112 I113 S144 R169	R111-E142 PolarHBondContact O-N 3.02Å; I112-E142 WeakPolarHBondContact CA-O 3.45Å; I112-E142 HydrophobicContact CG1-CB 4.29Å; I112-E142 HydrophobicContact CG2-CB 4.19Å; I112-E142 HydrophobicContact CG2-CG 4.4Å; I113-E142 PolarHBondContact N-O 3.17Å; E142-S144 WeakPolarHBondContact OE1-CB 3.29Å; E142-S144 PolarHBondContact OE1-OG 2.94Å; E142-R169 HydrophobicContact CG-CG 4.27Å; E142-R169 WeakPolarHBondContact OE1-CD 3.35Å; E142-R169 IonicContact OE1-CZ 2.8Å; E142-R169 IonicContact OE1-NE 3.23Å; E142-R169 IonicContact OE1-NH1 3.97Å; E142-R169 PolarHBondContact OE1-NH1 3.09Å; E142-R169 IonicContact OE2-CZ 2.77Å; E142-R169 IonicContact OE2-NE 3.15Å; E142-R169 IonicContact OE2-NH1 2.82Å; E142-R169 PolarHBondContact OE2-NH1 3.35Å; E142-R169 IonicContact OE2-NH2 3.34Å
143	I	92.7	Very high	90.2	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	102.6	160.3	-59.2	178.3	0	0	0	106.5	I113 A123 L140 K145 V148 L167 C168 R169	I113-I143 CarbonylContact O-C 3.5Å; I113-I143 VanDerWaalsContact O-CA 3.3Å; I113-I143 WeakPolarHBondContact O-CA 3.08Å; A123-I143 HydrophobicContact CB-CG2 3.84Å; L140-I143 HydrophobicContact CD2-CD1 4.41Å; L140-I143 HydrophobicContact CD2-CG1 4.43Å; I143-K145 PolarHBondContact O-N 3.02Å; I143-V148 HydrophobicContact CD1-CG2 3.59Å; I143-L167 HydrophobicContact CD1-CB 4.46Å; I143-L167 HydrophobicContact CG1-CB 4.44Å; I143-L167 PolarHBondContact N-O 3.44Å; I143-C168 WeakPolarHBondContact O-CA 3.07Å; I143-R169 PolarHBondContact O-N 2.04Å
144	S	89.4	Confident	90	Very high	28 Å²	28	17.7 Å²	17.7	20%	0.196	11%	0.106	C	C	.	.			trans	-74.1	-26.3	-165.3	-46.3	0	0	0	0	114	I113 R114 E142	I113-S144 PolarHBondContact O-N 2.93Å; R114-S144 WeakPolarHBondContact CD-OG 3.28Å; E142-S144 WeakPolarHBondContact OE1-CB 3.29Å; E142-S144 PolarHBondContact OE1-OG 2.94Å
145	K	85.1	Confident	90.1	Very high	68 Å²	68	19.2 Å²	19.2	30%	0.296	11%	0.113	S	C	.	.	S	Bend	trans	-151.8	146.1	178.8	175.1	171.1	-175.6	-172.3	0	109.5	R114 L118 A123 I143	R114-K145 WeakPolarHBondContact O-CB 3.27Å; R114-K145 PolarHBondContact O-N 2.03Å; L118-K145 HydrophobicContact CD1-CG 4.34Å; A123-K145 VanDerWaalsContact CB-O 3.27Å; A123-K145 WeakPolarHBondContact CB-O 3.5Å; I143-K145 PolarHBondContact O-N 3.02Å
146	G	77.3	Confident	90.1	Very high	3 Å²	3	19.3 Å²	19.3	3%	0.031	11%	0.113	C	C	.	.	S	Bend	trans	81.7	165.2	176.3	0	0	0	0	0	114.5	E170	G146-E170 PolarHBondContact N-OE2 3.35Å
147	G	84.3	Confident	90.2	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.01	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	-166.3	-176.6	0	0	0	0	0	115.5	N121 Y122 A123 L124 H174	N121-G147 PolarHBondContact O-N 3.48Å; Y122-G147 CarbonylContact C-O 3.54Å; Y122-G147 WeakPolarHBondContact CA-O 3.26Å; A123-G147 PolarHBondContact N-O 3.36Å; L124-G147 PolarHBondContact N-O 3.49Å; G147-H174 CarbonylContact C-O 3.52Å; G147-H174 WeakPolarHBondContact CA-O 3.4Å
148	V	89.7	Confident	90	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	134	179.5	179.8	0	0	0	0	110.3	L124 I143 I150 W164 H174 V175 V176	L124-V148 HydrophobicContact CB-CG1 4.27Å; L124-V148 HydrophobicContact CB-CG2 4.25Å; L124-V148 HydrophobicContact CD2-CG1 4.03Å; L124-V148 HydrophobicContact CG-CG1 4.24Å; L124-V148 WeakPolarHBondContact O-CA 3.35Å; I143-V148 HydrophobicContact CD1-CG2 3.59Å; V148-I150 HydrophobicContact CG1-CD1 3.56Å; V148-I150 HydrophobicContact CG1-CG1 3.77Å; V148-W164 HydrophobicContact CB-CE3 4.33Å; V148-W164 HydrophobicContact CG1-CD2 4.39Å; V148-W164 HydrophobicContact CG1-CE3 3.95Å; V148-W164 HydrophobicContact CG1-CH2 4.46Å; V148-W164 HydrophobicContact CG1-CZ3 3.99Å; V148-W164 HydrophobicContact CG2-CE3 3.91Å; V148-W164 HydrophobicContact CG2-CZ3 4.33Å; V148-H174 PolarHBondContact N-O 3.32Å; V148-V175 HydrophobicContact CB-CG2 4.49Å; V148-V175 CarbonylContact O-C 3.33Å; V148-V175 WeakPolarHBondContact O-CA 3.05Å; V148-V176 PolarHBondContact O-N 3.14Å
149	R	88.8	Confident	89.9	Confident	6 Å²	6	20 Å²	20	2%	0.023	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	115.6	174	-169.6	149.4	-173.5	165	0.2	111.9	Y122 L124 V125 L126 V176 E784 F788	Y122-R149 HydrophobicContact CD1-CB 3.82Å; Y122-R149 HydrophobicContact CD2-CB 3.97Å; Y122-R149 HydrophobicContact CE1-CB 3.98Å; Y122-R149 HydrophobicContact CE2-CB 4.13Å; Y122-R149 VanDerWaalsContact CE2-CD 3.41Å; Y122-R149 HydrophobicContact CE2-CG 4.43Å; Y122-R149 HydrophobicContact CG-CB 3.81Å; Y122-R149 PolarHBondContact OH-NH1 3.39Å; L124-R149 PolarHBondContact O-N 3.33Å; V125-R149 WeakPolarHBondContact CA-O 3.22Å; L126-R149 PolarHBondContact N-O 2.97Å; R149-V176 WeakPolarHBondContact CA-O 3.48Å; R149-V176 HydrophobicContact CB-CB 4.47Å; R149-V176 HydrophobicContact CG-CB 4.02Å; R149-V176 HydrophobicContact CG-CG1 4.19Å; R149-E784 IonicContact CZ-OE1 3.25Å; R149-E784 VanDerWaalsContact CZ-OE1 3.23Å; R149-E784 IonicContact NH1-OE1 3.48Å; R149-E784 PolarHBondContact NH1-OE1 3.01Å; R149-E784 IonicContact NH2-OE1 2.74Å; R149-E784 PolarHBondContact NH2-OE1 3.28Å; R149-F788 HydrophobicContact CB-CZ 4.34Å; R149-F788 HydrophobicContact CG-CE1 4.16Å; R149-F788 HydrophobicContact CG-CZ 3.99Å
150	I	91.4	Very high	89.6	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	104.4	-173.5	-59.5	165.6	0	0	0	107.8	L126 I135 V148 L156 V159 W164 V176 V177 E178 N180	L126-I150 HydrophobicContact CB-CB 4.5Å; L126-I150 HydrophobicContact CB-CG1 4.21Å; L126-I150 HydrophobicContact CB-CG2 4.22Å; L126-I150 HydrophobicContact CD1-CD1 4.41Å; L126-I150 HydrophobicContact CD1-CG1 4.11Å; L126-I150 HydrophobicContact CD1-CG2 4.41Å; L126-I150 HydrophobicContact CG-CG1 4.21Å; L126-I150 CarbonylContact O-C 3.54Å; L126-I150 WeakPolarHBondContact O-CA 3.42Å; I135-I150 HydrophobicContact CD1-CD1 3.7Å; V148-I150 HydrophobicContact CG1-CD1 3.56Å; V148-I150 HydrophobicContact CG1-CG1 3.77Å; I150-L156 HydrophobicContact CG2-CD2 3.51Å; I150-V159 HydrophobicContact CB-CG1 4.33Å; I150-V159 HydrophobicContact CD1-CG1 3.74Å; I150-V159 HydrophobicContact CG2-CG1 4Å; I150-V159 HydrophobicContact CG2-CG2 4.37Å; I150-W164 HydrophobicContact CD1-CH2 3.65Å; I150-W164 HydrophobicContact CD1-CZ2 3.46Å; I150-W164 VanDerWaalsContact CD1-CZ2 3.46Å; I150-W164 HydrophobicContact CD1-CZ3 4.38Å; I150-V176 PolarHBondContact N-O 3.36Å; I150-V177 HydrophobicContact CB-CG2 4.44Å; I150-V177 WeakPolarHBondContact O-CA 3.47Å; I150-E178 PolarHBondContact O-N 2.83Å; I150-N180 PolarHBondContact O-ND2 2.79Å
151	F	88	Confident	89.3	Confident	4 Å²	4	23 Å²	23	2%	0.018	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	138.3	-164.1	-168.4	-131.7	0	0	0	114.6	L126 F127 Q128 N153 E178 R785	L126-F151 PolarHBondContact O-N 2.81Å; F127-F151 WeakPolarHBondContact CA-O 3.47Å; F127-F151 HydrophobicContact CD2-CB 4Å; F127-F151 AromaticContact CD2-CD1 3.69Å; F127-F151 HydrophobicContact CD2-CD1 3.69Å; F127-F151 HydrophobicContact CD2-CG 4.25Å; F127-F151 WeakPolarHBondContact CD2-O 3.4Å; F127-F151 AromaticContact CE2-CD1 3.45Å; F127-F151 HydrophobicContact CE2-CD1 3.45Å; F127-F151 VanDerWaalsContact CE2-CD1 3.45Å; F127-F151 HydrophobicContact CE2-CE1 4.07Å; F127-F151 HydrophobicContact CE2-CG 4.39Å; F127-F151 HydrophobicContact CZ-CD1 4.48Å; Q128-F151 PolarHBondContact N-O 3.41Å; Q128-F151 VanDerWaalsContact N-O 3.08Å; F151-N153 PolarHBondContact N-ND2 3.34Å; F151-N153 PolarHBondContact O-N 3.48Å; F151-N153 PolarHBondContact O-ND2 3.45Å; F151-N153 VanDerWaalsContact O-ND2 3.12Å; F151-E178 WeakPolarHBondContact CA-O 3.3Å; F151-E178 HydrophobicContact CD2-CB 3.56Å; F151-E178 VanDerWaalsContact CD2-O 3.24Å; F151-E178 WeakPolarHBondContact CD2-O 3.43Å; F151-E178 HydrophobicContact CE2-CB 3.58Å; F151-R785 HydrophobicContact CE1-CG 4Å; F151-R785 HydrophobicContact CZ-CG 4.25Å; F151-R785 VanDerWaalsContact CZ-CZ 3.46Å
152	N	89.2	Confident	89.2	Confident	39 Å²	39	21.5 Å²	21.5	21%	0.209	12%	0.12	C	C	.	.			trans	53.8	32.6	174.8	-67.3	-22.9	0	0	0	114.9	F127 Q128 A154 E178 G179 R785	F127-N152 HydrophobicContact CD2-CB 4.44Å; F127-N152 HydrophobicContact CE2-CB 4.27Å; Q128-N152 WeakPolarHBondContact CA-O 3.13Å; Q128-N152 HydrophobicContact CG-CB 4.02Å; N152-A154 PolarHBondContact O-N 3.46Å; N152-E178 PolarHBondContact N-O 3.46Å; N152-G179 WeakPolarHBondContact CA-O 3.24Å; N152-R785 PolarHBondContact ND2-NH2 3.3Å
153	N	92.2	Very high	89.1	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.124	C	C	.	.			trans	-92.9	92.5	174.2	-51	-80.8	0	0	0	108.5	L126 N129 F151 E155 L156 N180	L126-N153 PolarHBondContact O-ND2 3.25Å; N129-N153 WeakPolarHBondContact CB-OD1 3.43Å; N129-N153 PolarHBondContact N-OD1 2.04Å; N129-N153 PolarHBondContact ND2-OD1 3.36Å; F151-N153 PolarHBondContact N-ND2 3.34Å; F151-N153 PolarHBondContact O-N 3.48Å; F151-N153 PolarHBondContact O-ND2 3.45Å; F151-N153 VanDerWaalsContact O-ND2 3.12Å; N153-E155 VanDerWaalsContact C-N 3.31Å; N153-E155 PolarHBondContact O-N 2.84Å; N153-L156 HydrophobicContact CB-CB 3.56Å; N153-L156 HydrophobicContact CB-CD2 3.66Å; N153-L156 HydrophobicContact CB-CG 4.25Å; N153-L156 VanDerWaalsContact O-CB 3.27Å; N153-L156 WeakPolarHBondContact O-CB 3.03Å; N153-L156 PolarHBondContact O-N 2.93Å; N153-N180 WeakPolarHBondContact CB-OD1 3.35Å; N153-N180 PolarHBondContact N-OD1 3.1Å; N153-N180 VanDerWaalsContact N-OD1 3.07Å; N153-N180 PolarHBondContact ND2-OD1 3Å; N153-N180 WeakPolarHBondContact O-CA 3.4Å
154	A	89.1	Confident	88.9	Confident	59 Å²	59	23 Å²	23	49%	0.488	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-30.8	-162.2	0	0	0	0	0	115.7	N152	N152-A154 PolarHBondContact O-N 3.46Å
155	E	93	Very high	88.7	Confident	76 Å²	76	26.9 Å²	26.9	36%	0.355	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	0.9	179	-78.3	-64.5	121.7	0	0	114.2	L132 R133 N153 C157 K181	L132-E155 CarbonylContact O-C 3.59Å; L132-E155 VanDerWaalsContact O-C 3.23Å; R133-E155 HydrophobicContact CG-CB 4.34Å; N153-E155 VanDerWaalsContact C-N 3.31Å; N153-E155 PolarHBondContact O-N 2.84Å; E155-C157 PolarHBondContact O-N 3.18Å; E155-K181 IonicContact OE1-NZ 3.19Å; E155-K181 PolarHBondContact OE1-NZ 3.34Å; E155-K181 IonicContact OE2-NZ 3.48Å; E155-K181 PolarHBondContact OE2-NZ 3.49Å
156	L	94.5	Very high	88.8	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.005	16%	0.164	C	C	.	.			trans	-81.4	113.1	-167	-175.3	63.2	0	0	0	112.8	L132 I135 I150 N153 V159 N180 K181	L132-L156 HydrophobicContact CD2-CD1 4.03Å; L132-L156 HydrophobicContact CD2-CD2 4.31Å; L132-L156 HydrophobicContact CG-CD1 4Å; L132-L156 WeakPolarHBondContact O-CA 3.44Å; L132-L156 WeakPolarHBondContact O-CB 2.96Å; L132-L156 PolarHBondContact O-N 2.71Å; L132-L156 VanDerWaalsContact O-N 3.1Å; I135-L156 HydrophobicContact CG1-CD1 4.13Å; I135-L156 HydrophobicContact CG1-CD2 4.5Å; I150-L156 HydrophobicContact CG2-CD2 3.51Å; N153-L156 HydrophobicContact CB-CB 3.56Å; N153-L156 HydrophobicContact CB-CD2 3.66Å; N153-L156 HydrophobicContact CB-CG 4.25Å; N153-L156 VanDerWaalsContact O-CB 3.27Å; N153-L156 WeakPolarHBondContact O-CB 3.03Å; N153-L156 PolarHBondContact O-N 2.93Å; L156-V159 HydrophobicContact CD1-CG2 4.41Å; L156-V159 HydrophobicContact CD2-CG2 3.6Å; L156-V159 HydrophobicContact CG-CG2 3.53Å; L156-N180 HydrophobicContact CB-CB 4.46Å; L156-K181 WeakPolarHBondContact O-CB 3.49Å; L156-K181 PolarHBondContact O-N 3.32Å
157	C	93.3	Very high	89.3	Confident	18 Å²	18	30.6 Å²	30.6	12%	0.122	17%	0.165	C	C	.	.			trans	-102.6	179.7	168	-59.5	0	0	0	0	110.9	R133 E155 V159 C186	R133-C157 PolarHBondContact O-N 2.71Å; E155-C157 PolarHBondContact O-N 3.18Å; C157-V159 VanDerWaalsContact C-N 3.27Å; C157-V159 PolarHBondContact O-N 3.33Å; C157-C186 VanDerWaalsContact CA-SG 3.56Å; C157-C186 HydrophobicContact CB-CB 3.69Å; C157-C186 WeakPolarHBondContact CB-SG 3.25Å; C157-C186 WeakPolarHBondContact SG-CB 3.21Å; C157-C186 CovalentContact SG-SG 2.04Å; C157-C186 PolarHBondContact SG-SG 2.84Å
158	Y	90.5	Very high	89.5	Confident	32 Å²	32	31.4 Å²	31.4	13%	0.125	17%	0.17	C	C	.	.	S	Bend	trans	60.3	29.2	178	-61.4	-81.4	0	0	0	114.6	T161 S187 E188 W214 N215	Y158-T161 VanDerWaalsContact C-OG1 3.3Å; Y158-T161 WeakPolarHBondContact CA-OG1 3.2Å; Y158-T161 HydrophobicContact CD1-CG2 4.11Å; Y158-T161 PolarHBondContact O-OG1 3.11Å; Y158-S187 PolarHBondContact OH-O 3.44Å; Y158-E188 HydrophobicContact CD1-CB 4.49Å; Y158-E188 HydrophobicContact CE1-CB 4.21Å; Y158-E188 PolarHBondContact N-OE1 3.11Å; Y158-W214 WeakPolarHBondContact CB-O 3.34Å; Y158-N215 HydrophobicContact CD2-CB 4.4Å
159	V	89.8	Confident	89.2	Confident	5 Å²	5	36.7 Å²	36.7	3%	0.03	19%	0.19	C	C	.	.	S	Bend	trans	-89.7	-39.7	174.3	-161.8	0	0	0	0	111.5	I135 I150 L156 C157 T161 W164 V177	I135-V159 HydrophobicContact CD1-CG1 4.37Å; I150-V159 HydrophobicContact CB-CG1 4.33Å; I150-V159 HydrophobicContact CD1-CG1 3.74Å; I150-V159 HydrophobicContact CG2-CG1 4Å; I150-V159 HydrophobicContact CG2-CG2 4.37Å; L156-V159 HydrophobicContact CD1-CG2 4.41Å; L156-V159 HydrophobicContact CD2-CG2 3.6Å; L156-V159 HydrophobicContact CG-CG2 3.53Å; C157-V159 VanDerWaalsContact C-N 3.27Å; C157-V159 PolarHBondContact O-N 3.33Å; V159-T161 VanDerWaalsContact C-N 3.32Å; V159-W164 HydrophobicContact CG1-CZ2 4.14Å; V159-W164 PolarHBondContact O-NE1 3.24Å; V159-V177 HydrophobicContact CB-CG1 4.09Å; V159-V177 HydrophobicContact CG1-CB 4.37Å; V159-V177 HydrophobicContact CG1-CG1 3.5Å; V159-V177 VanDerWaalsContact CG1-CG1 3.5Å; V159-V177 HydrophobicContact CG1-CG2 3.87Å
160	N	86.4	Confident	88.3	Confident	82 Å²	82	40.2 Å²	40.2	44%	0.439	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-6.4	-179.5	-65.8	-20.6	0	0	0	112.9	P183	N160-P183 VanDerWaalsContact ND2-CG 3.29Å; N160-P183 WeakPolarHBondContact ND2-CG 3.06Å
161	T	88	Confident	87	Confident	17 Å²	17	47.7 Å²	47.7	10%	0.104	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-6.3	170.6	51.8	0	0	0	0	113.1	Y158 V159 E188 A212 C213	Y158-T161 VanDerWaalsContact C-OG1 3.3Å; Y158-T161 WeakPolarHBondContact CA-OG1 3.2Å; Y158-T161 HydrophobicContact CD1-CG2 4.11Å; Y158-T161 PolarHBondContact O-OG1 3.11Å; V159-T161 VanDerWaalsContact C-N 3.32Å; T161-E188 HydrophobicContact CG2-CB 4.01Å; T161-A212 CarbonylContact O-C 3.21Å; T161-A212 WeakPolarHBondContact O-CA 3.07Å; T161-A212 WeakPolarHBondContact O-CB 2.96Å; T161-C213 CarbonylContact C-O 3.57Å; T161-C213 VanDerWaalsContact CB-O 3.29Å; T161-C213 WeakPolarHBondContact CB-O 3.28Å; T161-C213 PolarHBondContact O-N 3.17Å; T161-C213 PolarHBondContact OG1-O 2.73Å
162	V	89.4	Confident	85.7	Confident	4 Å²	4	53.2 Å²	53.2	2%	0.024	27%	0.271	C	S	.	.	S	Bend	trans	-101.9	127	178.4	177.8	0	0	0	0	109.9	W164 L167 C213 W214	V162-W164 HydrophobicContact CB-CD2 4.44Å; V162-W164 HydrophobicContact CB-CZ2 4.01Å; V162-W164 HydrophobicContact CG1-CD2 3.94Å; V162-W164 HydrophobicContact CG1-CE3 4.25Å; V162-W164 HydrophobicContact CG1-CG 4.36Å; V162-W164 HydrophobicContact CG1-CH2 4.35Å; V162-W164 HydrophobicContact CG1-CZ2 4.02Å; V162-W164 HydrophobicContact CG1-CZ3 4.45Å; V162-W164 HydrophobicContact CG2-CZ2 4.44Å; V162-W164 PolarHBondContact O-N 3.43Å; V162-W164 VanDerWaalsContact O-N 3.1Å; V162-W164 PolarHBondContact O-NE1 3.48Å; V162-L167 HydrophobicContact CG1-CD1 3.99Å; V162-C213 WeakPolarHBondContact CG2-O 3.43Å; V162-W214 HydrophobicContact CG1-CH2 4.01Å; V162-W214 HydrophobicContact CG1-CZ2 4.29Å; V162-W214 HydrophobicContact CG1-CZ3 4.15Å; V162-W214 HydrophobicContact CG2-CD2 4.04Å; V162-W214 HydrophobicContact CG2-CE3 3.71Å; V162-W214 HydrophobicContact CG2-CZ3 4.02Å
163	D	88.8	Confident	84.5	Confident	25 Å²	25	52.3 Å²	52.3	13%	0.134	27%	0.269	C	S	.	.			trans	-80.3	87.8	169.7	-172.7	-19.9	0	0	0	109.1	V165 K166 V198 Q220	D163-V165 PolarHBondContact O-N 3.44Å; D163-V165 WeakPolarHBondContact OD1-CB 3.05Å; D163-V165 PolarHBondContact OD1-N 2.9Å; D163-K166 HydrophobicContact CB-CB 4.5Å; D163-K166 HydrophobicContact CB-CG 4.1Å; D163-K166 VanDerWaalsContact CG-CG 3.42Å; D163-K166 PolarHBondContact O-N 2.03Å; D163-K166 VanDerWaalsContact O-N 3.17Å; D163-K166 PolarHBondContact OD1-N 2.81Å; D163-K166 VanDerWaalsContact OD2-CG 3.27Å; D163-K166 WeakPolarHBondContact OD2-CG 3.25Å; D163-V198 HydrophobicContact CB-CG1 3.86Å; D163-Q220 PolarHBondContact O-NE2 3.05Å
164	W	89.1	Confident	83.3	Confident	15 Å²	15	55.9 Å²	55.9	6%	0.057	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-60.5	-29.1	179.5	-63.3	98.4	0	0	0	113.2	L124 I135 V148 I150 V159 V162 K166 L167 C168 V175 W214	L124-W164 HydrophobicContact CD2-CH2 4.29Å; L124-W164 HydrophobicContact CD2-CZ3 3.92Å; I135-W164 HydrophobicContact CD1-CH2 3.57Å; I135-W164 HydrophobicContact CD1-CZ2 3.59Å; V148-W164 HydrophobicContact CB-CE3 4.33Å; V148-W164 HydrophobicContact CG1-CD2 4.39Å; V148-W164 HydrophobicContact CG1-CE3 3.95Å; V148-W164 HydrophobicContact CG1-CH2 4.46Å; V148-W164 HydrophobicContact CG1-CZ3 3.99Å; V148-W164 HydrophobicContact CG2-CE3 3.91Å; V148-W164 HydrophobicContact CG2-CZ3 4.33Å; I150-W164 HydrophobicContact CD1-CH2 3.65Å; I150-W164 HydrophobicContact CD1-CZ2 3.46Å; I150-W164 VanDerWaalsContact CD1-CZ2 3.46Å; I150-W164 HydrophobicContact CD1-CZ3 4.38Å; V159-W164 HydrophobicContact CG1-CZ2 4.14Å; V159-W164 PolarHBondContact O-NE1 3.24Å; V162-W164 HydrophobicContact CB-CD2 4.44Å; V162-W164 HydrophobicContact CB-CZ2 4.01Å; V162-W164 HydrophobicContact CG1-CD2 3.94Å; V162-W164 HydrophobicContact CG1-CE3 4.25Å; V162-W164 HydrophobicContact CG1-CG 4.36Å; V162-W164 HydrophobicContact CG1-CH2 4.35Å; V162-W164 HydrophobicContact CG1-CZ2 4.02Å; V162-W164 HydrophobicContact CG1-CZ3 4.45Å; V162-W164 HydrophobicContact CG2-CZ2 4.44Å; V162-W164 PolarHBondContact O-N 3.43Å; V162-W164 VanDerWaalsContact O-N 3.1Å; V162-W164 PolarHBondContact O-NE1 3.48Å; W164-K166 PolarHBondContact O-N 2.88Å; W164-L167 HydrophobicContact CE3-CD1 3.96Å; W164-L167 HydrophobicContact CZ3-CD1 4.15Å; W164-L167 PolarHBondContact O-N 2.04Å; W164-C168 PolarHBondContact O-N 2.76Å; W164-V175 HydrophobicContact CB-CB 4.45Å; W164-V175 HydrophobicContact CB-CG1 3.81Å; W164-V175 HydrophobicContact CB-CG2 3.81Å; W164-V175 HydrophobicContact CG-CG1 3.87Å; W164-W214 HydrophobicContact CH2-CH2 4.31Å; W164-W214 AromaticContact CH2-CZ3 3.93Å; W164-W214 HydrophobicContact CH2-CZ3 3.93Å; W164-W214 HydrophobicContact CZ3-CH2 4.29Å; W164-W214 HydrophobicContact CZ3-CZ3 4.37Å
165	V	84.9	Confident	82.9	Confident	110 Å²	110	55.7 Å²	55.7	67%	0.667	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-69	-23.9	179.6	-173.4	0	0	0	0	111.1	D163 L167	D163-V165 PolarHBondContact O-N 3.44Å; D163-V165 WeakPolarHBondContact OD1-CB 3.05Å; D163-V165 PolarHBondContact OD1-N 2.9Å; V165-L167 VanDerWaalsContact C-N 3.34Å
166	K	86.1	Confident	82.3	Confident	141 Å²	141	53.1 Å²	53.1	61%	0.613	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-79.9	-10.7	172.1	-60	-61.9	172.9	-162.4	0	114.6	D163 W164 V198	D163-K166 HydrophobicContact CB-CB 4.5Å; D163-K166 HydrophobicContact CB-CG 4.1Å; D163-K166 VanDerWaalsContact CG-CG 3.42Å; D163-K166 PolarHBondContact O-N 2.03Å; D163-K166 VanDerWaalsContact O-N 3.17Å; D163-K166 PolarHBondContact OD1-N 2.81Å; D163-K166 VanDerWaalsContact OD2-CG 3.27Å; D163-K166 WeakPolarHBondContact OD2-CG 3.25Å; W164-K166 PolarHBondContact O-N 2.88Å; K166-V198 HydrophobicContact CG-CG1 4.12Å
167	L	89.7	Confident	81.8	Confident	7 Å²	7	55 Å²	55	4%	0.037	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-39.9	177.2	-59.4	177	0	0	0	111.6	L140 I143 V162 W164 V165 W214	L140-L167 HydrophobicContact CD2-CD1 4.46Å; L140-L167 WeakPolarHBondContact O-CD2 3.41Å; I143-L167 HydrophobicContact CD1-CB 4.46Å; I143-L167 HydrophobicContact CG1-CB 4.44Å; I143-L167 PolarHBondContact N-O 3.44Å; V162-L167 HydrophobicContact CG1-CD1 3.99Å; W164-L167 HydrophobicContact CE3-CD1 3.96Å; W164-L167 HydrophobicContact CZ3-CD1 4.15Å; W164-L167 PolarHBondContact O-N 2.04Å; V165-L167 VanDerWaalsContact C-N 3.34Å; L167-W214 HydrophobicContact CD1-CH2 3.61Å; L167-W214 HydrophobicContact CD1-CZ2 3.76Å; L167-W214 HydrophobicContact CD2-CZ2 4.49Å
168	C	88.4	Confident	81.2	Confident	19 Å²	19	58.6 Å²	58.6	13%	0.128	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-72.7	133.6	-179.9	-63	0	0	0	0	112.4	I143 W164 A173	I143-C168 WeakPolarHBondContact O-CA 3.07Å; W164-C168 PolarHBondContact O-N 2.76Å; C168-A173 HydrophobicContact CB-CB 3.51Å
169	R	83.1	Confident	80.6	Confident	110 Å²	110	59.4 Å²	59.4	42%	0.415	31%	0.312	S	S	.	.			trans	-93.3	-11	174.2	-88.3	-171.4	162.8	162.4	-5	115.5	E142 I143	E142-R169 HydrophobicContact CG-CG 4.27Å; E142-R169 WeakPolarHBondContact OE1-CD 3.35Å; E142-R169 IonicContact OE1-CZ 2.8Å; E142-R169 IonicContact OE1-NE 3.23Å; E142-R169 IonicContact OE1-NH1 3.97Å; E142-R169 PolarHBondContact OE1-NH1 3.09Å; E142-R169 IonicContact OE2-CZ 2.77Å; E142-R169 IonicContact OE2-NE 3.15Å; E142-R169 IonicContact OE2-NH1 2.82Å; E142-R169 PolarHBondContact OE2-NH1 3.35Å; E142-R169 IonicContact OE2-NH2 3.34Å; I143-R169 PolarHBondContact O-N 2.04Å
170	E	70.2	Confident	80.6	Confident	80 Å²	80	60.5 Å²	60.5	37%	0.374	32%	0.318	S	S	.	.	S	Bend	trans	-94.4	125.5	172.5	-71.8	-176.3	137.8	0	0	110.3	G146 F172 A173	G146-E170 PolarHBondContact N-OE2 3.35Å; E170-F172 PolarHBondContact O-N 3.18Å; E170-A173 HydrophobicContact CB-CB 4.34Å; E170-A173 WeakPolarHBondContact O-CB 3.12Å; E170-A173 PolarHBondContact O-N 2.89Å
171	D	63.5	Low	80.7	Confident	157 Å²	157	59.1 Å²	59.1	84%	0.84	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-18.7	-178.9	-53.1	-62.3	0	0	0	114
172	F	59.7	Low	80.5	Confident	121 Å²	121	62 Å²	62	53%	0.531	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	19.6	-179	-51.3	-76	0	0	0	112.7	E170 H174	E170-F172 PolarHBondContact O-N 3.18Å; F172-H174 PolarHBondContact O-CD2 3.34Å; F172-H174 VanDerWaalsContact O-CD2 3.29Å; F172-H174 PolarHBondContact O-N 3.03Å; F172-H174 VanDerWaalsContact O-N 3.08Å
173	A	64.9	Low	80	Confident	19 Å²	19	64.2 Å²	64.2	16%	0.157	34%	0.337	C	S	.	.			trans	-66.9	104.3	177.6	0	0	0	0	0	111.3	C168 E170 V175	C168-A173 HydrophobicContact CB-CB 3.51Å; E170-A173 HydrophobicContact CB-CB 4.34Å; E170-A173 WeakPolarHBondContact O-CB 3.12Å; E170-A173 PolarHBondContact O-N 2.89Å; A173-V175 PolarHBondContact O-N 3.11Å
174	H	67.7	Low	79.5	Confident	76 Å²	76	70 Å²	70	35%	0.352	37%	0.368	S	S	.	.			trans	-63.6	120	-180	-70.1	-102.3	0	0	0	111.7	Y122 G147 V148 F172	Y122-H174 HydrophobicContact CE1-CB 3.89Å; Y122-H174 WeakPolarHBondContact CE1-O 3.48Å; G147-H174 CarbonylContact C-O 3.52Å; G147-H174 WeakPolarHBondContact CA-O 3.4Å; V148-H174 PolarHBondContact N-O 3.32Å; F172-H174 PolarHBondContact O-CD2 3.34Å; F172-H174 VanDerWaalsContact O-CD2 3.29Å; F172-H174 PolarHBondContact O-N 3.03Å; F172-H174 VanDerWaalsContact O-N 3.08Å
175	V	80.2	Confident	79.3	Confident	54 Å²	54	75.6 Å²	75.6	33%	0.327	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	119.6	172.8	179.4	0	0	0	0	108.7	V148 W164 A173 V177	V148-V175 HydrophobicContact CB-CG2 4.49Å; V148-V175 CarbonylContact O-C 3.33Å; V148-V175 WeakPolarHBondContact O-CA 3.05Å; W164-V175 HydrophobicContact CB-CB 4.45Å; W164-V175 HydrophobicContact CB-CG1 3.81Å; W164-V175 HydrophobicContact CB-CG2 3.81Å; W164-V175 HydrophobicContact CG-CG1 3.87Å; A173-V175 PolarHBondContact O-N 3.11Å; V175-V177 HydrophobicContact CG1-CG2 4.14Å
176	V	80	Confident	79.3	Confident	22 Å²	22	70.9 Å²	70.9	13%	0.133	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	117	-179	178.1	0	0	0	0	109.2	Y122 V148 R149 I150 E178	Y122-V176 HydrophobicContact CE1-CG2 4.2Å; V148-V176 PolarHBondContact O-N 3.14Å; R149-V176 WeakPolarHBondContact CA-O 3.48Å; R149-V176 HydrophobicContact CB-CB 4.47Å; R149-V176 HydrophobicContact CG-CB 4.02Å; R149-V176 HydrophobicContact CG-CG1 4.19Å; I150-V176 PolarHBondContact N-O 3.36Å; V176-E178 HydrophobicContact CG1-CG 4.45Å; V176-E178 WeakPolarHBondContact CG1-OE1 3.3Å
177	V	83.2	Confident	79	Confident	42 Å²	42	69.3 Å²	69.3	26%	0.255	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	103.4	-177.3	178	0	0	0	0	109.1	I150 V159 V175	I150-V177 HydrophobicContact CB-CG2 4.44Å; I150-V177 WeakPolarHBondContact O-CA 3.47Å; V159-V177 HydrophobicContact CB-CG1 4.09Å; V159-V177 HydrophobicContact CG1-CB 4.37Å; V159-V177 HydrophobicContact CG1-CG1 3.5Å; V159-V177 VanDerWaalsContact CG1-CG1 3.5Å; V159-V177 HydrophobicContact CG1-CG2 3.87Å; V175-V177 HydrophobicContact CG1-CG2 4.14Å
178	E	80.9	Confident	78.3	Confident	93 Å²	93	71.3 Å²	71.3	44%	0.435	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	159.9	-172.6	-71.8	167.3	-143.5	0	0	111	I150 F151 N152 V176 N180	I150-E178 PolarHBondContact O-N 2.83Å; F151-E178 WeakPolarHBondContact CA-O 3.3Å; F151-E178 HydrophobicContact CD2-CB 3.56Å; F151-E178 VanDerWaalsContact CD2-O 3.24Å; F151-E178 WeakPolarHBondContact CD2-O 3.43Å; F151-E178 HydrophobicContact CE2-CB 3.58Å; N152-E178 PolarHBondContact N-O 3.46Å; V176-E178 HydrophobicContact CG1-CG 4.45Å; V176-E178 WeakPolarHBondContact CG1-OE1 3.3Å; E178-N180 PolarHBondContact O-N 2.04Å; E178-N180 PolarHBondContact O-ND2 3.19Å
179	G	79	Confident	77.8	Confident	49 Å²	49	77.5 Å²	77.5	51%	0.505	41%	0.411	S	S	.	.	S	Bend	trans	61.2	5.5	169.9	0	0	0	0	0	116.6	N152	N152-G179 WeakPolarHBondContact CA-O 3.24Å
180	N	88.6	Confident	77.7	Confident	27 Å²	27	73.6 Å²	73.6	14%	0.144	40%	0.4	C	S	.	.	S	Bend	trans	-80.1	-174.6	171.7	-50.1	-62.1	0	0	0	109.7	I150 N153 L156 E178	I150-N180 PolarHBondContact O-ND2 2.79Å; N153-N180 WeakPolarHBondContact CB-OD1 3.35Å; N153-N180 PolarHBondContact N-OD1 3.1Å; N153-N180 VanDerWaalsContact N-OD1 3.07Å; N153-N180 PolarHBondContact ND2-OD1 3Å; N153-N180 WeakPolarHBondContact O-CA 3.4Å; L156-N180 HydrophobicContact CB-CB 4.46Å; E178-N180 PolarHBondContact O-N 2.04Å; E178-N180 PolarHBondContact O-ND2 3.19Å
181	K	89.5	Confident	78.3	Confident	53 Å²	53	73.1 Å²	73.1	23%	0.23	40%	0.402	C	S	.	.			trans	-63.1	141.8	-178.8	-163.2	151.6	176	159.5	0	111.5	E155 L156 P183	E155-K181 IonicContact OE1-NZ 3.19Å; E155-K181 PolarHBondContact OE1-NZ 3.34Å; E155-K181 IonicContact OE2-NZ 3.48Å; E155-K181 PolarHBondContact OE2-NZ 3.49Å; L156-K181 WeakPolarHBondContact O-CB 3.49Å; L156-K181 PolarHBondContact O-N 3.32Å; K181-P183 WeakPolarHBondContact O-CD 3.5Å
182	D	82.9	Confident	78.5	Confident	77 Å²	77	68.3 Å²	68.3	41%	0.412	38%	0.377	S	S	.	.			trans	-61.4	124.7	176.6	-174.3	-38.2	0	0	0	109.6	N184 L185 C186	D182-N184 PolarHBondContact O-N 2.91Å; D182-N184 VanDerWaalsContact O-N 3.08Å; D182-N184 VanDerWaalsContact OD1-CB 3.3Å; D182-N184 WeakPolarHBondContact OD1-CB 3.33Å; D182-N184 PolarHBondContact OD1-N 2.97Å; D182-N184 PolarHBondContact OD1-ND2 3.24Å; D182-L185 HydrophobicContact CB-CB 4.35Å; D182-L185 HydrophobicContact CB-CD1 4.01Å; D182-L185 HydrophobicContact CB-CG 4.01Å; D182-L185 WeakPolarHBondContact O-CA 3.43Å; D182-L185 WeakPolarHBondContact O-CB 3.43Å; D182-L185 PolarHBondContact O-N 3.15Å; D182-C186 PolarHBondContact O-N 3.34Å
183	P	79.7	Confident	78.9	Confident	51 Å²	51	71 Å²	71	33%	0.331	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-25.3	179.9	-27	35.9	0	0	0	114.3	N160 K181 L185 C186	N160-P183 VanDerWaalsContact ND2-CG 3.29Å; N160-P183 WeakPolarHBondContact ND2-CG 3.06Å; K181-P183 WeakPolarHBondContact O-CD 3.5Å; P183-L185 VanDerWaalsContact C-N 3.31Å; P183-C186 PolarHBondContact O-N 3.5Å
184	N	79.1	Confident	79.2	Confident	148 Å²	148	71.6 Å²	71.6	79%	0.791	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-19.4	176.1	-55.3	-83.4	0	0	0	112.8	D182	D182-N184 PolarHBondContact O-N 2.91Å; D182-N184 VanDerWaalsContact O-N 3.08Å; D182-N184 VanDerWaalsContact OD1-CB 3.3Å; D182-N184 WeakPolarHBondContact OD1-CB 3.33Å; D182-N184 PolarHBondContact OD1-N 2.97Å; D182-N184 PolarHBondContact OD1-ND2 3.24Å
185	L	84.9	Confident	79.5	Confident	131 Å²	131	77.3 Å²	77.3	69%	0.686	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-12.3	171.5	-60.4	179.5	0	0	0	112.3	D182 P183	D182-L185 HydrophobicContact CB-CB 4.35Å; D182-L185 HydrophobicContact CB-CD1 4.01Å; D182-L185 HydrophobicContact CB-CG 4.01Å; D182-L185 WeakPolarHBondContact O-CA 3.43Å; D182-L185 WeakPolarHBondContact O-CB 3.43Å; D182-L185 PolarHBondContact O-N 3.15Å; P183-L185 VanDerWaalsContact C-N 3.31Å
186	C	84.9	Confident	79.4	Confident	12 Å²	12	77.3 Å²	77.3	8%	0.081	41%	0.414	C	S	.	.	S	Bend	trans	-90.4	134.9	171.9	-68	0	0	0	0	110.4	C157 D182 P183 E188	C157-C186 VanDerWaalsContact CA-SG 3.56Å; C157-C186 HydrophobicContact CB-CB 3.69Å; C157-C186 WeakPolarHBondContact CB-SG 3.25Å; C157-C186 WeakPolarHBondContact SG-CB 3.21Å; C157-C186 CovalentContact SG-SG 2.04Å; C157-C186 PolarHBondContact SG-SG 2.84Å; D182-C186 PolarHBondContact O-N 3.34Å; P183-C186 PolarHBondContact O-N 3.5Å; C186-E188 HydrophobicContact CB-CG 3.38Å; C186-E188 PolarHBondContact O-N 2.97Å
187	S	78.5	Confident	79.6	Confident	107 Å²	107	76.5 Å²	76.5	75%	0.748	41%	0.409	S	S	*	.			trans	-83.4	53.7	175	-68.9	0	0	0	0	111.4	Y158 K189	Y158-S187 PolarHBondContact OH-O 3.44Å; S187-K189 PolarHBondContact O-N 3.37Å
188	E	74.9	Confident	79.7	Confident	49 Å²	49	75.2 Å²	75.2	23%	0.229	40%	0.401	C	S	.	.			trans	-70.4	100	-170.8	-51.6	-165.1	153	0	0	111.2	Y158 T161 C186	Y158-E188 HydrophobicContact CD1-CB 4.49Å; Y158-E188 HydrophobicContact CE1-CB 4.21Å; Y158-E188 PolarHBondContact N-OE1 3.11Å; T161-E188 HydrophobicContact CG2-CB 4.01Å; C186-E188 HydrophobicContact CB-CG 3.38Å; C186-E188 PolarHBondContact O-N 2.97Å
189	K	78.4	Confident	79.6	Confident	150 Å²	150	77.1 Å²	77.1	65%	0.652	41%	0.408	S	S	*	.			trans	-135	103.6	176.9	-69.5	-174.3	-179.6	178.3	0	110.2	S187 T191 H216	S187-K189 PolarHBondContact O-N 3.37Å; K189-T191 PolarHBondContact O-N 2.82Å; K189-T191 VanDerWaalsContact O-N 3.11Å; K189-H216 PolarHBondContact O-CD2 2.94Å
190	C	81.6	Confident	79.1	Confident	28 Å²	28	78 Å²	78	19%	0.189	40%	0.399	C	S	.	.			trans	-70.7	99.3	171.1	-50.3	0	0	0	0	109.1	N211 C213	C190-N211 VanDerWaalsContact CB-O 3.31Å; C190-N211 WeakPolarHBondContact CB-O 3.19Å; C190-N211 PolarHBondContact SG-O 3Å; C190-C213 WeakPolarHBondContact CA-SG 3.43Å; C190-C213 HydrophobicContact CB-CB 3.55Å; C190-C213 WeakPolarHBondContact CB-SG 3.03Å; C190-C213 WeakPolarHBondContact SG-CB 3.29Å; C190-C213 CovalentContact SG-SG 2.03Å; C190-C213 PolarHBondContact SG-SG 2.99Å
191	T	81.2	Confident	78	Confident	69 Å²	69	83.8 Å²	83.8	42%	0.423	42%	0.419	S	S	.	.			trans	-80.3	-21.2	-176.4	60.2	0	0	0	0	113.6	K189 Q193 H216	K189-T191 PolarHBondContact O-N 2.82Å; K189-T191 VanDerWaalsContact O-N 3.11Å; T191-Q193 PolarHBondContact O-N 2.83Å; T191-H216 WeakPolarHBondContact CG2-CE1 3.38Å; T191-H216 VanDerWaalsContact CG2-NE2 3.3Å; T191-H216 WeakPolarHBondContact CG2-NE2 3.05Å; T191-H216 PolarHBondContact N-O 3.14Å; T191-H216 PolarHBondContact OG1-O 3.2Å
192	N	69.1	Low	76.5	Confident	57 Å²	57	82 Å²	82	31%	0.305	41%	0.414	S	S	.	.			trans	-71.7	108.6	-177.1	-168.2	-32.9	0	0	0	111.5	S194 N211 D217 C219	N192-S194 VanDerWaalsContact C-N 3.34Å; N192-S194 WeakPolarHBondContact OD1-CB 3.37Å; N192-S194 PolarHBondContact OD1-N 3.28Å; N192-S194 VanDerWaalsContact OD1-N 3.11Å; N192-N211 PolarHBondContact O-ND2 2.02Å; N192-D217 WeakPolarHBondContact CB-O 3.08Å; N192-D217 PolarHBondContact ND2-O 2.99Å; N192-D217 VanDerWaalsContact ND2-O 3.09Å; N192-C219 HydrophobicContact CB-CB 4.14Å
193	Q	67.3	Low	75.1	Confident	178 Å²	178	84.3 Å²	84.3	83%	0.832	44%	0.436	S	S	*	.			trans	-92.4	19.7	-178.4	-61.1	-172.2	5.3	0	0	113.6	T191 K195	T191-Q193 PolarHBondContact O-N 2.83Å; Q193-K195 PolarHBondContact O-N 3.23Å
194	S	72.1	Confident	73.7	Confident	31 Å²	31	86 Å²	86	22%	0.217	46%	0.462	C	S	.	.			trans	-55.6	140	177.2	-179.4	0	0	0	0	111.5	N192 F196 C197	N192-S194 VanDerWaalsContact C-N 3.34Å; N192-S194 WeakPolarHBondContact OD1-CB 3.37Å; N192-S194 PolarHBondContact OD1-N 3.28Å; N192-S194 VanDerWaalsContact OD1-N 3.11Å; S194-F196 PolarHBondContact O-N 2.87Å; S194-F196 PolarHBondContact OG-N 3.13Å; S194-C197 PolarHBondContact O-N 2.9Å; S194-C197 PolarHBondContact O-SG 3.33Å; S194-C197 VanDerWaalsContact O-SG 3.33Å
195	K	73.1	Confident	72.1	Confident	196 Å²	196	82.9 Å²	82.9	85%	0.852	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-20	176.4	-67.5	-178.8	-179.2	174.9	0	112.4	Q193	Q193-K195 PolarHBondContact O-N 3.23Å
196	F	77.6	Confident	70.2	Confident	53 Å²	53	85.3 Å²	85.3	23%	0.232	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	17.4	-179	-48.8	-75.3	0	0	0	113.5	S194 A222 E239 W241	S194-F196 PolarHBondContact O-N 2.87Å; S194-F196 PolarHBondContact OG-N 3.13Å; F196-A222 PolarHBondContact O-N 3.11Å; F196-E239 HydrophobicContact CE2-CG 4.2Å; F196-W241 HydrophobicContact CB-CD2 3.9Å; F196-W241 HydrophobicContact CB-CE3 3.7Å; F196-W241 HydrophobicContact CB-CH2 3.37Å; F196-W241 HydrophobicContact CB-CZ2 3.59Å; F196-W241 HydrophobicContact CB-CZ3 3.45Å; F196-W241 VanDerWaalsContact CB-CZ3 3.45Å; F196-W241 HydrophobicContact CD1-CB 4.41Å; F196-W241 AromaticContact CD1-CD2 3.94Å; F196-W241 HydrophobicContact CD1-CD2 3.94Å; F196-W241 HydrophobicContact CD1-CE3 4.02Å; F196-W241 HydrophobicContact CD1-CG 4.16Å; F196-W241 AromaticContact CD2-CD2 3.92Å; F196-W241 HydrophobicContact CD2-CD2 3.92Å; F196-W241 AromaticContact CD2-CE2 3.64Å; F196-W241 HydrophobicContact CD2-CG 4.16Å; F196-W241 HydrophobicContact CD2-CZ2 4.04Å; F196-W241 AromaticContact CD2-NE1 3.73Å; F196-W241 HydrophobicContact CE1-CB 4.12Å; F196-W241 HydrophobicContact CE1-CD2 4.43Å; F196-W241 HydrophobicContact CE1-CG 4.16Å; F196-W241 AromaticContact CE2-CD1 3.96Å; F196-W241 HydrophobicContact CE2-CD2 4.4Å; F196-W241 HydrophobicContact CE2-CG 4.16Å; F196-W241 AromaticContact CE2-NE1 3.97Å; F196-W241 AromaticContact CG-CD2 3.67Å; F196-W241 HydrophobicContact CG-CD2 3.67Å; F196-W241 AromaticContact CG-CE2 3.76Å; F196-W241 AromaticContact CG-CE3 3.87Å; F196-W241 HydrophobicContact CG-CE3 3.87Å; F196-W241 HydrophobicContact CG-CG 4.16Å; F196-W241 HydrophobicContact CG-CH2 4.21Å; F196-W241 HydrophobicContact CG-CZ2 4.03Å; F196-W241 HydrophobicContact CG-CZ3 4.15Å; F196-W241 HydrophobicContact CZ-CB 4.32Å; F196-W241 HydrophobicContact CZ-CG 4.16Å
197	C	85.6	Confident	68.6	Low	5 Å²	5	90.8 Å²	90.8	3%	0.034	48%	0.482	C	S	.	.	B	Isolated β-bridge	trans	-81.8	142.1	167.7	-56.1	0	0	0	0	110.7	S194 N211 C219 Q220	S194-C197 PolarHBondContact O-N 2.9Å; S194-C197 PolarHBondContact O-SG 3.33Å; S194-C197 VanDerWaalsContact O-SG 3.33Å; C197-N211 HydrophobicContact CB-CB 3.88Å; C197-C219 VanDerWaalsContact CA-SG 3.58Å; C197-C219 HydrophobicContact CB-CB 3.64Å; C197-C219 WeakPolarHBondContact CB-SG 3.35Å; C197-C219 WeakPolarHBondContact SG-CB 3.43Å; C197-C219 CovalentContact SG-SG 2.04Å; C197-C219 PolarHBondContact SG-SG 3.25Å; C197-Q220 CarbonylContact C-O 3.55Å; C197-Q220 WeakPolarHBondContact CA-O 3.34Å
198	V	84.6	Confident	67.6	Low	15 Å²	15	87.7 Å²	87.7	9%	0.091	46%	0.46	C	S	.	.			trans	-59.3	140.4	169.6	173.9	0	0	0	0	109.1	D163 K166 N211 A212 Q220 A222	D163-V198 HydrophobicContact CB-CG1 3.86Å; K166-V198 HydrophobicContact CG-CG1 4.12Å; V198-N211 CarbonylContact O-C 3.28Å; V198-N211 WeakPolarHBondContact O-CA 3.49Å; V198-A212 HydrophobicContact CB-CB 4.01Å; V198-A212 HydrophobicContact CG1-CB 4.19Å; V198-A212 PolarHBondContact O-N 3.27Å; V198-Q220 HydrophobicContact CB-CB 4.34Å; V198-Q220 HydrophobicContact CB-CG 4.34Å; V198-Q220 HydrophobicContact CG2-CB 4.36Å; V198-Q220 HydrophobicContact CG2-CG 3.94Å; V198-Q220 PolarHBondContact N-O 2.8Å; V198-A222 HydrophobicContact CB-CB 4.4Å; V198-A222 HydrophobicContact CG2-CB 3.66Å
199	K	78.5	Confident	67.2	Low	134 Å²	134	91 Å²	91	58%	0.583	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.2	104.9	-179.5	-70	-167.6	176.2	-171.5	0	111.2	F209	K199-F209 HydrophobicContact CB-CB 4.28Å; K199-F209 HydrophobicContact CB-CD1 4.23Å; K199-F209 HydrophobicContact CD-CB 4.47Å
200	H	68.2	Low	67	Low	68 Å²	68	88.3 Å²	88.3	32%	0.315	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	150.6	174	-167.3	-101	0	0	0	110.5	F209 I210 A212	H200-F209 CarbonylContact O-C 3.6Å; H200-F209 VanDerWaalsContact O-CA 3.31Å; H200-F209 WeakPolarHBondContact O-CA 3.36Å; H200-I210 PolarHBondContact N-O 3.45Å; H200-I210 PolarHBondContact O-N 3.38Å; H200-A212 HydrophobicContact CB-CB 4.33Å
201	R	65.2	Low	67.1	Low	147 Å²	147	88.5 Å²	88.5	56%	0.555	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	133.4	177.6	-159.1	177.7	-160.9	168.6	8.5	109.7	S203 D207	R201-S203 PolarHBondContact O-N 2.84Å; R201-D207 IonicContact NH2-OD1 2.94Å
202	A	58.6	Low	67.4	Low	17 Å²	17	85.2 Å²	85.2	14%	0.14	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-72.4	129.6	177.6	0	0	0	0	0	111.1	G204 S208 I210	A202-G204 PolarHBondContact O-N 3.12Å; A202-S208 WeakPolarHBondContact CB-OG 3.05Å; A202-S208 PolarHBondContact N-O 2.88Å; A202-S208 VanDerWaalsContact N-O 3.16Å; A202-I210 HydrophobicContact CB-CD1 3.75Å; A202-I210 HydrophobicContact CB-CG1 4.12Å
203	S	53.4	Low	68.4	Low	124 Å²	124	82.6 Å²	82.6	87%	0.867	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	129.4	169.3	-72.7	0	0	0	0	110.5	R201	R201-S203 PolarHBondContact O-N 2.84Å
204	G	50.4	Low	69.6	Low	86 Å²	86	74.1 Å²	74.1	89%	0.887	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.2	-7.7	172.9	0	0	0	0	0	116.9	A202	A202-G204 PolarHBondContact O-N 3.12Å
205	V	46	Very low	70.4	Confident	83 Å²	83	73.9 Å²	73.9	50%	0.503	39%	0.388	S	S	.	.			trans	-128.9	124.4	179.4	179.6	0	0	0	0	110.5	S208	V205-S208 WeakPolarHBondContact CB-OG 3.37Å; V205-S208 WeakPolarHBondContact CG1-OG 3.41Å
206	K	44.3	Very low	71.1	Confident	183 Å²	183	68.5 Å²	68.5	80%	0.796	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	136	169.8	-74.5	-173.1	176.5	-177.3	0	109.4	S208	K206-S208 VanDerWaalsContact C-N 3.3Å; K206-S208 PolarHBondContact O-N 2.71Å
207	D	51.3	Low	71.5	Confident	127 Å²	127	70.7 Å²	70.7	68%	0.679	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	17.5	171.4	-47.5	-31	0	0	0	117.5	R201	R201-D207 IonicContact NH2-OD1 2.94Å
208	S	57.8	Low	71.6	Confident	41 Å²	41	72.7 Å²	72.7	29%	0.287	39%	0.392	S	S	.	.			trans	-99.3	130.7	159.5	69.5	0	0	0	0	112.2	A202 V205 K206	A202-S208 WeakPolarHBondContact CB-OG 3.05Å; A202-S208 PolarHBondContact N-O 2.88Å; A202-S208 VanDerWaalsContact N-O 3.16Å; V205-S208 WeakPolarHBondContact CB-OG 3.37Å; V205-S208 WeakPolarHBondContact CG1-OG 3.41Å; K206-S208 VanDerWaalsContact C-N 3.3Å; K206-S208 PolarHBondContact O-N 2.71Å
209	F	66.7	Low	71.9	Confident	120 Å²	120	72.6 Å²	72.6	53%	0.526	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	138	171.5	-68.9	-92.2	0	0	0	108.8	K199 H200	K199-F209 HydrophobicContact CB-CB 4.28Å; K199-F209 HydrophobicContact CB-CD1 4.23Å; K199-F209 HydrophobicContact CD-CB 4.47Å; H200-F209 CarbonylContact O-C 3.6Å; H200-F209 VanDerWaalsContact O-CA 3.31Å; H200-F209 WeakPolarHBondContact O-CA 3.36Å
210	I	74.7	Confident	72.5	Confident	93 Å²	93	66.3 Å²	66.3	48%	0.477	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	141.1	175.8	-61.3	171.2	0	0	0	107.2	H200 A202 A212	H200-I210 PolarHBondContact N-O 3.45Å; H200-I210 PolarHBondContact O-N 3.38Å; A202-I210 HydrophobicContact CB-CD1 3.75Å; A202-I210 HydrophobicContact CB-CG1 4.12Å; I210-A212 PolarHBondContact O-N 3.26Å
211	N	82.6	Confident	73.4	Confident	31 Å²	31	64.8 Å²	64.8	17%	0.166	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	126.4	172.1	-76.4	4.2	0	0	0	108.9	C190 N192 C197 V198	C190-N211 VanDerWaalsContact CB-O 3.31Å; C190-N211 WeakPolarHBondContact CB-O 3.19Å; C190-N211 PolarHBondContact SG-O 3Å; N192-N211 PolarHBondContact O-ND2 2.02Å; C197-N211 HydrophobicContact CB-CB 3.88Å; V198-N211 CarbonylContact O-C 3.28Å; V198-N211 WeakPolarHBondContact O-CA 3.49Å
212	A	88.5	Confident	74.4	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.008	34%	0.344	C	S	.	.			trans	-67.8	143.4	173.7	0	0	0	0	0	110.4	T161 V198 H200 I210 C219 Q220	T161-A212 CarbonylContact O-C 3.21Å; T161-A212 WeakPolarHBondContact O-CA 3.07Å; T161-A212 WeakPolarHBondContact O-CB 2.96Å; V198-A212 HydrophobicContact CB-CB 4.01Å; V198-A212 HydrophobicContact CG1-CB 4.19Å; V198-A212 PolarHBondContact O-N 3.27Å; H200-A212 HydrophobicContact CB-CB 4.33Å; I210-A212 PolarHBondContact O-N 3.26Å; A212-C219 CarbonylContact O-C 3.01Å; A212-C219 WeakPolarHBondContact O-CA 3.34Å; A212-C219 VanDerWaalsContact O-CB 3.29Å; A212-C219 WeakPolarHBondContact O-CB 3.42Å; A212-Q220 HydrophobicContact CB-CB 3.98Å; A212-Q220 PolarHBondContact O-N 3.03Å
213	C	90.7	Very high	75.7	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.007	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-148.1	151.1	-179.2	68.3	0	0	0	0	114.9	T161 V162 C190 N215 T218 C219	T161-C213 CarbonylContact C-O 3.57Å; T161-C213 VanDerWaalsContact CB-O 3.29Å; T161-C213 WeakPolarHBondContact CB-O 3.28Å; T161-C213 PolarHBondContact O-N 3.17Å; T161-C213 PolarHBondContact OG1-O 2.73Å; V162-C213 WeakPolarHBondContact CG2-O 3.43Å; C190-C213 WeakPolarHBondContact CA-SG 3.43Å; C190-C213 HydrophobicContact CB-CB 3.55Å; C190-C213 WeakPolarHBondContact CB-SG 3.03Å; C190-C213 WeakPolarHBondContact SG-CB 3.29Å; C190-C213 CovalentContact SG-SG 2.03Å; C190-C213 PolarHBondContact SG-SG 2.99Å; C213-N215 VanDerWaalsContact CB-O 3.29Å; C213-N215 WeakPolarHBondContact CB-O 3.43Å; C213-N215 PolarHBondContact SG-O 2.91Å; C213-T218 WeakPolarHBondContact CA-O 3.41Å; C213-T218 WeakPolarHBondContact CB-O 3.07Å; C213-C219 HydrophobicContact CB-CB 4.45Å
214	W	91.5	Very high	77.3	Confident	1 Å²	1	55.2 Å²	55.2	0%	0.004	32%	0.315	C	S	.	.	S	Bend	trans	-84.7	-28	175.9	-68.8	105	0	0	0	112.4	I135 L137 S138 L140 Y158 V162 W164 L167 T218	I135-W214 HydrophobicContact CB-CE3 4.43Å; I135-W214 HydrophobicContact CB-CZ3 4.44Å; I135-W214 HydrophobicContact CG2-CE3 4.49Å; I135-W214 HydrophobicContact CG2-CZ3 4.11Å; L137-W214 HydrophobicContact CB-CZ3 4.43Å; S138-W214 VanDerWaalsContact CA-CD1 3.5Å; S138-W214 PolarHBondContact O-NE1 3.24Å; L140-W214 HydrophobicContact CB-CH2 4.18Å; L140-W214 HydrophobicContact CB-CZ2 3.99Å; L140-W214 HydrophobicContact CD2-CH2 4.06Å; Y158-W214 WeakPolarHBondContact CB-O 3.34Å; V162-W214 HydrophobicContact CG1-CH2 4.01Å; V162-W214 HydrophobicContact CG1-CZ2 4.29Å; V162-W214 HydrophobicContact CG1-CZ3 4.15Å; V162-W214 HydrophobicContact CG2-CD2 4.04Å; V162-W214 HydrophobicContact CG2-CE3 3.71Å; V162-W214 HydrophobicContact CG2-CZ3 4.02Å; W164-W214 HydrophobicContact CH2-CH2 4.31Å; W164-W214 AromaticContact CH2-CZ3 3.93Å; W164-W214 HydrophobicContact CH2-CZ3 3.93Å; W164-W214 HydrophobicContact CZ3-CH2 4.29Å; W164-W214 HydrophobicContact CZ3-CZ3 4.37Å; L167-W214 HydrophobicContact CD1-CH2 3.61Å; L167-W214 HydrophobicContact CD1-CZ2 3.76Å; L167-W214 HydrophobicContact CD2-CZ2 4.49Å; W214-T218 PolarHBondContact N-O 3.35Å
215	N	89.2	Confident	79	Confident	26 Å²	26	58.3 Å²	58.3	14%	0.139	30%	0.304	C	S	.	.	S	Bend	trans	-160.6	-172	168.2	63.3	18.8	0	0	0	110.1	E134 Y158 C213 D217 T218	E134-N215 PolarHBondContact OE1-ND2 3.45Å; E134-N215 WeakPolarHBondContact OE2-CB 3.39Å; E134-N215 PolarHBondContact OE2-ND2 2.89Å; Y158-N215 HydrophobicContact CD2-CB 4.4Å; C213-N215 VanDerWaalsContact CB-O 3.29Å; C213-N215 WeakPolarHBondContact CB-O 3.43Å; C213-N215 PolarHBondContact SG-O 2.91Å; N215-D217 PolarHBondContact O-N 2.91Å; N215-D217 VanDerWaalsContact O-N 3.15Å; N215-D217 PolarHBondContact OD1-N 3.35Å; N215-T218 PolarHBondContact OD1-N 3.39Å; N215-T218 PolarHBondContact OD1-OG1 2.65Å
216	H	87	Confident	81	Confident	82 Å²	82	60 Å²	60	38%	0.38	31%	0.307	S	S	.	.	S	Bend	trans	-51.3	-37.4	-176.3	-177.3	-94.9	0	0	0	114.7	K189 T191	K189-H216 PolarHBondContact O-CD2 2.94Å; T191-H216 WeakPolarHBondContact CG2-CE1 3.38Å; T191-H216 VanDerWaalsContact CG2-NE2 3.3Å; T191-H216 WeakPolarHBondContact CG2-NE2 3.05Å; T191-H216 PolarHBondContact N-O 3.14Å; T191-H216 PolarHBondContact OG1-O 3.2Å
217	D	85.9	Confident	83.2	Confident	100 Å²	100	51.3 Å²	51.3	54%	0.535	27%	0.269	S	S	.	.	S	Bend	trans	-106.5	-29	-169.6	-54.3	-45.2	0	0	0	113.2	N192 N215	N192-D217 WeakPolarHBondContact CB-O 3.08Å; N192-D217 PolarHBondContact ND2-O 2.99Å; N192-D217 VanDerWaalsContact ND2-O 3.09Å; N215-D217 PolarHBondContact O-N 2.91Å; N215-D217 VanDerWaalsContact O-N 3.15Å; N215-D217 PolarHBondContact OD1-N 3.35Å
218	T	88.7	Confident	84.7	Confident	47 Å²	47	49.5 Å²	49.5	29%	0.288	26%	0.263	S	S	.	.			trans	-104.8	108.8	-176.1	63.1	0	0	0	0	111.8	C213 W214 N215	C213-T218 WeakPolarHBondContact CA-O 3.41Å; C213-T218 WeakPolarHBondContact CB-O 3.07Å; W214-T218 PolarHBondContact N-O 3.35Å; N215-T218 PolarHBondContact OD1-N 3.39Å; N215-T218 PolarHBondContact OD1-OG1 2.65Å
219	C	90	Very high	85.9	Confident	12 Å²	12	54.9 Å²	54.9	8%	0.081	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-77.7	158.4	173.9	77.4	0	0	0	0	112.2	N192 C197 A212 C213 T221	N192-C219 HydrophobicContact CB-CB 4.14Å; C197-C219 VanDerWaalsContact CA-SG 3.58Å; C197-C219 HydrophobicContact CB-CB 3.64Å; C197-C219 WeakPolarHBondContact CB-SG 3.35Å; C197-C219 WeakPolarHBondContact SG-CB 3.43Å; C197-C219 CovalentContact SG-SG 2.04Å; C197-C219 PolarHBondContact SG-SG 3.25Å; A212-C219 CarbonylContact O-C 3.01Å; A212-C219 WeakPolarHBondContact O-CA 3.34Å; A212-C219 VanDerWaalsContact O-CB 3.29Å; A212-C219 WeakPolarHBondContact O-CB 3.42Å; C213-C219 HydrophobicContact CB-CB 4.45Å; C219-T221 PolarHBondContact O-N 3.35Å
220	Q	91	Very high	86.8	Confident	3 Å²	3	57.2 Å²	57.2	1%	0.014	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-73.2	120.1	171.7	-175.1	-174.8	2.6	0	0	108.7	D163 C197 V198 A212	D163-Q220 PolarHBondContact O-NE2 3.05Å; C197-Q220 CarbonylContact C-O 3.55Å; C197-Q220 WeakPolarHBondContact CA-O 3.34Å; V198-Q220 HydrophobicContact CB-CB 4.34Å; V198-Q220 HydrophobicContact CB-CG 4.34Å; V198-Q220 HydrophobicContact CG2-CB 4.36Å; V198-Q220 HydrophobicContact CG2-CG 3.94Å; V198-Q220 PolarHBondContact N-O 2.8Å; A212-Q220 HydrophobicContact CB-CB 3.98Å; A212-Q220 PolarHBondContact O-N 3.03Å
221	T	88.3	Confident	87.3	Confident	35 Å²	35	55 Å²	55	22%	0.215	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-72.8	128.5	-174	57.8	0	0	0	0	112.3	C219 W241	C219-T221 PolarHBondContact O-N 3.35Å; T221-W241 HydrophobicContact CG2-CH2 3.77Å; T221-W241 HydrophobicContact CG2-CZ3 4.45Å
222	A	84.9	Confident	87.6	Confident	28 Å²	28	54.8 Å²	54.8	23%	0.231	29%	0.287	C	S	.	.			trans	-106.4	128	173.6	0	0	0	0	0	110.6	F196 V198 W241	F196-A222 PolarHBondContact O-N 3.11Å; V198-A222 HydrophobicContact CB-CB 4.4Å; V198-A222 HydrophobicContact CG2-CB 3.66Å; A222-W241 VanDerWaalsContact O-CZ3 3.26Å; A222-W241 WeakPolarHBondContact O-CZ3 3.5Å
223	C	87.5	Confident	87.7	Confident	39 Å²	39	55.5 Å²	55.5	26%	0.264	29%	0.293	S	S	.	.			trans	-66.1	154.1	171.9	-70.1	0	0	0	0	112	C227 T228 C234	C223-C227 HydrophobicContact CB-CB 4.21Å; C223-T228 PolarHBondContact O-OG1 2.98Å; C223-C234 WeakPolarHBondContact CA-SG 3.29Å; C223-C234 HydrophobicContact CB-CB 3.67Å; C223-C234 WeakPolarHBondContact CB-SG 3.3Å; C223-C234 WeakPolarHBondContact SG-CB 3.34Å; C223-C234 PolarHBondContact SG-N 3.47Å; C223-C234 VanDerWaalsContact SG-N 3.44Å; C223-C234 CovalentContact SG-SG 2.04Å; C223-C234 PolarHBondContact SG-SG 2.69Å
224	P	86.7	Confident	87.7	Confident	21 Å²	21	55.5 Å²	55.5	14%	0.136	29%	0.293	C	S	.	.			trans	-50.5	148.2	167.4	-24.1	32.9	0	0	0	111.4	E226 C227 T228 W241	P224-E226 WeakPolarHBondContact CB-OE2 3.34Å; P224-E226 PolarHBondContact O-N 3.38Å; P224-C227 WeakPolarHBondContact O-CB 3.39Å; P224-C227 PolarHBondContact O-N 2.73Å; P224-T228 PolarHBondContact O-N 2.94Å; P224-T228 VanDerWaalsContact O-N 3.07Å; P224-T228 PolarHBondContact O-OG1 3.17Å; P224-T228 VanDerWaalsContact O-OG1 3.06Å; P224-W241 HydrophobicContact CG-CB 4.14Å
225	K	85.5	Confident	87.6	Confident	151 Å²	151	55.5 Å²	55.5	66%	0.657	29%	0.293	S	S	*	.	H	α-helix	trans	-57.7	-40.8	-176.4	-77.6	-168.7	172	-166.7	0	111.4	C227 T228 E229	K225-C227 PolarHBondContact O-N 2.91Å; K225-T228 PolarHBondContact O-N 3.39Å; K225-E229 WeakPolarHBondContact O-CB 3.47Å; K225-E229 WeakPolarHBondContact O-CG 3.49Å; K225-E229 PolarHBondContact O-N 2.67Å
226	E	88.1	Confident	87.1	Confident	119 Å²	119	55.2 Å²	55.2	56%	0.556	29%	0.293	S	S	*	.	H	α-helix	trans	-59	-29.3	179.5	-53.1	76.2	-170.1	0	0	112	P224 R230	P224-E226 WeakPolarHBondContact CB-OE2 3.34Å; P224-E226 PolarHBondContact O-N 3.38Å; E226-R230 WeakPolarHBondContact O-CD 3.35Å; E226-R230 VanDerWaalsContact O-CG 3.28Å; E226-R230 WeakPolarHBondContact O-CG 2.95Å
227	C	89.7	Confident	86.6	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-83.2	-45.3	173.7	-43.1	0	0	0	0	110.6	C223 P224 K225 R230 G231 L232 C243	C223-C227 HydrophobicContact CB-CB 4.21Å; P224-C227 WeakPolarHBondContact O-CB 3.39Å; P224-C227 PolarHBondContact O-N 2.73Å; K225-C227 PolarHBondContact O-N 2.91Å; C227-R230 CarbonylContact O-C 3.58Å; C227-R230 PolarHBondContact O-N 2.88Å; C227-R230 VanDerWaalsContact O-N 3.11Å; C227-G231 PolarHBondContact O-N 2.81Å; C227-G231 VanDerWaalsContact O-N 3.09Å; C227-L232 HydrophobicContact CB-CB 4.2Å; C227-L232 PolarHBondContact O-N 3.44Å; C227-C243 WeakPolarHBondContact CA-SG 3.5Å; C227-C243 HydrophobicContact CB-CB 3.83Å; C227-C243 WeakPolarHBondContact CB-SG 3.47Å; C227-C243 PolarHBondContact N-SG 2.81Å; C227-C243 VanDerWaalsContact N-SG 3.45Å; C227-C243 WeakPolarHBondContact SG-CA 3.07Å; C227-C243 WeakPolarHBondContact SG-CB 3.43Å; C227-C243 PolarHBondContact SG-N 2.86Å; C227-C243 CovalentContact SG-SG 2.04Å; C227-C243 PolarHBondContact SG-SG 3.4Å
228	T	83	Confident	86	Confident	89 Å²	89	55.3 Å²	55.3	55%	0.546	30%	0.296	S	S	.	.	H	α-helix	trans	-61.1	-47.1	-177.2	-52.6	0	0	0	0	112	C223 P224 K225 R230 G231	C223-T228 PolarHBondContact O-OG1 2.98Å; P224-T228 PolarHBondContact O-N 2.94Å; P224-T228 VanDerWaalsContact O-N 3.07Å; P224-T228 PolarHBondContact O-OG1 3.17Å; P224-T228 VanDerWaalsContact O-OG1 3.06Å; K225-T228 PolarHBondContact O-N 3.39Å; T228-R230 PolarHBondContact O-N 3.27Å; T228-G231 PolarHBondContact O-N 3.42Å
229	E	83.9	Confident	85.2	Confident	153 Å²	153	59.7 Å²	59.7	72%	0.715	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-21.5	176.9	-69.7	165.7	-163.9	0	0	112.7	K225	K225-E229 WeakPolarHBondContact O-CB 3.47Å; K225-E229 WeakPolarHBondContact O-CG 3.49Å; K225-E229 PolarHBondContact O-N 2.67Å
230	R	86.3	Confident	84.7	Confident	170 Å²	170	64.4 Å²	64.4	64%	0.642	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	1.7	176	-65.8	174.7	64.6	-159.9	-0.7	113.5	E226 C227 T228 L232	E226-R230 WeakPolarHBondContact O-CD 3.35Å; E226-R230 VanDerWaalsContact O-CG 3.28Å; E226-R230 WeakPolarHBondContact O-CG 2.95Å; C227-R230 CarbonylContact O-C 3.58Å; C227-R230 PolarHBondContact O-N 2.88Å; C227-R230 VanDerWaalsContact O-N 3.11Å; T228-R230 PolarHBondContact O-N 3.27Å; R230-L232 HydrophobicContact CB-CD1 3.86Å; R230-L232 HydrophobicContact CB-CG 3.81Å; R230-L232 PolarHBondContact O-N 2.87Å
231	G	85.1	Confident	84.3	Confident	47 Å²	47	66 Å²	66	49%	0.485	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	15.9	-175.7	0	0	0	0	0	115	C227 T228	C227-G231 PolarHBondContact O-N 2.81Å; C227-G231 VanDerWaalsContact O-N 3.09Å; T228-G231 PolarHBondContact O-N 3.42Å
232	L	89	Confident	84.3	Confident	25 Å²	25	67.3 Å²	67.3	13%	0.131	35%	0.353	C	S	.	.			trans	-89.7	143.7	-174.2	-61.4	176.5	0	0	0	112.2	C227 R230 C243 P246	C227-L232 HydrophobicContact CB-CB 4.2Å; C227-L232 PolarHBondContact O-N 3.44Å; R230-L232 HydrophobicContact CB-CD1 3.86Å; R230-L232 HydrophobicContact CB-CG 3.81Å; R230-L232 PolarHBondContact O-N 2.87Å; L232-C243 HydrophobicContact CB-CB 4.46Å; L232-C243 HydrophobicContact CD1-CB 4.08Å; L232-P246 HydrophobicContact CD2-CB 3.81Å; L232-P246 HydrophobicContact CD2-CG 3.94Å
233	A	90	Very high	84.7	Confident	16 Å²	16	67.6 Å²	67.6	13%	0.132	35%	0.353	C	S	.	.			trans	-68.1	165.6	164.3	0	0	0	0	0	111.6	C244	A233-C244 HydrophobicContact CB-CB 4.27Å; A233-C244 WeakPolarHBondContact O-CB 3.33Å; A233-C244 PolarHBondContact O-N 2.73Å
234	C	91.1	Very high	85	Confident	2 Å²	2	66 Å²	66	1%	0.014	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-132.7	160.3	178.5	60.7	0	0	0	0	112.5	C223 F242 C244 G251	C223-C234 WeakPolarHBondContact CA-SG 3.29Å; C223-C234 HydrophobicContact CB-CB 3.67Å; C223-C234 WeakPolarHBondContact CB-SG 3.3Å; C223-C234 WeakPolarHBondContact SG-CB 3.34Å; C223-C234 PolarHBondContact SG-N 3.47Å; C223-C234 VanDerWaalsContact SG-N 3.44Å; C223-C234 CovalentContact SG-SG 2.04Å; C223-C234 PolarHBondContact SG-SG 2.69Å; C234-F242 CarbonylContact C-O 3.55Å; C234-F242 VanDerWaalsContact CA-O 3.24Å; C234-F242 WeakPolarHBondContact CA-O 3.36Å; C234-F242 WeakPolarHBondContact CB-O 3.45Å; C234-C244 WeakPolarHBondContact CA-SG 3.25Å; C234-G251 WeakPolarHBondContact O-CA 3.03Å
235	N	89.3	Confident	85.4	Confident	0 Å²	0	68 Å²	68	0%	0	35%	0.35	C	S	.	.			trans	-72.3	128	165.6	-174	-34.7	0	0	0	109	T237 M238 W241 F242 C252 T253	N235-T237 WeakPolarHBondContact OD1-CA 3.47Å; N235-T237 PolarHBondContact OD1-N 3.31Å; N235-T237 PolarHBondContact OD1-OG1 2.88Å; N235-M238 PolarHBondContact OD1-N 3.21Å; N235-W241 WeakPolarHBondContact O-CB 3.26Å; N235-F242 HydrophobicContact CB-CD1 4.04Å; N235-F242 HydrophobicContact CB-CD2 4.26Å; N235-F242 HydrophobicContact CB-CE1 3.65Å; N235-F242 HydrophobicContact CB-CE2 3.87Å; N235-F242 HydrophobicContact CB-CG 4.34Å; N235-F242 HydrophobicContact CB-CZ 3.56Å; N235-F242 PolarHBondContact N-O 3.41Å; N235-F242 VanDerWaalsContact ND2-CE1 3.33Å; N235-F242 WeakPolarHBondContact ND2-CE1 3.39Å; N235-F242 WeakPolarHBondContact ND2-CZ 3.39Å; N235-C252 VanDerWaalsContact CG-O 3.27Å; N235-C252 PolarHBondContact ND2-O 3.1Å; N235-T253 PolarHBondContact ND2-O 2.89Å
236	T	78.5	Confident	85.8	Confident	20 Å²	20	63.5 Å²	63.5	12%	0.123	34%	0.336	C	S	.	.	S	Bend	trans	-113.3	17.7	-178.8	71.8	0	0	0	0	112.6	R111 W241	R111-T236 PolarHBondContact NH1-OG1 3.31Å; R111-T236 PolarHBondContact NH2-OG1 2.79Å; T236-W241 HydrophobicContact CG2-CZ3 4.31Å
237	T	76.6	Confident	86.1	Confident	75 Å²	75	59.4 Å²	59.4	46%	0.46	32%	0.317	S	S	.	.	S	Bend	trans	-133.8	-17.8	-167.8	62.6	0	0	0	0	114.3	N235 Y261	N235-T237 WeakPolarHBondContact OD1-CA 3.47Å; N235-T237 PolarHBondContact OD1-N 3.31Å; N235-T237 PolarHBondContact OD1-OG1 2.88Å; T237-Y261 WeakPolarHBondContact CG2-OH 3.4Å
238	M	73.5	Confident	86.3	Confident	109 Å²	109	59.7 Å²	59.7	54%	0.537	32%	0.319	S	S	.	.	S	Bend	trans	-128.2	129.9	178.4	-62.7	-177.4	69.4	0	0	110	N235 P240 W241	N235-M238 PolarHBondContact OD1-N 3.21Å; M238-P240 CarbonylContact O-C 3.59Å; M238-W241 VanDerWaalsContact O-CD1 3.26Å; M238-W241 PolarHBondContact O-N 3.35Å
239	E	72	Confident	86.6	Confident	140 Å²	140	55.4 Å²	55.4	65%	0.654	29%	0.293	S	S	*	.	S	Bend	trans	-94.2	138.3	170.5	-75.8	-173.9	-179.3	0	0	111	F196	F196-E239 HydrophobicContact CE2-CG 4.2Å
240	P	78.1	Confident	86.7	Confident	111 Å²	111	48.4 Å²	48.4	72%	0.721	26%	0.261	S	S	*	.	S	Bend	cis	-72.3	140.3	-2.2	31.1	-35.5	0	0	0	112.8	M238	M238-P240 CarbonylContact O-C 3.59Å
241	W	82.7	Confident	86.9	Confident	36 Å²	36	40.3 Å²	40.3	14%	0.136	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-67.6	138.9	179.2	-64.3	18.8	0	0	0	110.1	F196 T221 A222 P224 N235 T236 M238	F196-W241 HydrophobicContact CB-CD2 3.9Å; F196-W241 HydrophobicContact CB-CE3 3.7Å; F196-W241 HydrophobicContact CB-CH2 3.37Å; F196-W241 HydrophobicContact CB-CZ2 3.59Å; F196-W241 HydrophobicContact CB-CZ3 3.45Å; F196-W241 VanDerWaalsContact CB-CZ3 3.45Å; F196-W241 HydrophobicContact CD1-CB 4.41Å; F196-W241 AromaticContact CD1-CD2 3.94Å; F196-W241 HydrophobicContact CD1-CD2 3.94Å; F196-W241 HydrophobicContact CD1-CE3 4.02Å; F196-W241 HydrophobicContact CD1-CG 4.16Å; F196-W241 AromaticContact CD2-CD2 3.92Å; F196-W241 HydrophobicContact CD2-CD2 3.92Å; F196-W241 AromaticContact CD2-CE2 3.64Å; F196-W241 HydrophobicContact CD2-CG 4.16Å; F196-W241 HydrophobicContact CD2-CZ2 4.04Å; F196-W241 AromaticContact CD2-NE1 3.73Å; F196-W241 HydrophobicContact CE1-CB 4.12Å; F196-W241 HydrophobicContact CE1-CD2 4.43Å; F196-W241 HydrophobicContact CE1-CG 4.16Å; F196-W241 AromaticContact CE2-CD1 3.96Å; F196-W241 HydrophobicContact CE2-CD2 4.4Å; F196-W241 HydrophobicContact CE2-CG 4.16Å; F196-W241 AromaticContact CE2-NE1 3.97Å; F196-W241 AromaticContact CG-CD2 3.67Å; F196-W241 HydrophobicContact CG-CD2 3.67Å; F196-W241 AromaticContact CG-CE2 3.76Å; F196-W241 AromaticContact CG-CE3 3.87Å; F196-W241 HydrophobicContact CG-CE3 3.87Å; F196-W241 HydrophobicContact CG-CG 4.16Å; F196-W241 HydrophobicContact CG-CH2 4.21Å; F196-W241 HydrophobicContact CG-CZ2 4.03Å; F196-W241 HydrophobicContact CG-CZ3 4.15Å; F196-W241 HydrophobicContact CZ-CB 4.32Å; F196-W241 HydrophobicContact CZ-CG 4.16Å; T221-W241 HydrophobicContact CG2-CH2 3.77Å; T221-W241 HydrophobicContact CG2-CZ3 4.45Å; A222-W241 VanDerWaalsContact O-CZ3 3.26Å; A222-W241 WeakPolarHBondContact O-CZ3 3.5Å; P224-W241 HydrophobicContact CG-CB 4.14Å; N235-W241 WeakPolarHBondContact O-CB 3.26Å; T236-W241 HydrophobicContact CG2-CZ3 4.31Å; M238-W241 VanDerWaalsContact O-CD1 3.26Å; M238-W241 PolarHBondContact O-N 3.35Å
242	F	90	Very high	87.3	Confident	62 Å²	62	38.1 Å²	38.1	27%	0.272	21%	0.208	S	C	.	.			trans	-133.1	159.2	-176.9	59.6	-95.1	0	0	0	111.6	C234 N235 G254 P255	C234-F242 CarbonylContact C-O 3.55Å; C234-F242 VanDerWaalsContact CA-O 3.24Å; C234-F242 WeakPolarHBondContact CA-O 3.36Å; C234-F242 WeakPolarHBondContact CB-O 3.45Å; N235-F242 HydrophobicContact CB-CD1 4.04Å; N235-F242 HydrophobicContact CB-CD2 4.26Å; N235-F242 HydrophobicContact CB-CE1 3.65Å; N235-F242 HydrophobicContact CB-CE2 3.87Å; N235-F242 HydrophobicContact CB-CG 4.34Å; N235-F242 HydrophobicContact CB-CZ 3.56Å; N235-F242 PolarHBondContact N-O 3.41Å; N235-F242 VanDerWaalsContact ND2-CE1 3.33Å; N235-F242 WeakPolarHBondContact ND2-CE1 3.39Å; N235-F242 WeakPolarHBondContact ND2-CZ 3.39Å; F242-G254 VanDerWaalsContact CE2-C 3.47Å; F242-P255 HydrophobicContact CE2-CB 4.24Å
243	C	93	Very high	87.4	Confident	35 Å²	35	40.3 Å²	40.3	24%	0.236	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-74.9	133.7	176.1	-46.9	0	0	0	0	110.9	C227 L232	C227-C243 WeakPolarHBondContact CA-SG 3.5Å; C227-C243 HydrophobicContact CB-CB 3.83Å; C227-C243 WeakPolarHBondContact CB-SG 3.47Å; C227-C243 PolarHBondContact N-SG 2.81Å; C227-C243 VanDerWaalsContact N-SG 3.45Å; C227-C243 WeakPolarHBondContact SG-CA 3.07Å; C227-C243 WeakPolarHBondContact SG-CB 3.43Å; C227-C243 PolarHBondContact SG-N 2.86Å; C227-C243 CovalentContact SG-SG 2.04Å; C227-C243 PolarHBondContact SG-SG 3.4Å; L232-C243 HydrophobicContact CB-CB 4.46Å; L232-C243 HydrophobicContact CD1-CB 4.08Å
244	C	94.2	Very high	87.4	Confident	5 Å²	5	40 Å²	40	3%	0.034	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-69.1	166.5	177.1	-59.9	0	0	0	0	112.4	A233 C234 C248 C252	A233-C244 HydrophobicContact CB-CB 4.27Å; A233-C244 WeakPolarHBondContact O-CB 3.33Å; A233-C244 PolarHBondContact O-N 2.73Å; C234-C244 WeakPolarHBondContact CA-SG 3.25Å; C244-C248 HydrophobicContact CB-CB 3.76Å; C244-C252 WeakPolarHBondContact CA-SG 3.43Å; C244-C252 HydrophobicContact CB-CB 3.74Å; C244-C252 WeakPolarHBondContact CB-SG 3.23Å; C244-C252 WeakPolarHBondContact SG-CB 3.26Å; C244-C252 PolarHBondContact SG-N 2.96Å; C244-C252 CovalentContact SG-SG 2.03Å; C244-C252 PolarHBondContact SG-SG 3.17Å
245	H	94.6	Very high	87.4	Confident	63 Å²	63	43.3 Å²	43.3	29%	0.292	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-54.1	140.2	168.3	-172	-107.7	0	0	0	110.8	M247 C248 D257	H245-M247 PolarHBondContact ND1-N 2.99Å; H245-M247 PolarHBondContact O-N 3.48Å; H245-C248 WeakPolarHBondContact O-CB 3.49Å; H245-C248 PolarHBondContact O-N 3.01Å; H245-C248 PolarHBondContact O-SG 2.8Å; H245-D257 WeakPolarHBondContact ND1-CB 3.17Å
246	P	93.7	Very high	87.6	Confident	57 Å²	57	48.7 Å²	48.7	37%	0.37	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-4.7	-176.3	-26.8	36.3	0	0	0	116.8	L232 Q264	L232-P246 HydrophobicContact CD2-CB 3.81Å; L232-P246 HydrophobicContact CD2-CG 3.94Å; P246-Q264 PolarHBondContact O-OE1 3.4Å; P246-Q264 VanDerWaalsContact O-OE1 3.13Å
247	M	93.6	Very high	88.2	Confident	32 Å²	32	49 Å²	49	16%	0.158	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	0.2	172.8	-55	-73.1	84.5	0	0	113.2	H245 C263 Q264 C272 K274	H245-M247 PolarHBondContact ND1-N 2.99Å; H245-M247 PolarHBondContact O-N 3.48Å; M247-C263 CarbonylContact O-C 3.56Å; M247-C263 WeakPolarHBondContact O-CA 3.45Å; M247-Q264 PolarHBondContact O-N 3.22Å; M247-C272 HydrophobicContact CB-CB 3.77Å; M247-C272 VanDerWaalsContact CB-O 3.25Å; M247-C272 WeakPolarHBondContact CB-O 3.35Å; M247-C272 WeakPolarHBondContact CG-O 3.35Å; M247-K274 HydrophobicContact SD-CB 3.63Å; M247-K274 HydrophobicContact SD-CG 4.33Å; M247-K274 PolarHBondContact SD-N 3.16Å
248	C	93.8	Very high	89	Confident	6 Å²	6	49 Å²	49	4%	0.041	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	149.6	177.4	-55.7	0	0	0	0	112.9	C244 H245 C260 A262	C244-C248 HydrophobicContact CB-CB 3.76Å; H245-C248 WeakPolarHBondContact O-CB 3.49Å; H245-C248 PolarHBondContact O-N 3.01Å; H245-C248 PolarHBondContact O-SG 2.8Å; C248-C260 WeakPolarHBondContact CA-SG 3.37Å; C248-C260 HydrophobicContact CB-CB 3.58Å; C248-C260 WeakPolarHBondContact CB-SG 3.39Å; C248-C260 VanDerWaalsContact SG-CA 3.51Å; C248-C260 WeakPolarHBondContact SG-CB 3.19Å; C248-C260 CovalentContact SG-SG 2.03Å; C248-C260 PolarHBondContact SG-SG 3.41Å; C248-A262 CarbonylContact C-O 3.52Å; C248-A262 WeakPolarHBondContact CA-O 3.34Å
249	A	90.4	Very high	89.9	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	152.9	168	0	0	0	0	0	109.9	I112 G251 A262 Q264	I112-A249 HydrophobicContact CD1-CB 3.67Å; A249-G251 PolarHBondContact O-N 3.09Å; A249-G251 VanDerWaalsContact O-N 3.1Å; A249-A262 PolarHBondContact N-O 2.97Å; A249-A262 PolarHBondContact O-N 3.16Å; A249-Q264 HydrophobicContact CB-CB 4.47Å
250	G	86.3	Confident	90.9	Very high	5 Å²	5	39.4 Å²	39.4	5%	0.052	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	66.3	4.9	-178.9	0	0	0	0	0	116.3	R111	R111-G250 WeakPolarHBondContact CD-O 3.41Å; R111-G250 PolarHBondContact NH1-O 2.71Å
251	G	90.6	Very high	91.5	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	108.9	-170	178.4	0	0	0	0	0	114.4	C234 A249 Y261	C234-G251 WeakPolarHBondContact O-CA 3.03Å; A249-G251 PolarHBondContact O-N 3.09Å; A249-G251 VanDerWaalsContact O-N 3.1Å; G251-Y261 PolarHBondContact O-N 2.86Å
252	C	92.8	Very high	91.9	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	162	-176.8	54.4	0	0	0	0	111.3	N235 C244 G254 D259 Y261	N235-C252 VanDerWaalsContact CG-O 3.27Å; N235-C252 PolarHBondContact ND2-O 3.1Å; C244-C252 WeakPolarHBondContact CA-SG 3.43Å; C244-C252 HydrophobicContact CB-CB 3.74Å; C244-C252 WeakPolarHBondContact CB-SG 3.23Å; C244-C252 WeakPolarHBondContact SG-CB 3.26Å; C244-C252 PolarHBondContact SG-N 2.96Å; C244-C252 CovalentContact SG-SG 2.03Å; C244-C252 PolarHBondContact SG-SG 3.17Å; C252-G254 WeakPolarHBondContact CB-O 3.49Å; C252-G254 PolarHBondContact SG-O 2.84Å; C252-D259 CarbonylContact C-O 3.56Å; C252-D259 WeakPolarHBondContact CA-O 3.45Å; C252-D259 VanDerWaalsContact CB-O 3.24Å; C252-D259 WeakPolarHBondContact CB-O 3.41Å; C252-Y261 VanDerWaalsContact N-CD2 3.33Å
253	T	91.2	Very high	92	Very high	71 Å²	71	32.5 Å²	32.5	44%	0.436	19%	0.187	S	C	.	.	S	Bend	trans	-90.4	-23.2	168.7	53.3	0	0	0	0	112.8	N235 D259 Y261	N235-T253 PolarHBondContact ND2-O 2.89Å; T253-D259 PolarHBondContact N-O 3.25Å; T253-D259 PolarHBondContact OG1-O 2.86Å; T253-Y261 HydrophobicContact CG2-CE1 3.68Å
254	G	90.4	Very high	91.8	Very high	9 Å²	9	34.3 Å²	34.3	9%	0.093	19%	0.192	C	C	.	.	S	Bend	trans	-151	174.3	-172.3	0	0	0	0	0	111.7	F242 C252 D259	F242-G254 VanDerWaalsContact CE2-C 3.47Å; C252-G254 WeakPolarHBondContact CB-O 3.49Å; C252-G254 PolarHBondContact SG-O 2.84Å; G254-D259 VanDerWaalsContact CA-CB 3.5Å; G254-D259 WeakPolarHBondContact CA-OD2 3.41Å; G254-D259 WeakPolarHBondContact O-CB 3.29Å
255	P	90	Very high	91.6	Very high	72 Å²	72	36.6 Å²	36.6	47%	0.468	20%	0.202	S	C	.	.	S	Bend	trans	-84	-6.5	-172.4	34.5	-36	0	0	0	114.7	F242 D259	F242-P255 HydrophobicContact CE2-CB 4.24Å; P255-D259 WeakPolarHBondContact CD-OD2 3.49Å
256	H	92.8	Very high	91.5	Very high	113 Å²	113	33.6 Å²	33.6	52%	0.523	19%	0.188	S	C	.	.	S	Bend	trans	-95.3	169.4	-173	-56.8	-70.1	0	0	0	113.3	T258 D259	H256-T258 WeakPolarHBondContact CB-OG1 3.44Å; H256-T258 PolarHBondContact O-N 3.19Å; H256-D259 WeakPolarHBondContact CB-OD2 3.41Å; H256-D259 IonicContact CD2-OD2 3.17Å; H256-D259 PolarHBondContact CD2-OD2 3.14Å; H256-D259 IonicContact CG-OD2 2.78Å; H256-D259 PolarHBondContact N-OD2 3.27Å; H256-D259 PolarHBondContact O-N 2.97Å; H256-D259 VanDerWaalsContact O-N 3.12Å
257	D	92.3	Very high	91.4	Very high	26 Å²	26	34.5 Å²	34.5	14%	0.139	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-12.5	177.4	67.8	-29.4	0	0	0	113.7	H245 R271 C272	H245-D257 WeakPolarHBondContact ND1-CB 3.17Å; D257-R271 CarbonylContact O-C 3.46Å; D257-R271 WeakPolarHBondContact O-CA 3.32Å; D257-R271 IonicContact OD1-CZ 3.03Å; D257-R271 IonicContact OD1-NE 3.17Å; D257-R271 IonicContact OD1-NH2 3.48Å; D257-R271 IonicContact OD2-CZ 3.37Å; D257-R271 IonicContact OD2-NE 3.22Å; D257-R271 PolarHBondContact OD2-NE 3.19Å; D257-R271 IonicContact OD2-NH2 2.7Å; D257-R271 PolarHBondContact OD2-NH2 3.03Å; D257-C272 PolarHBondContact O-N 2.04Å
258	T	93.2	Very high	91.3	Very high	76 Å²	76	35.9 Å²	35.9	47%	0.466	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-19.4	168.9	43.4	0	0	0	0	114.3	H256 G270 R271	H256-T258 WeakPolarHBondContact CB-OG1 3.44Å; H256-T258 PolarHBondContact O-N 3.19Å; T258-G270 WeakPolarHBondContact CA-O 3.41Å; T258-R271 HydrophobicContact CG2-CG 3.77Å
259	D	92.6	Very high	91	Very high	32 Å²	32	42.3 Å²	42.3	17%	0.171	22%	0.22	C	C	.	.	S	Bend	trans	-105.4	7	-158.5	-48.7	-22.2	0	0	0	113	C252 T253 G254 P255 H256	C252-D259 CarbonylContact C-O 3.56Å; C252-D259 WeakPolarHBondContact CA-O 3.45Å; C252-D259 VanDerWaalsContact CB-O 3.24Å; C252-D259 WeakPolarHBondContact CB-O 3.41Å; T253-D259 PolarHBondContact N-O 3.25Å; T253-D259 PolarHBondContact OG1-O 2.86Å; G254-D259 VanDerWaalsContact CA-CB 3.5Å; G254-D259 WeakPolarHBondContact CA-OD2 3.41Å; G254-D259 WeakPolarHBondContact O-CB 3.29Å; P255-D259 WeakPolarHBondContact CD-OD2 3.49Å; H256-D259 WeakPolarHBondContact CB-OD2 3.41Å; H256-D259 IonicContact CD2-OD2 3.17Å; H256-D259 PolarHBondContact CD2-OD2 3.14Å; H256-D259 IonicContact CG-OD2 2.78Å; H256-D259 PolarHBondContact N-OD2 3.27Å; H256-D259 PolarHBondContact O-N 2.97Å; H256-D259 VanDerWaalsContact O-N 3.12Å
260	C	92.5	Very high	90.8	Very high	15 Å²	15	43.8 Å²	43.8	10%	0.101	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	142.6	-175.2	-54	0	0	0	0	112.9	C248 A262 C272	C248-C260 WeakPolarHBondContact CA-SG 3.37Å; C248-C260 HydrophobicContact CB-CB 3.58Å; C248-C260 WeakPolarHBondContact CB-SG 3.39Å; C248-C260 VanDerWaalsContact SG-CA 3.51Å; C248-C260 WeakPolarHBondContact SG-CB 3.19Å; C248-C260 CovalentContact SG-SG 2.03Å; C248-C260 PolarHBondContact SG-SG 3.41Å; C260-A262 WeakPolarHBondContact CB-O 3.5Å; C260-C272 VanDerWaalsContact CB-SG 3.54Å
261	Y	90.6	Very high	91.1	Very high	44 Å²	44	49.3 Å²	49.3	17%	0.173	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	-41.5	167.9	-71.2	-53.5	0	0	0	111.7	R86 R111 T237 G251 C252 T253	R86-Y261 WeakPolarHBondContact CD-O 3.47Å; R86-Y261 PolarHBondContact NH1-O 3.15Å; R111-Y261 VanDerWaalsContact CZ-CD2 3.46Å; T237-Y261 WeakPolarHBondContact CG2-OH 3.4Å; G251-Y261 PolarHBondContact O-N 2.86Å; C252-Y261 VanDerWaalsContact N-CD2 3.33Å; T253-Y261 HydrophobicContact CG2-CE1 3.68Å
262	A	90.7	Very high	91.3	Very high	11 Å²	11	49.5 Å²	49.5	9%	0.091	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	163.3	167.6	0	0	0	0	0	110.2	I112 C248 A249 C260	I112-A262 HydrophobicContact CD1-CB 3.66Å; C248-A262 CarbonylContact C-O 3.52Å; C248-A262 WeakPolarHBondContact CA-O 3.34Å; A249-A262 PolarHBondContact N-O 2.97Å; A249-A262 PolarHBondContact O-N 3.16Å; C260-A262 WeakPolarHBondContact CB-O 3.5Å
263	C	92	Very high	91.3	Very high	10 Å²	10	51.2 Å²	51.2	7%	0.068	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	145.3	174.4	-52.9	0	0	0	0	111.2	R114 M247 H265 C272	R114-C263 PolarHBondContact NH2-O 3.06Å; M247-C263 CarbonylContact O-C 3.56Å; M247-C263 WeakPolarHBondContact O-CA 3.45Å; C263-H265 VanDerWaalsContact C-N 3.31Å; C263-H265 WeakPolarHBondContact CB-O 3.46Å; C263-C272 WeakPolarHBondContact CA-SG 3.4Å; C263-C272 HydrophobicContact CB-CB 3.68Å; C263-C272 WeakPolarHBondContact CB-SG 3.41Å; C263-C272 WeakPolarHBondContact SG-CA 3.36Å; C263-C272 WeakPolarHBondContact SG-CB 3.16Å; C263-C272 CovalentContact SG-SG 2.04Å; C263-C272 PolarHBondContact SG-SG 3.1Å
264	Q	90	Very high	91.4	Very high	73 Å²	73	54.8 Å²	54.8	34%	0.341	28%	0.275	S	S	.	.	S	Bend	trans	-71.7	-31.2	167.9	-172.1	175.2	19.9	0	0	111.5	P246 M247 A249	P246-Q264 PolarHBondContact O-OE1 3.4Å; P246-Q264 VanDerWaalsContact O-OE1 3.13Å; M247-Q264 PolarHBondContact O-N 3.22Å; A249-Q264 HydrophobicContact CB-CB 4.47Å
265	H	90.4	Very high	91.5	Very high	53 Å²	53	63.2 Å²	63.2	25%	0.245	30%	0.304	C	S	.	.	S	Bend	trans	-120.7	-119.8	173.4	-57.6	-61.2	0	0	0	109.2	C263 L273	C263-H265 VanDerWaalsContact C-N 3.31Å; C263-H265 WeakPolarHBondContact CB-O 3.46Å; H265-L273 WeakPolarHBondContact CB-O 3.23Å
266	V	91.3	Very high	91.7	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	140.2	-168.1	-65.1	0	0	0	0	114.8	L273 E282	V266-L273 HydrophobicContact CG2-CB 4.36Å; V266-L273 WeakPolarHBondContact CG2-O 3.32Å; V266-L273 PolarHBondContact N-O 2.99Å; V266-L273 VanDerWaalsContact N-O 3.11Å; V266-L273 PolarHBondContact O-N 3.27Å; V266-E282 HydrophobicContact CG1-CB 4.22Å; V266-E282 HydrophobicContact CG1-CG 3.94Å
267	H	91	Very high	91.7	Very high	75 Å²	75	58 Å²	58	35%	0.347	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	133.8	172.2	178.6	-97.7	0	0	0	112.1	G270 R271 R286 R287 C288	H267-G270 WeakPolarHBondContact NE2-CA 3.33Å; H267-R271 WeakPolarHBondContact CA-O 3.46Å; H267-R286 PolarHBondContact N-O 3.31Å; H267-R287 WeakPolarHBondContact O-CA 3.4Å; H267-C288 PolarHBondContact O-N 3.13Å
268	Y	91.7	Very high	91.6	Very high	62 Å²	62	64.2 Å²	64.2	24%	0.243	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	137.1	169.5	-174.5	-109.3	0	0	0	111.5	G270 R271 P277 L280 C288	Y268-G270 PolarHBondContact O-N 3.35Å; Y268-R271 PolarHBondContact N-O 3.45Å; Y268-R271 WeakPolarHBondContact O-CB 3.5Å; Y268-R271 PolarHBondContact O-N 2.6Å; Y268-P277 HydrophobicContact CD1-CG 3.97Å; Y268-P277 HydrophobicContact CE1-CG 4.27Å; Y268-L280 HydrophobicContact CD1-CD1 4.25Å; Y268-L280 HydrophobicContact CD2-CD1 3.91Å; Y268-L280 HydrophobicContact CE1-CD1 3.8Å; Y268-L280 HydrophobicContact CE2-CD1 3.39Å; Y268-L280 HydrophobicContact CG-CD1 4.3Å; Y268-C288 HydrophobicContact CD2-CB 3.62Å; Y268-C288 HydrophobicContact CG-CB 3.99Å
269	E	87.6	Confident	91.5	Very high	140 Å²	140	63.2 Å²	63.2	65%	0.654	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.4	37.3	177.7	-76.5	174.6	-171.8	0	0	114.9	R271	E269-R271 VanDerWaalsContact C-N 3.34Å
270	G	86.5	Confident	91.5	Very high	32 Å²	32	63.2 Å²	63.2	33%	0.33	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	6.6	-179.6	0	0	0	0	0	114.9	T258 H267 Y268	T258-G270 WeakPolarHBondContact CA-O 3.41Å; H267-G270 WeakPolarHBondContact NE2-CA 3.33Å; Y268-G270 PolarHBondContact O-N 3.35Å
271	R	92.8	Very high	91.6	Very high	120 Å²	120	62.8 Å²	62.8	45%	0.453	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	146	-177.3	-61	177.5	65.5	176.1	2.2	112	D257 T258 H267 Y268 E269 L273	D257-R271 CarbonylContact O-C 3.46Å; D257-R271 WeakPolarHBondContact O-CA 3.32Å; D257-R271 IonicContact OD1-CZ 3.03Å; D257-R271 IonicContact OD1-NE 3.17Å; D257-R271 IonicContact OD1-NH2 3.48Å; D257-R271 IonicContact OD2-CZ 3.37Å; D257-R271 IonicContact OD2-NE 3.22Å; D257-R271 PolarHBondContact OD2-NE 3.19Å; D257-R271 IonicContact OD2-NH2 2.7Å; D257-R271 PolarHBondContact OD2-NH2 3.03Å; T258-R271 HydrophobicContact CG2-CG 3.77Å; H267-R271 WeakPolarHBondContact CA-O 3.46Å; Y268-R271 PolarHBondContact N-O 3.45Å; Y268-R271 WeakPolarHBondContact O-CB 3.5Å; Y268-R271 PolarHBondContact O-N 2.6Å; E269-R271 VanDerWaalsContact C-N 3.34Å; R271-L273 HydrophobicContact CB-CD2 4.29Å
272	C	94.7	Very high	91.7	Very high	5 Å²	5	62.1 Å²	62.1	3%	0.034	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	114.6	170.8	-68.5	0	0	0	0	111.6	M247 D257 C260 C263	M247-C272 HydrophobicContact CB-CB 3.77Å; M247-C272 VanDerWaalsContact CB-O 3.25Å; M247-C272 WeakPolarHBondContact CB-O 3.35Å; M247-C272 WeakPolarHBondContact CG-O 3.35Å; D257-C272 PolarHBondContact O-N 2.04Å; C260-C272 VanDerWaalsContact CB-SG 3.54Å; C263-C272 WeakPolarHBondContact CA-SG 3.4Å; C263-C272 HydrophobicContact CB-CB 3.68Å; C263-C272 WeakPolarHBondContact CB-SG 3.41Å; C263-C272 WeakPolarHBondContact SG-CA 3.36Å; C263-C272 WeakPolarHBondContact SG-CB 3.16Å; C263-C272 CovalentContact SG-SG 2.04Å; C263-C272 PolarHBondContact SG-SG 3.1Å
273	L	93.9	Very high	91.6	Very high	37 Å²	37	61.7 Å²	61.7	19%	0.194	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	153.3	-175.4	-54.4	177.4	0	0	0	111	H265 V266 R271 R275 P277	H265-L273 WeakPolarHBondContact CB-O 3.23Å; V266-L273 HydrophobicContact CG2-CB 4.36Å; V266-L273 WeakPolarHBondContact CG2-O 3.32Å; V266-L273 PolarHBondContact N-O 2.99Å; V266-L273 VanDerWaalsContact N-O 3.11Å; V266-L273 PolarHBondContact O-N 3.27Å; R271-L273 HydrophobicContact CB-CD2 4.29Å; L273-R275 VanDerWaalsContact C-N 3.33Å; L273-R275 WeakPolarHBondContact CB-O 3.38Å; L273-P277 HydrophobicContact CD1-CG 4.1Å
274	K	93.1	Very high	91	Very high	146 Å²	146	65.3 Å²	65.3	64%	0.635	34%	0.339	S	S	*	.	S	Bend	trans	-69.6	-31.4	176.6	-169.5	171.2	-178.5	175.4	0	113.1	M247	M247-K274 HydrophobicContact SD-CB 3.63Å; M247-K274 HydrophobicContact SD-CG 4.33Å; M247-K274 PolarHBondContact SD-N 3.16Å
275	R	92.7	Very high	90.6	Very high	185 Å²	185	66.3 Å²	66.3	70%	0.698	35%	0.347	S	S	*	.	S	Bend	trans	-150.7	164.6	177.5	-72.2	-168.1	174.2	174.6	-5.7	109.8	L273 E282	L273-R275 VanDerWaalsContact C-N 3.33Å; L273-R275 WeakPolarHBondContact CB-O 3.38Å; R275-E282 WeakPolarHBondContact CA-OE1 3.39Å; R275-E282 VanDerWaalsContact CB-OE1 3.29Å; R275-E282 WeakPolarHBondContact CB-OE1 3.38Å; R275-E282 WeakPolarHBondContact CG-OE1 3.36Å
276	C	93.6	Very high	90.5	Very high	22 Å²	22	65.2 Å²	65.2	15%	0.149	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-69.8	150.4	175.5	-67.9	0	0	0	0	113.9	L280 E282 C288	C276-L280 HydrophobicContact CB-CB 4.09Å; C276-E282 HydrophobicContact CB-CG 4.07Å; C276-E282 PolarHBondContact N-OE1 3.46Å; C276-E282 WeakPolarHBondContact SG-CG 3.44Å; C276-C288 WeakPolarHBondContact CA-SG 3.2Å; C276-C288 HydrophobicContact CB-CB 3.93Å; C276-C288 WeakPolarHBondContact CB-SG 3.26Å; C276-C288 WeakPolarHBondContact SG-CA 3.02Å; C276-C288 WeakPolarHBondContact SG-CB 3.45Å; C276-C288 CovalentContact SG-SG 2.02Å; C276-C288 PolarHBondContact SG-SG 3.41Å
277	P	93.1	Very high	90.4	Very high	53 Å²	53	66.8 Å²	66.8	34%	0.344	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-57.8	152.5	166.6	-22.7	32.9	0	0	0	112.6	Y268 L273 G279 L280	Y268-P277 HydrophobicContact CD1-CG 3.97Å; Y268-P277 HydrophobicContact CE1-CG 4.27Å; L273-P277 HydrophobicContact CD1-CG 4.1Å; P277-G279 PolarHBondContact O-N 2.87Å; P277-L280 HydrophobicContact CB-CD1 4.16Å; P277-L280 HydrophobicContact CG-CD1 4.1Å; P277-L280 WeakPolarHBondContact O-CB 3.47Å; P277-L280 PolarHBondContact O-N 3.41Å
278	V	90.7	Very high	90.5	Very high	158 Å²	158	63.8 Å²	63.8	96%	0.958	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	128.6	-178.8	-177.9	0	0	0	0	110.9
279	G	89.5	Confident	90.5	Very high	55 Å²	55	61.1 Å²	61.1	57%	0.567	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.8	-7.7	-175.5	0	0	0	0	0	114.8	P277 Y281	P277-G279 PolarHBondContact O-N 2.87Å; G279-Y281 WeakPolarHBondContact O-CE2 3.46Å
280	L	94	Very high	90.8	Very high	32 Å²	32	56.1 Å²	56.1	17%	0.168	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	161	172.6	-59.7	174.3	0	0	0	111.1	Y268 C276 P277 C288 I289	Y268-L280 HydrophobicContact CD1-CD1 4.25Å; Y268-L280 HydrophobicContact CD2-CD1 3.91Å; Y268-L280 HydrophobicContact CE1-CD1 3.8Å; Y268-L280 HydrophobicContact CE2-CD1 3.39Å; Y268-L280 HydrophobicContact CG-CD1 4.3Å; C276-L280 HydrophobicContact CB-CB 4.09Å; P277-L280 HydrophobicContact CB-CD1 4.16Å; P277-L280 HydrophobicContact CG-CD1 4.1Å; P277-L280 WeakPolarHBondContact O-CB 3.47Å; P277-L280 PolarHBondContact O-N 3.41Å; L280-C288 HydrophobicContact CB-CB 4.34Å; L280-C288 HydrophobicContact CD1-CB 4.46Å; L280-I289 WeakPolarHBondContact CA-O 3.29Å
281	Y	93.5	Very high	91.1	Very high	6 Å²	6	60 Å²	60	2%	0.024	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	132.2	-168.8	-60.8	-102.1	0	0	0	110.8	G279 L283 C288 I289 R291 A313 E315 G318	G279-Y281 WeakPolarHBondContact O-CE2 3.46Å; Y281-L283 PolarHBondContact O-N 3.09Å; Y281-C288 WeakPolarHBondContact O-CA 3.46Å; Y281-I289 PolarHBondContact N-O 3.33Å; Y281-I289 PolarHBondContact O-N 3.06Å; Y281-R291 HydrophobicContact CD2-CB 4.28Å; Y281-R291 HydrophobicContact CE2-CB 3.58Å; Y281-R291 HydrophobicContact CE2-CG 3.95Å; Y281-R291 PolarHBondContact OH-NH1 3.47Å; Y281-A313 HydrophobicContact CD1-CB 3.89Å; Y281-A313 HydrophobicContact CE1-CB 3.67Å; Y281-A313 HydrophobicContact CG-CB 4.41Å; Y281-E315 HydrophobicContact CE1-CB 4.33Å; Y281-G318 CarbonylContact C-O 3.57Å; Y281-G318 WeakPolarHBondContact CA-O 3.34Å
282	E	92.6	Very high	91	Very high	29 Å²	29	60.9 Å²	60.9	14%	0.136	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	115.4	177.4	-62.4	-179.1	-170.4	0	0	110.5	V266 R275 C276 G318 V319 C320	V266-E282 HydrophobicContact CG1-CB 4.22Å; V266-E282 HydrophobicContact CG1-CG 3.94Å; R275-E282 WeakPolarHBondContact CA-OE1 3.39Å; R275-E282 VanDerWaalsContact CB-OE1 3.29Å; R275-E282 WeakPolarHBondContact CB-OE1 3.38Å; R275-E282 WeakPolarHBondContact CG-OE1 3.36Å; C276-E282 HydrophobicContact CB-CG 4.07Å; C276-E282 PolarHBondContact N-OE1 3.46Å; C276-E282 WeakPolarHBondContact SG-CG 3.44Å; E282-G318 PolarHBondContact N-O 3.38Å; E282-V319 HydrophobicContact CB-CG1 4.31Å; E282-C320 PolarHBondContact O-N 2.89Å
283	L	88.8	Confident	90.9	Very high	3 Å²	3	63.6 Å²	63.6	2%	0.016	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	126	170.6	-177.1	73.2	0	0	0	109.7	Y281 N285 R286 R287 I289 R297 Y311 C320	Y281-L283 PolarHBondContact O-N 3.09Å; L283-N285 PolarHBondContact O-N 3.46Å; L283-R286 PolarHBondContact O-N 3.07Å; L283-R287 HydrophobicContact CB-CG 4.37Å; L283-R287 PolarHBondContact N-O 3.31Å; L283-R287 PolarHBondContact O-N 3.47Å; L283-I289 HydrophobicContact CB-CD1 4.11Å; L283-I289 HydrophobicContact CB-CG1 4.29Å; L283-I289 HydrophobicContact CD1-CD1 4.41Å; L283-I289 HydrophobicContact CD2-CD1 4.29Å; L283-R297 VanDerWaalsContact CD2-CZ 3.42Å; L283-Y311 HydrophobicContact CD1-CD1 4.38Å; L283-Y311 HydrophobicContact CD1-CE1 3.93Å; L283-C320 HydrophobicContact CD1-CB 4.23Å
284	S	78.8	Confident	90.8	Very high	85 Å²	85	61.8 Å²	61.8	59%	0.594	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	26.8	173.9	-53.5	0	0	0	0	115.1	R286	S284-R286 PolarHBondContact O-N 3.02Å
285	N	83.1	Confident	90.7	Very high	95 Å²	95	57.2 Å²	57.2	51%	0.508	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	34.7	-172.6	-175.1	43.7	0	0	0	113	L283	L283-N285 PolarHBondContact O-N 3.46Å
286	R	86.7	Confident	90.5	Very high	30 Å²	30	52.3 Å²	52.3	11%	0.113	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.6	-31.9	-174.4	-156.6	-174.4	76.6	77	-0.4	114.5	E59 E87 H267 L283 S284	E59-R286 IonicContact OE1-CZ 2.82Å; E59-R286 VanDerWaalsContact OE1-CZ 3.25Å; E59-R286 IonicContact OE1-NE 3.38Å; E59-R286 PolarHBondContact OE1-NE 3.22Å; E59-R286 IonicContact OE1-NH2 3.51Å; E59-R286 PolarHBondContact OE1-NH2 2.91Å; E87-R286 IonicContact OE2-NH1 3.23Å; E87-R286 PolarHBondContact OE2-NH1 2.78Å; H267-R286 PolarHBondContact N-O 3.31Å; L283-R286 PolarHBondContact O-N 3.07Å; S284-R286 PolarHBondContact O-N 3.02Å
287	R	90.3	Very high	90.2	Very high	32 Å²	32	54.7 Å²	54.7	12%	0.121	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	152.4	-177.8	51.8	175	160.9	167.3	-5.8	113.1	E59 H267 L283	E59-R287 IonicContact OE1-CZ 2.72Å; E59-R287 IonicContact OE1-NE 2.78Å; E59-R287 PolarHBondContact OE1-NE 3.5Å; E59-R287 IonicContact OE1-NH2 3.56Å; E59-R287 PolarHBondContact OE1-NH2 2.85Å; E59-R287 IonicContact OE2-CZ 3.61Å; E59-R287 IonicContact OE2-NH2 2.93Å; E59-R287 PolarHBondContact OE2-NH2 3.3Å; H267-R287 WeakPolarHBondContact O-CA 3.4Å; L283-R287 HydrophobicContact CB-CG 4.37Å; L283-R287 PolarHBondContact N-O 3.31Å; L283-R287 PolarHBondContact O-N 3.47Å
288	C	93.4	Very high	89.6	Confident	12 Å²	12	54.8 Å²	54.8	8%	0.081	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	140.5	172.1	-58.8	0	0	0	0	111.6	H267 Y268 C276 L280 Y281	H267-C288 PolarHBondContact O-N 3.13Å; Y268-C288 HydrophobicContact CD2-CB 3.62Å; Y268-C288 HydrophobicContact CG-CB 3.99Å; C276-C288 WeakPolarHBondContact CA-SG 3.2Å; C276-C288 HydrophobicContact CB-CB 3.93Å; C276-C288 WeakPolarHBondContact CB-SG 3.26Å; C276-C288 WeakPolarHBondContact SG-CA 3.02Å; C276-C288 WeakPolarHBondContact SG-CB 3.45Å; C276-C288 CovalentContact SG-SG 2.02Å; C276-C288 PolarHBondContact SG-SG 3.41Å; L280-C288 HydrophobicContact CB-CB 4.34Å; L280-C288 HydrophobicContact CD1-CB 4.46Å; Y281-C288 WeakPolarHBondContact O-CA 3.46Å
289	I	91.8	Very high	89.3	Confident	6 Å²	6	50.4 Å²	50.4	3%	0.031	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	160.6	173.2	63.9	171.7	0	0	0	110.9	L280 Y281 L283 E293 C294 C320	L280-I289 WeakPolarHBondContact CA-O 3.29Å; Y281-I289 PolarHBondContact N-O 3.33Å; Y281-I289 PolarHBondContact O-N 3.06Å; L283-I289 HydrophobicContact CB-CD1 4.11Å; L283-I289 HydrophobicContact CB-CG1 4.29Å; L283-I289 HydrophobicContact CD1-CD1 4.41Å; L283-I289 HydrophobicContact CD2-CD1 4.29Å; I289-E293 HydrophobicContact CB-CB 4.16Å; I289-E293 HydrophobicContact CD1-CB 4.4Å; I289-C294 HydrophobicContact CD1-CB 3.85Å; I289-C294 HydrophobicContact CG1-CB 4.45Å; I289-C320 HydrophobicContact CD1-CB 4.04Å; I289-C320 HydrophobicContact CG1-CB 4.39Å
290	S	93.4	Very high	88.8	Confident	36 Å²	36	50.3 Å²	50.3	25%	0.252	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	161.7	174.1	66.9	0	0	0	0	113	Q292 E293 C294	S290-Q292 PolarHBondContact O-N 2.84Å; S290-E293 VanDerWaalsContact CB-OE2 3.27Å; S290-E293 WeakPolarHBondContact CB-OE2 3.02Å; S290-E293 PolarHBondContact N-OE2 2.8Å; S290-E293 PolarHBondContact O-N 3.07Å; S290-E293 VanDerWaalsContact OG-CG 3.28Å; S290-E293 WeakPolarHBondContact OG-CG 3.32Å; S290-E293 PolarHBondContact OG-N 3.48Å; S290-E293 PolarHBondContact OG-OE2 3.22Å; S290-C294 PolarHBondContact O-N 2.96Å
291	R	92.3	Very high	87.9	Confident	114 Å²	114	54.6 Å²	54.6	43%	0.43	30%	0.295	S	S	.	.	H	α-helix	trans	-53.5	-41.1	172.9	-160.7	-174.3	-163	124.4	9.4	111.8	Y281 C294 V295 A313 E315	Y281-R291 HydrophobicContact CD2-CB 4.28Å; Y281-R291 HydrophobicContact CE2-CB 3.58Å; Y281-R291 HydrophobicContact CE2-CG 3.95Å; Y281-R291 PolarHBondContact OH-NH1 3.47Å; R291-C294 PolarHBondContact O-N 3.39Å; R291-V295 WeakPolarHBondContact O-CB 3.26Å; R291-V295 WeakPolarHBondContact O-CG2 3.23Å; R291-V295 PolarHBondContact O-N 3.23Å; R291-A313 HydrophobicContact CG-CB 3.85Å; R291-E315 IonicContact CZ-OE2 2.74Å; R291-E315 VanDerWaalsContact CZ-OE2 3.23Å; R291-E315 IonicContact NH1-OE1 2.98Å; R291-E315 PolarHBondContact NH1-OE1 2.99Å; R291-E315 VanDerWaalsContact NH1-OE1 3.17Å; R291-E315 IonicContact NH1-OE2 3.73Å; R291-E315 PolarHBondContact NH1-OE2 2.93Å; R291-E315 IonicContact NH2-OE2 3.5Å; R291-E315 PolarHBondContact NH2-OE2 2.86Å
292	Q	91.9	Very high	86.2	Confident	138 Å²	138	54.7 Å²	54.7	65%	0.645	30%	0.296	S	S	*	.	H	α-helix	trans	-67	-47.6	-178.4	-172.7	65.7	11.1	0	0	111	S290 C294 V295 S296	S290-Q292 PolarHBondContact O-N 2.84Å; Q292-C294 VanDerWaalsContact C-N 3.26Å; Q292-C294 PolarHBondContact O-N 2.87Å; Q292-V295 PolarHBondContact O-N 2.87Å; Q292-S296 WeakPolarHBondContact O-CB 3.13Å; Q292-S296 PolarHBondContact O-N 2.76Å; Q292-S296 PolarHBondContact O-OG 3.24Å; Q292-S296 VanDerWaalsContact O-OG 3.05Å
293	E	91.5	Very high	84.3	Confident	61 Å²	61	62.8 Å²	62.8	29%	0.285	33%	0.334	S	S	.	.	H	α-helix	trans	-64.9	-27.7	176.2	-70.1	164.2	116.6	0	0	113.4	I289 S290 R297	I289-E293 HydrophobicContact CB-CB 4.16Å; I289-E293 HydrophobicContact CD1-CB 4.4Å; S290-E293 VanDerWaalsContact CB-OE2 3.27Å; S290-E293 WeakPolarHBondContact CB-OE2 3.02Å; S290-E293 PolarHBondContact N-OE2 2.8Å; S290-E293 PolarHBondContact O-N 3.07Å; S290-E293 VanDerWaalsContact OG-CG 3.28Å; S290-E293 WeakPolarHBondContact OG-CG 3.32Å; S290-E293 PolarHBondContact OG-N 3.48Å; S290-E293 PolarHBondContact OG-OE2 3.22Å; E293-R297 VanDerWaalsContact O-CD 3.26Å; E293-R297 WeakPolarHBondContact O-CD 3.48Å; E293-R297 VanDerWaalsContact O-CG 3.23Å; E293-R297 WeakPolarHBondContact O-CG 3.28Å; E293-R297 PolarHBondContact O-NE 2.78Å
294	C	92.1	Very high	82.2	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-68.1	-53.8	171.3	-176.5	0	0	0	0	110.4	I289 S290 R291 Q292 S296 R297 Y311 A313 C320	I289-C294 HydrophobicContact CD1-CB 3.85Å; I289-C294 HydrophobicContact CG1-CB 4.45Å; S290-C294 PolarHBondContact O-N 2.96Å; R291-C294 PolarHBondContact O-N 3.39Å; Q292-C294 VanDerWaalsContact C-N 3.26Å; Q292-C294 PolarHBondContact O-N 2.87Å; C294-S296 PolarHBondContact O-N 3.29Å; C294-R297 PolarHBondContact O-N 2.97Å; C294-Y311 WeakPolarHBondContact O-CB 3.33Å; C294-A313 HydrophobicContact CB-CB 4.06Å; C294-C320 VanDerWaalsContact CA-SG 3.54Å; C294-C320 HydrophobicContact CB-CB 3.85Å; C294-C320 WeakPolarHBondContact CB-SG 3.29Å; C294-C320 WeakPolarHBondContact SG-CB 3.36Å; C294-C320 CovalentContact SG-SG 2.03Å; C294-C320 PolarHBondContact SG-SG 2.03Å
295	V	90.2	Very high	80.8	Confident	50 Å²	50	66.4 Å²	66.4	30%	0.303	35%	0.352	S	S	.	.	H	α-helix	trans	-71.8	-28.3	-174.6	168.5	0	0	0	0	113.4	R291 Q292 A313	R291-V295 WeakPolarHBondContact O-CB 3.26Å; R291-V295 WeakPolarHBondContact O-CG2 3.23Å; R291-V295 PolarHBondContact O-N 3.23Å; Q292-V295 PolarHBondContact O-N 2.87Å; V295-A313 HydrophobicContact CG2-CB 4.21Å
296	S	88.6	Confident	79.8	Confident	81 Å²	81	63.6 Å²	63.6	57%	0.566	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	0.3	179.7	79	0	0	0	0	114.3	Q292 C294	Q292-S296 WeakPolarHBondContact O-CB 3.13Å; Q292-S296 PolarHBondContact O-N 2.76Å; Q292-S296 PolarHBondContact O-OG 3.24Å; Q292-S296 VanDerWaalsContact O-OG 3.05Å; C294-S296 PolarHBondContact O-N 3.29Å
297	R	87.9	Confident	79	Confident	72 Å²	72	66.6 Å²	66.6	27%	0.272	36%	0.364	S	S	.	.	S	Bend	trans	-65.7	146	173.3	-87.4	158.7	-177.9	-84.7	-8.8	110.8	L283 E293 C294 Y311	L283-R297 VanDerWaalsContact CD2-CZ 3.42Å; E293-R297 VanDerWaalsContact O-CD 3.26Å; E293-R297 WeakPolarHBondContact O-CD 3.48Å; E293-R297 VanDerWaalsContact O-CG 3.23Å; E293-R297 WeakPolarHBondContact O-CG 3.28Å; E293-R297 PolarHBondContact O-NE 2.78Å; C294-R297 PolarHBondContact O-N 2.97Å; R297-Y311 HydrophobicContact CB-CD2 3.35Å; R297-Y311 HydrophobicContact CB-CE2 3.66Å; R297-Y311 HydrophobicContact CB-CG 4Å; R297-Y311 HydrophobicContact CG-CD2 4.34Å; R297-Y311 HydrophobicContact CG-CE2 4.36Å
298	G	80.7	Confident	78.6	Confident	56 Å²	56	68.6 Å²	68.6	58%	0.577	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-58	148.7	177.4	0	0	0	0	0	111.9	V300	G298-V300 PolarHBondContact O-N 2.03Å
299	V	84.2	Confident	78.1	Confident	66 Å²	66	69.3 Å²	69.3	40%	0.4	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-59.6	129.3	171.7	-179.5	0	0	0	0	108.9	D308 Y310	V299-D308 HydrophobicContact CG1-CB 3.44Å; V299-D308 VanDerWaalsContact CG1-CB 3.44Å; V299-Y310 HydrophobicContact CG1-CE1 4.43Å; V299-Y310 HydrophobicContact CG2-CD1 3.85Å; V299-Y310 HydrophobicContact CG2-CE1 3.49Å; V299-Y310 VanDerWaalsContact CG2-CE1 3.49Å
300	V	80	Confident	77.9	Confident	52 Å²	52	71.7 Å²	71.7	32%	0.315	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	124.2	173.5	178.4	0	0	0	0	106.9	G298 L309 Y311 L322	G298-V300 PolarHBondContact O-N 2.03Å; V300-L309 HydrophobicContact CB-CB 4.48Å; V300-L309 PolarHBondContact N-O 3.01Å; V300-L309 WeakPolarHBondContact O-CA 3.4Å; V300-L309 VanDerWaalsContact O-CB 3.23Å; V300-L309 WeakPolarHBondContact O-CB 3.29Å; V300-L309 PolarHBondContact O-N 2.8Å; V300-Y311 HydrophobicContact CG2-CE2 3.74Å; V300-L322 HydrophobicContact CB-CD1 4.22Å; V300-L322 HydrophobicContact CB-CD2 4.15Å; V300-L322 HydrophobicContact CG1-CD1 4.27Å; V300-L322 HydrophobicContact CG2-CD1 4.19Å; V300-L322 HydrophobicContact CG2-CD2 4.03Å
301	K	73.7	Confident	77.8	Confident	122 Å²	122	72.1 Å²	72.1	53%	0.53	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	131.3	170.7	-72.8	-164	158.4	-64.1	0	109.6	E303 G306 D307 D308	K301-E303 PolarHBondContact O-N 2.81Å; K301-G306 PolarHBondContact NZ-O 3.37Å; K301-D307 CarbonylContact C-O 3.46Å; K301-D307 WeakPolarHBondContact CA-O 3.37Å; K301-D308 WeakPolarHBondContact CE-OD1 3.35Å; K301-D308 IonicContact NZ-OD1 2.69Å; K301-D308 PolarHBondContact NZ-OD1 3.22Å
302	D	58.7	Low	77.8	Confident	8 Å²	8	66.8 Å²	66.8	4%	0.043	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-62.6	126	170.8	-166.6	-73.1	0	0	0	109.1	V304 T305 G306 D307 L309 R323	D302-V304 PolarHBondContact O-N 3.02Å; D302-V304 WeakPolarHBondContact OD1-CB 3.31Å; D302-V304 PolarHBondContact OD1-N 2.72Å; D302-T305 PolarHBondContact OD1-N 3.17Å; D302-G306 VanDerWaalsContact O-CA 3.23Å; D302-G306 WeakPolarHBondContact O-CA 3.42Å; D302-G306 PolarHBondContact O-N 2.84Å; D302-D307 PolarHBondContact N-O 3.49Å; D302-L309 HydrophobicContact CB-CD1 3.99Å; D302-L309 HydrophobicContact CB-CD2 4.46Å; D302-L309 HydrophobicContact CB-CG 4.05Å; D302-R323 IonicContact OD2-CZ 3.82Å; D302-R323 IonicContact OD2-NH2 3.38Å; D302-R323 PolarHBondContact OD2-NH2 3.48Å
303	E	52.2	Low	77.8	Confident	200 Å²	200	61 Å²	61	94%	0.935	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-17.7	-175.9	-62	-168.7	151.4	0	0	113.1	K301	K301-E303 PolarHBondContact O-N 2.81Å
304	V	45	Very low	77.8	Confident	105 Å²	105	58.7 Å²	58.7	64%	0.636	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-48	-177.8	-174.1	0	0	0	0	111.3	D302 F350	D302-V304 PolarHBondContact O-N 3.02Å; D302-V304 WeakPolarHBondContact OD1-CB 3.31Å; D302-V304 PolarHBondContact OD1-N 2.72Å; V304-F350 HydrophobicContact CG1-CB 4.35Å
305	T	48.6	Very low	77.5	Confident	58 Å²	58	64.7 Å²	64.7	36%	0.356	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-22.6	-177.3	66.8	0	0	0	0	114.4	D302 D307 F350	D302-T305 PolarHBondContact OD1-N 3.17Å; T305-D307 WeakPolarHBondContact CB-OD2 3.26Å; T305-D307 PolarHBondContact O-N 2.91Å; T305-D307 VanDerWaalsContact OG1-CB 3.3Å; T305-D307 WeakPolarHBondContact OG1-CB 3.45Å; T305-D307 PolarHBondContact OG1-N 3.38Å; T305-D307 PolarHBondContact OG1-OD2 3.44Å; T305-F350 HydrophobicContact CG2-CD1 3.72Å; T305-F350 HydrophobicContact CG2-CE1 3.47Å; T305-F350 VanDerWaalsContact CG2-CE1 3.47Å; T305-F350 HydrophobicContact CG2-CZ 4.07Å
306	G	62.2	Low	77.3	Confident	36 Å²	36	65.8 Å²	65.8	37%	0.371	37%	0.373	S	S	.	.			trans	77.4	2.1	-170.3	0	0	0	0	0	114.6	K301 D302	K301-G306 PolarHBondContact NZ-O 3.37Å; D302-G306 VanDerWaalsContact O-CA 3.23Å; D302-G306 WeakPolarHBondContact O-CA 3.42Å; D302-G306 PolarHBondContact O-N 2.84Å
307	D	69.9	Low	77.1	Confident	94 Å²	94	66.5 Å²	66.5	50%	0.503	37%	0.368	S	S	.	.			trans	-64.3	153.3	177.7	-68.5	-46.3	0	0	0	111.9	K301 D302 T305 L309	K301-D307 CarbonylContact C-O 3.46Å; K301-D307 WeakPolarHBondContact CA-O 3.37Å; D302-D307 PolarHBondContact N-O 3.49Å; T305-D307 WeakPolarHBondContact CB-OD2 3.26Å; T305-D307 PolarHBondContact O-N 2.91Å; T305-D307 VanDerWaalsContact OG1-CB 3.3Å; T305-D307 WeakPolarHBondContact OG1-CB 3.45Å; T305-D307 PolarHBondContact OG1-N 3.38Å; T305-D307 PolarHBondContact OG1-OD2 3.44Å; D307-L309 PolarHBondContact O-N 3.17Å
308	D	81.6	Confident	77.1	Confident	73 Å²	73	64 Å²	64	39%	0.39	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	102	178.2	-77.2	-18	0	0	0	110.7	V299 K301 Y310	V299-D308 HydrophobicContact CG1-CB 3.44Å; V299-D308 VanDerWaalsContact CG1-CB 3.44Å; K301-D308 WeakPolarHBondContact CE-OD1 3.35Å; K301-D308 IonicContact NZ-OD1 2.69Å; K301-D308 PolarHBondContact NZ-OD1 3.22Å; D308-Y310 HydrophobicContact CB-CE2 3.96Å; D308-Y310 VanDerWaalsContact O-CD2 3.23Å; D308-Y310 WeakPolarHBondContact O-CD2 3.37Å; D308-Y310 WeakPolarHBondContact O-CE2 3.16Å
309	L	82.9	Confident	77.7	Confident	27 Å²	27	62.6 Å²	62.6	14%	0.141	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	130.9	172.4	-55.8	176.2	0	0	0	110.7	V300 D302 D307 L322	V300-L309 HydrophobicContact CB-CB 4.48Å; V300-L309 PolarHBondContact N-O 3.01Å; V300-L309 WeakPolarHBondContact O-CA 3.4Å; V300-L309 VanDerWaalsContact O-CB 3.23Å; V300-L309 WeakPolarHBondContact O-CB 3.29Å; V300-L309 PolarHBondContact O-N 2.8Å; D302-L309 HydrophobicContact CB-CD1 3.99Å; D302-L309 HydrophobicContact CB-CD2 4.46Å; D302-L309 HydrophobicContact CB-CG 4.05Å; D307-L309 PolarHBondContact O-N 3.17Å; L309-L322 HydrophobicContact CB-CD2 4.09Å
310	Y	89.3	Confident	78.1	Confident	57 Å²	57	59.6 Å²	59.6	22%	0.224	33%	0.326	C	S	.	.			trans	-109.3	139.3	177.7	-57	-90	0	0	0	110.9	V299 D308 K312 P335 R336	V299-Y310 HydrophobicContact CG1-CE1 4.43Å; V299-Y310 HydrophobicContact CG2-CD1 3.85Å; V299-Y310 HydrophobicContact CG2-CE1 3.49Å; V299-Y310 VanDerWaalsContact CG2-CE1 3.49Å; D308-Y310 HydrophobicContact CB-CE2 3.96Å; D308-Y310 VanDerWaalsContact O-CD2 3.23Å; D308-Y310 WeakPolarHBondContact O-CD2 3.37Å; D308-Y310 WeakPolarHBondContact O-CE2 3.16Å; Y310-K312 WeakPolarHBondContact O-CG 3.04Å; Y310-K312 PolarHBondContact O-NZ 2.73Å; Y310-P335 HydrophobicContact CD2-CB 3.85Å; Y310-P335 HydrophobicContact CD2-CG 4.08Å; Y310-P335 HydrophobicContact CE2-CB 4.28Å; Y310-P335 HydrophobicContact CE2-CG 4.19Å; Y310-R336 HydrophobicContact CD1-CG 4.49Å; Y310-R336 HydrophobicContact CG-CG 4.37Å
311	Y	90.8	Very high	78.5	Confident	44 Å²	44	58.8 Å²	58.8	17%	0.173	32%	0.321	C	S	.	.			trans	-68.1	135.7	170.5	-75	-85.5	0	0	0	111.2	L283 C294 R297 V300 L322	L283-Y311 HydrophobicContact CD1-CD1 4.38Å; L283-Y311 HydrophobicContact CD1-CE1 3.93Å; C294-Y311 WeakPolarHBondContact O-CB 3.33Å; R297-Y311 HydrophobicContact CB-CD2 3.35Å; R297-Y311 HydrophobicContact CB-CE2 3.66Å; R297-Y311 HydrophobicContact CB-CG 4Å; R297-Y311 HydrophobicContact CG-CD2 4.34Å; R297-Y311 HydrophobicContact CG-CE2 4.36Å; V300-Y311 HydrophobicContact CG2-CE2 3.74Å; Y311-L322 HydrophobicContact CD1-CD2 3.87Å; Y311-L322 HydrophobicContact CD1-CG 4.09Å; Y311-L322 HydrophobicContact CD2-CD2 3.69Å; Y311-L322 HydrophobicContact CE1-CD1 4.47Å; Y311-L322 HydrophobicContact CE1-CD2 3.86Å; Y311-L322 HydrophobicContact CE1-CG 3.84Å; Y311-L322 HydrophobicContact CE2-CD2 3.7Å; Y311-L322 HydrophobicContact CE2-CG 4.48Å; Y311-L322 HydrophobicContact CG-CD2 3.79Å
312	K	92.3	Very high	79.2	Confident	2 Å²	2	55 Å²	55	1%	0.009	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	123.9	-174.9	-50.6	-178.6	171.4	56.7	0	109.3	Y310 L314 C320 V321 L322 E330 P335 R336 C338	Y310-K312 WeakPolarHBondContact O-CG 3.04Å; Y310-K312 PolarHBondContact O-NZ 2.73Å; K312-L314 PolarHBondContact O-N 2.69Å; K312-C320 WeakPolarHBondContact O-CA 3.22Å; K312-V321 HydrophobicContact CB-CG2 4.49Å; K312-V321 PolarHBondContact N-O 3.44Å; K312-V321 PolarHBondContact O-N 3.05Å; K312-L322 PolarHBondContact NZ-O 2.77Å; K312-E330 WeakPolarHBondContact CE-OE1 3.47Å; K312-E330 VanDerWaalsContact NZ-CD 3.31Å; K312-E330 IonicContact NZ-OE1 3.17Å; K312-E330 PolarHBondContact NZ-OE1 3.01Å; K312-E330 IonicContact NZ-OE2 2.72Å; K312-P335 WeakPolarHBondContact CE-O 3.03Å; K312-P335 PolarHBondContact NZ-O 2.91Å; K312-P335 VanDerWaalsContact NZ-O 3.1Å; K312-R336 WeakPolarHBondContact CA-O 3.38Å; K312-R336 WeakPolarHBondContact CB-O 3.34Å; K312-C338 VanDerWaalsContact CD-SG 3.5Å
313	A	92.4	Very high	80.4	Confident	16 Å²	16	60.4 Å²	60.4	13%	0.132	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	94.4	178.2	0	0	0	0	0	109.6	Y281 R291 C294 V295 E315	Y281-A313 HydrophobicContact CD1-CB 3.89Å; Y281-A313 HydrophobicContact CE1-CB 3.67Å; Y281-A313 HydrophobicContact CG-CB 4.41Å; R291-A313 HydrophobicContact CG-CB 3.85Å; C294-A313 HydrophobicContact CB-CB 4.06Å; V295-A313 HydrophobicContact CG2-CB 4.21Å; A313-E315 PolarHBondContact O-N 3.05Å
314	L	90.7	Very high	82	Confident	13 Å²	13	52.2 Å²	52.2	7%	0.068	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	101.8	-176.1	179.2	52.5	0	0	0	111.1	K312 A316 E317 G318 V319 P325 Y328 C338	K312-L314 PolarHBondContact O-N 2.69Å; L314-A316 HydrophobicContact CD1-CB 4.33Å; L314-A316 PolarHBondContact O-N 2.9Å; L314-E317 HydrophobicContact CD2-CB 4.07Å; L314-E317 HydrophobicContact CD2-CG 3.66Å; L314-E317 HydrophobicContact CG-CB 4.14Å; L314-E317 HydrophobicContact CG-CG 4.09Å; L314-E317 PolarHBondContact O-N 3.47Å; L314-G318 WeakPolarHBondContact O-CA 3.48Å; L314-G318 PolarHBondContact O-N 3.15Å; L314-V319 HydrophobicContact CB-CG2 4.06Å; L314-V319 HydrophobicContact CD2-CG2 4.47Å; L314-V319 PolarHBondContact N-O 3.39Å; L314-V319 PolarHBondContact O-N 2.83Å; L314-P325 HydrophobicContact CD2-CG 3.47Å; L314-P325 VanDerWaalsContact CD2-CG 3.47Å; L314-Y328 HydrophobicContact CD1-CD1 4.07Å; L314-Y328 HydrophobicContact CD1-CE1 3.87Å; L314-Y328 HydrophobicContact CD2-CD1 4.05Å; L314-Y328 HydrophobicContact CD2-CD2 3.92Å; L314-Y328 HydrophobicContact CD2-CE1 4.12Å; L314-Y328 HydrophobicContact CD2-CE2 4.01Å; L314-Y328 HydrophobicContact CD2-CG 3.95Å; L314-C338 HydrophobicContact CD1-CB 4.22Å; L314-C338 HydrophobicContact CD2-CB 4.33Å
315	E	86.7	Confident	83.8	Confident	126 Å²	126	48.7 Å²	48.7	59%	0.589	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-27.7	-171.8	-170.9	161.4	-158.7	0	0	114.1	Y281 R291 A313	Y281-E315 HydrophobicContact CE1-CB 4.33Å; R291-E315 IonicContact CZ-OE2 2.74Å; R291-E315 VanDerWaalsContact CZ-OE2 3.23Å; R291-E315 IonicContact NH1-OE1 2.98Å; R291-E315 PolarHBondContact NH1-OE1 2.99Å; R291-E315 VanDerWaalsContact NH1-OE1 3.17Å; R291-E315 IonicContact NH1-OE2 3.73Å; R291-E315 PolarHBondContact NH1-OE2 2.93Å; R291-E315 IonicContact NH2-OE2 3.5Å; R291-E315 PolarHBondContact NH2-OE2 2.86Å; A313-E315 PolarHBondContact O-N 3.05Å
316	A	84.5	Confident	85.1	Confident	73 Å²	73	50.8 Å²	50.8	60%	0.603	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-36.1	178.4	0	0	0	0	0	113.4	L314 Y328	L314-A316 HydrophobicContact CD1-CB 4.33Å; L314-A316 PolarHBondContact O-N 2.9Å; A316-Y328 HydrophobicContact CB-CE1 4.39Å; A316-Y328 VanDerWaalsContact CB-OH 3.32Å; A316-Y328 WeakPolarHBondContact CB-OH 3.32Å
317	E	84	Confident	86	Confident	97 Å²	97	54.9 Å²	54.9	45%	0.453	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-16.1	178.4	-60.1	-57.9	138.7	0	0	112.6	L314 V319 P325 Y328	L314-E317 HydrophobicContact CD2-CB 4.07Å; L314-E317 HydrophobicContact CD2-CG 3.66Å; L314-E317 HydrophobicContact CG-CB 4.14Å; L314-E317 HydrophobicContact CG-CG 4.09Å; L314-E317 PolarHBondContact O-N 3.47Å; E317-V319 HydrophobicContact CB-CG1 4.24Å; E317-V319 HydrophobicContact CB-CG2 4.02Å; E317-P325 HydrophobicContact CG-CG 4.3Å; E317-Y328 HydrophobicContact CG-CD2 4.47Å; E317-Y328 HydrophobicContact CG-CE2 3.58Å; E317-Y328 WeakPolarHBondContact OE1-CE2 3.41Å; E317-Y328 PolarHBondContact OE1-OH 3.06Å
318	G	89.3	Confident	86.8	Confident	19 Å²	19	52 Å²	52	20%	0.196	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	73	31.4	-175.8	0	0	0	0	0	113.9	Y281 E282 L314	Y281-G318 CarbonylContact C-O 3.57Å; Y281-G318 WeakPolarHBondContact CA-O 3.34Å; E282-G318 PolarHBondContact N-O 3.38Å; L314-G318 WeakPolarHBondContact O-CA 3.48Å; L314-G318 PolarHBondContact O-N 3.15Å
319	V	92.1	Very high	87.1	Confident	26 Å²	26	52.9 Å²	52.9	16%	0.158	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	148.1	-173.5	-55.6	0	0	0	0	113.5	E282 L314 E317 V321	E282-V319 HydrophobicContact CB-CG1 4.31Å; L314-V319 HydrophobicContact CB-CG2 4.06Å; L314-V319 HydrophobicContact CD2-CG2 4.47Å; L314-V319 PolarHBondContact N-O 3.39Å; L314-V319 PolarHBondContact O-N 2.83Å; E317-V319 HydrophobicContact CB-CG1 4.24Å; E317-V319 HydrophobicContact CB-CG2 4.02Å; V319-V321 HydrophobicContact CB-CG1 4.11Å; V319-V321 HydrophobicContact CG2-CG1 3.77Å; V319-V321 HydrophobicContact CG2-CG2 4.32Å
320	C	92.7	Very high	87.2	Confident	4 Å²	4	55.6 Å²	55.6	3%	0.027	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	111.4	169	-176.9	0	0	0	0	110	E282 L283 I289 C294 K312	E282-C320 PolarHBondContact O-N 2.89Å; L283-C320 HydrophobicContact CD1-CB 4.23Å; I289-C320 HydrophobicContact CD1-CB 4.04Å; I289-C320 HydrophobicContact CG1-CB 4.39Å; C294-C320 VanDerWaalsContact CA-SG 3.54Å; C294-C320 HydrophobicContact CB-CB 3.85Å; C294-C320 WeakPolarHBondContact CB-SG 3.29Å; C294-C320 WeakPolarHBondContact SG-CB 3.36Å; C294-C320 CovalentContact SG-SG 2.03Å; C294-C320 PolarHBondContact SG-SG 2.03Å; K312-C320 WeakPolarHBondContact O-CA 3.22Å
321	V	89.8	Confident	87.2	Confident	35 Å²	35	53.7 Å²	53.7	21%	0.212	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	152	-169.6	-67.1	0	0	0	0	112.6	K312 V319 R323	K312-V321 HydrophobicContact CB-CG2 4.49Å; K312-V321 PolarHBondContact N-O 3.44Å; K312-V321 PolarHBondContact O-N 3.05Å; V319-V321 HydrophobicContact CB-CG1 4.11Å; V319-V321 HydrophobicContact CG2-CG1 3.77Å; V319-V321 HydrophobicContact CG2-CG2 4.32Å; V321-R323 WeakPolarHBondContact CB-O 3.37Å; V321-R323 VanDerWaalsContact CG2-O 3.28Å; V321-R323 WeakPolarHBondContact CG2-O 3.03Å
322	L	86.6	Confident	86.9	Confident	43 Å²	43	57 Å²	57	23%	0.225	32%	0.315	C	S	.	.	S	Bend	trans	-79.3	-37.6	172.3	-72.4	170.2	0	0	0	112.3	V300 L309 Y311 K312	V300-L322 HydrophobicContact CB-CD1 4.22Å; V300-L322 HydrophobicContact CB-CD2 4.15Å; V300-L322 HydrophobicContact CG1-CD1 4.27Å; V300-L322 HydrophobicContact CG2-CD1 4.19Å; V300-L322 HydrophobicContact CG2-CD2 4.03Å; L309-L322 HydrophobicContact CB-CD2 4.09Å; Y311-L322 HydrophobicContact CD1-CD2 3.87Å; Y311-L322 HydrophobicContact CD1-CG 4.09Å; Y311-L322 HydrophobicContact CD2-CD2 3.69Å; Y311-L322 HydrophobicContact CE1-CD1 4.47Å; Y311-L322 HydrophobicContact CE1-CD2 3.86Å; Y311-L322 HydrophobicContact CE1-CG 3.84Å; Y311-L322 HydrophobicContact CE2-CD2 3.7Å; Y311-L322 HydrophobicContact CE2-CG 4.48Å; Y311-L322 HydrophobicContact CG-CD2 3.79Å; K312-L322 PolarHBondContact NZ-O 2.77Å
323	R	84.3	Confident	86.8	Confident	121 Å²	121	64 Å²	64	46%	0.457	35%	0.352	S	S	.	.	S	Bend	trans	-121.5	142.5	178.4	-58.4	-179.6	-173	154.2	-0.1	108.7	D302 V321	D302-R323 IonicContact OD2-CZ 3.82Å; D302-R323 IonicContact OD2-NH2 3.38Å; D302-R323 PolarHBondContact OD2-NH2 3.48Å; V321-R323 WeakPolarHBondContact CB-O 3.37Å; V321-R323 VanDerWaalsContact CG2-O 3.28Å; V321-R323 WeakPolarHBondContact CG2-O 3.03Å
324	C	86.5	Confident	86.6	Confident	27 Å²	27	66.1 Å²	66.1	18%	0.182	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-63.9	145.8	-176.1	-61.6	0	0	0	0	113	C338	C324-C338 VanDerWaalsContact CA-SG 3.53Å; C324-C338 HydrophobicContact CB-CB 3.94Å; C324-C338 WeakPolarHBondContact CB-SG 3.43Å; C324-C338 VanDerWaalsContact SG-CA 3.57Å; C324-C338 WeakPolarHBondContact SG-CB 3.04Å; C324-C338 CovalentContact SG-SG 2.04Å; C324-C338 PolarHBondContact SG-SG 2.93Å
325	P	82.7	Confident	86.4	Confident	32 Å²	32	68.3 Å²	68.3	21%	0.208	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-76.8	171.8	179.6	32	-33	0	0	0	112	L314 E317 Y328	L314-P325 HydrophobicContact CD2-CG 3.47Å; L314-P325 VanDerWaalsContact CD2-CG 3.47Å; E317-P325 HydrophobicContact CG-CG 4.3Å; P325-Y328 HydrophobicContact CG-CD2 3.85Å; P325-Y328 HydrophobicContact CG-CE2 4.4Å; P325-Y328 PolarHBondContact O-N 3Å; P325-Y328 VanDerWaalsContact O-N 3.1Å
326	P	76.2	Confident	86.5	Confident	102 Å²	102	67 Å²	67	66%	0.662	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	144.7	172.7	-26.7	35.6	0	0	0	112.2	Y328	P326-Y328 VanDerWaalsContact C-N 3.28Å; P326-Y328 WeakPolarHBondContact O-CD2 3.48Å; P326-Y328 PolarHBondContact O-N 3.33Å
327	N	81.2	Confident	86.8	Confident	121 Å²	121	68.1 Å²	68.1	65%	0.647	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	4.6	-171.7	-52.1	-34.2	0	0	0	116.4	C341 C345	N327-C341 PolarHBondContact O-N 3.08Å; N327-C345 WeakPolarHBondContact CA-SG 3.45Å; N327-C345 PolarHBondContact O-SG 2.96Å; N327-C345 VanDerWaalsContact O-SG 3.34Å
328	Y	87	Confident	87.1	Confident	35 Å²	35	64.1 Å²	64.1	14%	0.137	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	150.5	173.2	-56.2	-100.2	0	0	0	113.4	L314 A316 E317 P325 P326 C338 I339 P340 C345	L314-Y328 HydrophobicContact CD1-CD1 4.07Å; L314-Y328 HydrophobicContact CD1-CE1 3.87Å; L314-Y328 HydrophobicContact CD2-CD1 4.05Å; L314-Y328 HydrophobicContact CD2-CD2 3.92Å; L314-Y328 HydrophobicContact CD2-CE1 4.12Å; L314-Y328 HydrophobicContact CD2-CE2 4.01Å; L314-Y328 HydrophobicContact CD2-CG 3.95Å; A316-Y328 HydrophobicContact CB-CE1 4.39Å; A316-Y328 VanDerWaalsContact CB-OH 3.32Å; A316-Y328 WeakPolarHBondContact CB-OH 3.32Å; E317-Y328 HydrophobicContact CG-CD2 4.47Å; E317-Y328 HydrophobicContact CG-CE2 3.58Å; E317-Y328 WeakPolarHBondContact OE1-CE2 3.41Å; E317-Y328 PolarHBondContact OE1-OH 3.06Å; P325-Y328 HydrophobicContact CG-CD2 3.85Å; P325-Y328 HydrophobicContact CG-CE2 4.4Å; P325-Y328 PolarHBondContact O-N 3Å; P325-Y328 VanDerWaalsContact O-N 3.1Å; P326-Y328 VanDerWaalsContact C-N 3.28Å; P326-Y328 WeakPolarHBondContact O-CD2 3.48Å; P326-Y328 PolarHBondContact O-N 3.33Å; Y328-C338 HydrophobicContact CD1-CB 4.49Å; Y328-I339 CarbonylContact C-O 3.54Å; Y328-I339 VanDerWaalsContact CA-O 3.29Å; Y328-I339 WeakPolarHBondContact CA-O 3.43Å; Y328-P340 HydrophobicContact CD1-CB 4.48Å; Y328-P340 HydrophobicContact CD1-CG 4.12Å; Y328-P340 HydrophobicContact CE1-CG 3.95Å; Y328-C345 PolarHBondContact N-SG 2.91Å; Y328-C345 VanDerWaalsContact N-SG 3.45Å
329	E	86.7	Confident	87.1	Confident	90 Å²	90	65.3 Å²	65.3	42%	0.421	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	163.1	171	60.5	-168.4	159.8	0	0	110.5	C338 I339 C341	E329-C338 CarbonylContact O-C 3.55Å; E329-C338 VanDerWaalsContact O-CA 3.26Å; E329-C338 WeakPolarHBondContact O-CA 3.4Å; E329-I339 HydrophobicContact CG-CD1 4.29Å; E329-I339 HydrophobicContact CG-CG1 3.81Å; E329-I339 PolarHBondContact N-O 3.23Å; E329-I339 PolarHBondContact O-N 2.87Å; E329-C341 HydrophobicContact CB-CB 4.49Å; E329-C341 HydrophobicContact CG-CB 3.99Å; E329-C341 PolarHBondContact N-SG 2.74Å; E329-C341 VanDerWaalsContact N-SG 3.38Å; E329-C341 WeakPolarHBondContact OE1-CA 3.46Å; E329-C341 WeakPolarHBondContact OE1-CB 3.5Å
330	E	86.3	Confident	87	Confident	85 Å²	85	68.6 Å²	68.6	40%	0.397	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	139.8	177.6	-43	-153.6	140.4	0	0	110	K312 P332	K312-E330 WeakPolarHBondContact CE-OE1 3.47Å; K312-E330 VanDerWaalsContact NZ-CD 3.31Å; K312-E330 IonicContact NZ-OE1 3.17Å; K312-E330 PolarHBondContact NZ-OE1 3.01Å; K312-E330 IonicContact NZ-OE2 2.72Å; E330-P332 VanDerWaalsContact O-CD 3.29Å; E330-P332 WeakPolarHBondContact O-CD 3.47Å
331	D	87.7	Confident	86.6	Confident	16 Å²	16	69.6 Å²	69.6	9%	0.086	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	121	178.4	-166.9	-43.8	0	0	0	109.7	N333 D334 K337 I339	D331-N333 PolarHBondContact O-N 3.34Å; D331-N333 WeakPolarHBondContact OD1-CB 3.36Å; D331-N333 PolarHBondContact OD1-N 2.92Å; D331-N333 PolarHBondContact OD1-ND2 2.85Å; D331-D334 HydrophobicContact CB-CB 4.43Å; D331-D334 CarbonylContact O-C 3.49Å; D331-D334 PolarHBondContact O-N 3.1Å; D331-K337 HydrophobicContact CB-CB 3.98Å; D331-K337 HydrophobicContact CB-CD 4.08Å; D331-K337 HydrophobicContact CB-CG 4.08Å; D331-K337 PolarHBondContact N-O 2.84Å; D331-K337 WeakPolarHBondContact OD2-CD 3.19Å; D331-K337 VanDerWaalsContact OD2-CE 3.31Å; D331-K337 WeakPolarHBondContact OD2-CE 3.4Å; D331-K337 IonicContact OD2-NZ 2.84Å; D331-K337 PolarHBondContact OD2-NZ 2.87Å; D331-I339 HydrophobicContact CB-CG2 4.04Å; D331-I339 WeakPolarHBondContact OD2-CG2 3.13Å
332	P	85.2	Confident	86.2	Confident	115 Å²	115	78 Å²	78	75%	0.747	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-13	-179.4	-25.6	35.8	0	0	0	114.8	E330	E330-P332 VanDerWaalsContact O-CD 3.29Å; E330-P332 WeakPolarHBondContact O-CD 3.47Å
333	N	89.6	Confident	85.7	Confident	147 Å²	147	78.8 Å²	78.8	79%	0.786	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-14	-179.4	-44.3	-90.8	0	0	0	113	D331	D331-N333 PolarHBondContact O-N 3.34Å; D331-N333 WeakPolarHBondContact OD1-CB 3.36Å; D331-N333 PolarHBondContact OD1-N 2.92Å; D331-N333 PolarHBondContact OD1-ND2 2.85Å
334	D	88.5	Confident	85.1	Confident	62 Å²	62	78.6 Å²	78.6	33%	0.332	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	103.1	-178.2	179.1	9.9	0	0	0	111.9	D331 R336 K337	D331-D334 HydrophobicContact CB-CB 4.43Å; D331-D334 CarbonylContact O-C 3.49Å; D331-D334 PolarHBondContact O-N 3.1Å; D334-R336 PolarHBondContact O-N 2.69Å; D334-R336 WeakPolarHBondContact OD1-CB 3.18Å; D334-R336 PolarHBondContact OD1-N 3.41Å; D334-K337 HydrophobicContact CB-CB 4.04Å; D334-K337 PolarHBondContact O-N 2.93Å; D334-K337 WeakPolarHBondContact OD2-CB 3.43Å
335	P	87.2	Confident	84.5	Confident	59 Å²	59	78.4 Å²	78.4	38%	0.383	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	-1.6	-179.5	30.9	-36.5	0	0	0	114.1	Y310 K312	Y310-P335 HydrophobicContact CD2-CB 3.85Å; Y310-P335 HydrophobicContact CD2-CG 4.08Å; Y310-P335 HydrophobicContact CE2-CB 4.28Å; Y310-P335 HydrophobicContact CE2-CG 4.19Å; K312-P335 WeakPolarHBondContact CE-O 3.03Å; K312-P335 PolarHBondContact NZ-O 2.91Å; K312-P335 VanDerWaalsContact NZ-O 3.1Å
336	R	88.9	Confident	84.3	Confident	99 Å²	99	81 Å²	81	37%	0.374	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	4.1	170.2	-67.7	-171.4	170.6	74.3	-0.6	113.8	Y310 K312 D334	Y310-R336 HydrophobicContact CD1-CG 4.49Å; Y310-R336 HydrophobicContact CG-CG 4.37Å; K312-R336 WeakPolarHBondContact CA-O 3.38Å; K312-R336 WeakPolarHBondContact CB-O 3.34Å; D334-R336 PolarHBondContact O-N 2.69Å; D334-R336 WeakPolarHBondContact OD1-CB 3.18Å; D334-R336 PolarHBondContact OD1-N 3.41Å
337	K	90.1	Very high	84.6	Confident	95 Å²	95	81.3 Å²	81.3	41%	0.413	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	147.7	-172.3	-177.1	-179.5	168	-149.7	0	112.2	D331 D334	D331-K337 HydrophobicContact CB-CB 3.98Å; D331-K337 HydrophobicContact CB-CD 4.08Å; D331-K337 HydrophobicContact CB-CG 4.08Å; D331-K337 PolarHBondContact N-O 2.84Å; D331-K337 WeakPolarHBondContact OD2-CD 3.19Å; D331-K337 VanDerWaalsContact OD2-CE 3.31Å; D331-K337 WeakPolarHBondContact OD2-CE 3.4Å; D331-K337 IonicContact OD2-NZ 2.84Å; D331-K337 PolarHBondContact OD2-NZ 2.87Å; D334-K337 HydrophobicContact CB-CB 4.04Å; D334-K337 PolarHBondContact O-N 2.93Å; D334-K337 WeakPolarHBondContact OD2-CB 3.43Å
338	C	90.1	Very high	84.6	Confident	14 Å²	14	82.3 Å²	82.3	10%	0.095	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	147.4	168.1	-61.1	0	0	0	0	109.8	K312 L314 C324 Y328 E329	K312-C338 VanDerWaalsContact CD-SG 3.5Å; L314-C338 HydrophobicContact CD1-CB 4.22Å; L314-C338 HydrophobicContact CD2-CB 4.33Å; C324-C338 VanDerWaalsContact CA-SG 3.53Å; C324-C338 HydrophobicContact CB-CB 3.94Å; C324-C338 WeakPolarHBondContact CB-SG 3.43Å; C324-C338 VanDerWaalsContact SG-CA 3.57Å; C324-C338 WeakPolarHBondContact SG-CB 3.04Å; C324-C338 CovalentContact SG-SG 2.04Å; C324-C338 PolarHBondContact SG-SG 2.93Å; Y328-C338 HydrophobicContact CD1-CB 4.49Å; E329-C338 CarbonylContact O-C 3.55Å; E329-C338 VanDerWaalsContact O-CA 3.26Å; E329-C338 WeakPolarHBondContact O-CA 3.4Å
339	I	90.7	Very high	84.3	Confident	44 Å²	44	81 Å²	81	23%	0.226	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	147.4	174.1	56.3	174.3	0	0	0	110.1	Y328 E329 D331 C341	Y328-I339 CarbonylContact C-O 3.54Å; Y328-I339 VanDerWaalsContact CA-O 3.29Å; Y328-I339 WeakPolarHBondContact CA-O 3.43Å; E329-I339 HydrophobicContact CG-CD1 4.29Å; E329-I339 HydrophobicContact CG-CG1 3.81Å; E329-I339 PolarHBondContact N-O 3.23Å; E329-I339 PolarHBondContact O-N 2.87Å; D331-I339 HydrophobicContact CB-CG2 4.04Å; D331-I339 WeakPolarHBondContact OD2-CG2 3.13Å; I339-C341 PolarHBondContact O-N 3.35Å
340	P	89.3	Confident	84	Confident	95 Å²	95	79 Å²	79	62%	0.617	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.8	131	173.6	-18.4	31.3	0	0	0	110.8	Y328	Y328-P340 HydrophobicContact CD1-CB 4.48Å; Y328-P340 HydrophobicContact CD1-CG 4.12Å; Y328-P340 HydrophobicContact CE1-CG 3.95Å
341	C	84.7	Confident	83.8	Confident	24 Å²	24	75.8 Å²	75.8	16%	0.162	40%	0.401	C	S	.	.			trans	-75.9	153.7	-175.8	-21.8	0	0	0	0	112.6	N327 E329 I339 G343 C345	N327-C341 PolarHBondContact O-N 3.08Å; E329-C341 HydrophobicContact CB-CB 4.49Å; E329-C341 HydrophobicContact CG-CB 3.99Å; E329-C341 PolarHBondContact N-SG 2.74Å; E329-C341 VanDerWaalsContact N-SG 3.38Å; E329-C341 WeakPolarHBondContact OE1-CA 3.46Å; E329-C341 WeakPolarHBondContact OE1-CB 3.5Å; I339-C341 PolarHBondContact O-N 3.35Å; C341-G343 VanDerWaalsContact C-N 3.28Å; C341-G343 PolarHBondContact O-N 3.29Å; C341-C345 HydrophobicContact CB-CB 4.06Å; C341-C345 WeakPolarHBondContact CB-SG 3.46Å; C341-C345 VanDerWaalsContact SG-CA 3.55Å; C341-C345 WeakPolarHBondContact SG-CB 3.06Å; C341-C345 CovalentContact SG-SG 2.02Å; C341-C345 PolarHBondContact SG-SG 3.16Å
342	K	80.6	Confident	83.4	Confident	213 Å²	213	76.5 Å²	76.5	93%	0.926	41%	0.412	S	S	*	.	S	Bend	trans	-83.9	66.2	177.7	-65.2	178.8	-177.2	173.9	0	112
343	G	77.1	Confident	83.1	Confident	59 Å²	59	74.2 Å²	74.2	61%	0.608	39%	0.394	S	S	*	.	S	Bend	trans	130.5	-141.2	177.9	0	0	0	0	0	112.3	C341 C345	C341-G343 VanDerWaalsContact C-N 3.28Å; C341-G343 PolarHBondContact O-N 3.29Å; G343-C345 PolarHBondContact O-N 3.48Å
344	I	70.6	Confident	82.8	Confident	116 Å²	116	67.2 Å²	67.2	60%	0.595	36%	0.357	S	S	*	.	S	Bend	trans	-70.7	112.9	172.4	-57.7	174.8	0	0	0	108.3	L346	I344-L346 HydrophobicContact CG2-CD2 4.23Å; I344-L346 PolarHBondContact O-N 2.97Å
345	C	74.7	Confident	82	Confident	23 Å²	23	68.2 Å²	68.2	16%	0.155	36%	0.356	C	S	.	.			trans	-63.5	104.1	170	-65.9	0	0	0	0	110.3	N327 Y328 C341 G343 R347 N367	N327-C345 WeakPolarHBondContact CA-SG 3.45Å; N327-C345 PolarHBondContact O-SG 2.96Å; N327-C345 VanDerWaalsContact O-SG 3.34Å; Y328-C345 PolarHBondContact N-SG 2.91Å; Y328-C345 VanDerWaalsContact N-SG 3.45Å; C341-C345 HydrophobicContact CB-CB 4.06Å; C341-C345 WeakPolarHBondContact CB-SG 3.46Å; C341-C345 VanDerWaalsContact SG-CA 3.55Å; C341-C345 WeakPolarHBondContact SG-CB 3.06Å; C341-C345 CovalentContact SG-SG 2.02Å; C341-C345 PolarHBondContact SG-SG 3.16Å; G343-C345 PolarHBondContact O-N 3.48Å; C345-R347 PolarHBondContact O-N 3.04Å; C345-N367 PolarHBondContact O-OD1 2.94Å
346	L	78.8	Confident	81.1	Confident	86 Å²	86	65.4 Å²	65.4	45%	0.45	34%	0.337	S	S	.	.			trans	-74.5	98.6	179.4	-62.3	178.2	0	0	0	109.4	I344 K348 N367 I368	I344-L346 HydrophobicContact CG2-CD2 4.23Å; I344-L346 PolarHBondContact O-N 2.97Å; L346-K348 PolarHBondContact O-N 2.88Å; L346-K348 VanDerWaalsContact O-N 3.12Å; L346-N367 HydrophobicContact CB-CB 4.36Å; L346-N367 HydrophobicContact CD2-CB 4.03Å; L346-I368 HydrophobicContact CB-CD1 3.86Å; L346-I368 HydrophobicContact CB-CG1 4.22Å; L346-I368 HydrophobicContact CD1-CD1 4.09Å
347	R	80.9	Confident	80.2	Confident	110 Å²	110	62.6 Å²	62.6	42%	0.415	33%	0.33	S	S	.	.			trans	-65.4	117.2	179.4	179.7	170.5	157.3	-145.1	-13.9	109.8	C345 Q362 K364 N367 I368	C345-R347 PolarHBondContact O-N 3.04Å; R347-Q362 PolarHBondContact NH2-O 2.73Å; R347-Q362 VanDerWaalsContact NH2-O 3.08Å; R347-K364 PolarHBondContact NH1-O 3.38Å; R347-N367 PolarHBondContact N-OD1 3.16Å; R347-N367 VanDerWaalsContact N-OD1 3.08Å; R347-N367 PolarHBondContact O-N 3.18Å; R347-I368 PolarHBondContact O-N 2.86Å
348	K	81.7	Confident	79	Confident	141 Å²	141	59.2 Å²	59.2	61%	0.613	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.7	133.6	169.5	-67.4	164.9	178.8	175.8	0	109.3	L346 I368 I370	L346-K348 PolarHBondContact O-N 2.88Å; L346-K348 VanDerWaalsContact O-N 3.12Å; K348-I368 WeakPolarHBondContact CA-O 3.38Å; K348-I368 HydrophobicContact CG-CB 4.25Å; K348-I368 HydrophobicContact CG-CD1 4.36Å; K348-I370 HydrophobicContact CB-CD1 3.88Å; K348-I370 HydrophobicContact CD-CD1 4.07Å; K348-I370 HydrophobicContact CG-CD1 4.05Å
349	C	82.3	Confident	78.1	Confident	9 Å²	9	60.6 Å²	60.6	6%	0.061	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	156.8	169.4	-33.2	0	0	0	0	108.5	C366 I368 V369 I370	C349-C366 HydrophobicContact CB-CB 4.2Å; C349-C366 WeakPolarHBondContact CB-SG 3.27Å; C349-C366 WeakPolarHBondContact SG-CB 3.47Å; C349-C366 CovalentContact SG-SG 2.03Å; C349-C366 PolarHBondContact SG-SG 2.97Å; C349-I368 PolarHBondContact N-O 2.9Å; C349-V369 CarbonylContact O-C 3.59Å; C349-V369 WeakPolarHBondContact O-CA 3.32Å; C349-I370 PolarHBondContact O-N 2.65Å
350	F	78.8	Confident	77.6	Confident	47 Å²	47	58.5 Å²	58.5	21%	0.206	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	146	176.5	-60.6	-73.5	0	0	0	110.6	V304 T305 F363 I370	V304-F350 HydrophobicContact CG1-CB 4.35Å; T305-F350 HydrophobicContact CG2-CD1 3.72Å; T305-F350 HydrophobicContact CG2-CE1 3.47Å; T305-F350 VanDerWaalsContact CG2-CE1 3.47Å; T305-F350 HydrophobicContact CG2-CZ 4.07Å; F350-F363 WeakPolarHBondContact O-CE1 3.37Å; F350-I370 CarbonylContact C-O 3.53Å; F350-I370 WeakPolarHBondContact CA-O 3.27Å; F350-I370 HydrophobicContact CD1-CB 3.86Å; F350-I370 HydrophobicContact CD1-CG2 3.95Å; F350-I370 HydrophobicContact CE1-CB 4.1Å; F350-I370 HydrophobicContact CE1-CD1 4.26Å; F350-I370 HydrophobicContact CE1-CG2 3.95Å
351	G	82.1	Confident	77.1	Confident	17 Å²	17	55.2 Å²	55.2	18%	0.175	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	169.9	174.7	0	0	0	0	0	112.2	V369 I370 A372	G351-V369 VanDerWaalsContact CA-CG1 3.44Å; G351-I370 PolarHBondContact N-O 2.82Å; G351-A372 CarbonylContact C-O 3.57Å; G351-A372 WeakPolarHBondContact CA-O 3.32Å
352	G	79.6	Confident	76.7	Confident	31 Å²	31	59 Å²	59	32%	0.32	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	168.2	-170.6	-176.8	0	0	0	0	0	112	A372 D374	G352-A372 PolarHBondContact N-O 3.38Å; G352-D374 PolarHBondContact O-N 2.93Å
353	D	79.9	Confident	77	Confident	68 Å²	68	48.9 Å²	48.9	36%	0.364	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	150.1	172.8	-59.9	-63.2	0	0	0	111.7	R355 D374	D353-R355 HydrophobicContact CB-CG 4.47Å; D353-R355 IonicContact OD1-CZ 3.57Å; D353-R355 IonicContact OD1-NH2 2.75Å; D353-R355 PolarHBondContact OD1-NH2 3.06Å; D353-R355 VanDerWaalsContact OD1-NH2 3.09Å; D353-R355 IonicContact OD2-CZ 3.63Å; D353-R355 IonicContact OD2-NH1 2.67Å; D353-R355 PolarHBondContact OD2-NH1 3.11Å; D353-R355 IonicContact OD2-NH2 3.7Å; D353-R355 PolarHBondContact OD2-NH2 3.16Å; D353-D374 CarbonylContact C-O 3.58Å; D353-D374 WeakPolarHBondContact CA-O 3.32Å
354	V	82.5	Confident	77.4	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	97.3	167.4	178.3	0	0	0	0	109.1	A360 F363 L373 D374 I375 M376 M377	V354-A360 HydrophobicContact CG1-CB 3.76Å; V354-F363 HydrophobicContact CG2-CD2 4.02Å; V354-F363 HydrophobicContact CG2-CE2 3.52Å; V354-F363 HydrophobicContact CG2-CZ 4.48Å; V354-L373 HydrophobicContact CG2-CD1 3.93Å; V354-D374 PolarHBondContact N-O 3.2Å; V354-I375 HydrophobicContact CB-CG1 4.38Å; V354-I375 HydrophobicContact CB-CG2 4.48Å; V354-M376 CarbonylContact O-C 3.55Å; V354-M376 PolarHBondContact O-N 2.99Å; V354-M377 HydrophobicContact CG1-SD 3.91Å
355	R	71.6	Confident	78	Confident	82 Å²	82	46.8 Å²	46.8	31%	0.309	24%	0.241	S	C	.	.			trans	-104.8	-14.8	179.4	-55.8	179.6	176	90.4	8	113.4	Y120 D353 E359 M376	Y120-R355 HydrophobicContact CE2-CB 4.36Å; Y120-R355 PolarHBondContact OH-O 3.33Å; D353-R355 HydrophobicContact CB-CG 4.47Å; D353-R355 IonicContact OD1-CZ 3.57Å; D353-R355 IonicContact OD1-NH2 2.75Å; D353-R355 PolarHBondContact OD1-NH2 3.06Å; D353-R355 VanDerWaalsContact OD1-NH2 3.09Å; D353-R355 IonicContact OD2-CZ 3.63Å; D353-R355 IonicContact OD2-NH1 2.67Å; D353-R355 PolarHBondContact OD2-NH1 3.11Å; D353-R355 IonicContact OD2-NH2 3.7Å; D353-R355 PolarHBondContact OD2-NH2 3.16Å; R355-E359 WeakPolarHBondContact CA-OE2 3.2Å; R355-E359 VanDerWaalsContact CB-OE2 3.27Å; R355-E359 WeakPolarHBondContact CB-OE2 3.34Å; R355-E359 WeakPolarHBondContact CG-OE2 3.34Å; R355-E359 PolarHBondContact N-OE2 2.56Å; R355-M376 WeakPolarHBondContact CA-O 3.33Å
356	S	68.4	Low	78.7	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.233	C	C	.	.	S	Bend	trans	-145.5	170.5	-175.5	73.1	0	0	0	0	113	N121 S358 E359 A360 M377	N121-S356 WeakPolarHBondContact OD1-CB 3.5Å; N121-S356 PolarHBondContact OD1-OG 3.15Å; S356-S358 VanDerWaalsContact C-N 3.3Å; S356-S358 PolarHBondContact OG-N 2.65Å; S356-S358 PolarHBondContact OG-OG 3.29Å; S356-E359 WeakPolarHBondContact OG-CG 3.37Å; S356-E359 PolarHBondContact OG-N 3.41Å; S356-A360 WeakPolarHBondContact O-CB 3.42Å; S356-A360 PolarHBondContact O-N 2.91Å; S356-M377 PolarHBondContact N-SD 3.38Å; S356-M377 VanDerWaalsContact N-SD 3.45Å
357	L	69.4	Low	79.2	Confident	41 Å²	41	42.3 Å²	42.3	22%	0.215	22%	0.216	C	C	.	.	H	α-helix	trans	-67.4	-28.4	170.8	-67.9	175	0	0	0	112.5	S361 M377 F403 K406 L407 Y410	L357-S361 WeakPolarHBondContact O-CB 3.36Å; L357-S361 PolarHBondContact O-N 3.36Å; L357-M377 HydrophobicContact CD2-CE 4.49Å; L357-F403 HydrophobicContact CD1-CD2 4.05Å; L357-F403 HydrophobicContact CD1-CE2 4.39Å; L357-F403 HydrophobicContact CD2-CD2 4.19Å; L357-F403 HydrophobicContact CD2-CE2 4.13Å; L357-F403 HydrophobicContact CG-CD2 4.27Å; L357-F403 HydrophobicContact CG-CE2 4.15Å; L357-K406 HydrophobicContact CD2-CB 4.16Å; L357-L407 HydrophobicContact CD2-CD2 3.77Å; L357-L407 HydrophobicContact CD2-CG 3.79Å; L357-Y410 HydrophobicContact CB-CE2 4.45Å; L357-Y410 VanDerWaalsContact O-CE2 3.3Å; L357-Y410 WeakPolarHBondContact O-CE2 3.02Å
358	S	64.9	Low	79.7	Confident	23 Å²	23	38.1 Å²	38.1	16%	0.161	20%	0.201	C	C	.	.	H	α-helix	trans	-68.8	-45.8	174.6	62.1	0	0	0	0	111.6	Y120 N121 S356 A360 S361	Y120-S358 WeakPolarHBondContact O-CB 3.41Å; Y120-S358 PolarHBondContact O-OG 2.67Å; N121-S358 PolarHBondContact OD1-OG 3.32Å; S356-S358 VanDerWaalsContact C-N 3.3Å; S356-S358 PolarHBondContact OG-N 2.65Å; S356-S358 PolarHBondContact OG-OG 3.29Å; S358-A360 VanDerWaalsContact C-N 3.33Å; S358-A360 PolarHBondContact O-N 2.97Å; S358-S361 WeakPolarHBondContact O-CB 3.26Å; S358-S361 PolarHBondContact O-N 2.89Å; S358-S361 VanDerWaalsContact O-N 3.12Å; S358-S361 PolarHBondContact O-OG 3.49Å
359	E	71.1	Confident	80.1	Confident	44 Å²	44	31.4 Å²	31.4	21%	0.206	17%	0.172	C	C	.	.	H	α-helix	trans	-65.4	-35.2	174.7	-69.6	176.3	-165.3	0	0	111.5	R355 S356 S361 Q362	R355-E359 WeakPolarHBondContact CA-OE2 3.2Å; R355-E359 VanDerWaalsContact CB-OE2 3.27Å; R355-E359 WeakPolarHBondContact CB-OE2 3.34Å; R355-E359 WeakPolarHBondContact CG-OE2 3.34Å; R355-E359 PolarHBondContact N-OE2 2.56Å; S356-E359 WeakPolarHBondContact OG-CG 3.37Å; S356-E359 PolarHBondContact OG-N 3.41Å; E359-S361 VanDerWaalsContact C-N 3.35Å; E359-Q362 VanDerWaalsContact O-CG 3.28Å; E359-Q362 WeakPolarHBondContact O-CG 3.22Å; E359-Q362 PolarHBondContact O-NE2 3.27Å
360	A	81.3	Confident	80.4	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-64.5	-37	170.9	0	0	0	0	0	112.3	V354 S356 S358 Q362 F363 L407 Y410	V354-A360 HydrophobicContact CG1-CB 3.76Å; S356-A360 WeakPolarHBondContact O-CB 3.42Å; S356-A360 PolarHBondContact O-N 2.91Å; S358-A360 VanDerWaalsContact C-N 3.33Å; S358-A360 PolarHBondContact O-N 2.97Å; A360-Q362 PolarHBondContact O-N 3.36Å; A360-F363 WeakPolarHBondContact O-CB 3.36Å; A360-F363 PolarHBondContact O-N 2.86Å; A360-L407 HydrophobicContact CB-CD2 3.91Å; A360-Y410 HydrophobicContact CB-CD2 3.85Å
361	S	78.8	Confident	80.8	Confident	26 Å²	26	32.2 Å²	32.2	18%	0.182	18%	0.18	C	C	.	.	H	α-helix	trans	-60.2	-22.8	-173.2	77.6	0	0	0	0	114.8	L357 S358 E359 F363 K364	L357-S361 WeakPolarHBondContact O-CB 3.36Å; L357-S361 PolarHBondContact O-N 3.36Å; S358-S361 WeakPolarHBondContact O-CB 3.26Å; S358-S361 PolarHBondContact O-N 2.89Å; S358-S361 VanDerWaalsContact O-N 3.12Å; S358-S361 PolarHBondContact O-OG 3.49Å; E359-S361 VanDerWaalsContact C-N 3.35Å; S361-F363 PolarHBondContact O-N 2.98Å; S361-K364 WeakPolarHBondContact O-CB 3.46Å; S361-K364 PolarHBondContact O-N 3.21Å
362	Q	75.7	Confident	81.2	Confident	103 Å²	103	32.2 Å²	32.2	48%	0.481	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-26.2	175.5	77.5	-165.9	-43.9	0	0	113	R347 E359 A360	R347-Q362 PolarHBondContact NH2-O 2.73Å; R347-Q362 VanDerWaalsContact NH2-O 3.08Å; E359-Q362 VanDerWaalsContact O-CG 3.28Å; E359-Q362 WeakPolarHBondContact O-CG 3.22Å; E359-Q362 PolarHBondContact O-NE2 3.27Å; A360-Q362 PolarHBondContact O-N 3.36Å
363	F	86.9	Confident	81.9	Confident	1 Å²	1	30.8 Å²	30.8	0%	0.004	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-6.6	178.8	-64.4	-77.3	0	0	0	113.7	F350 V354 A360 S361 G365 C366 V369 L373 Y410 L411 I414	F350-F363 WeakPolarHBondContact O-CE1 3.37Å; V354-F363 HydrophobicContact CG2-CD2 4.02Å; V354-F363 HydrophobicContact CG2-CE2 3.52Å; V354-F363 HydrophobicContact CG2-CZ 4.48Å; A360-F363 WeakPolarHBondContact O-CB 3.36Å; A360-F363 PolarHBondContact O-N 2.86Å; S361-F363 PolarHBondContact O-N 2.98Å; F363-G365 PolarHBondContact O-N 3.26Å; F363-G365 VanDerWaalsContact O-N 3.14Å; F363-C366 HydrophobicContact CB-CB 4.41Å; F363-C366 WeakPolarHBondContact O-CA 3.47Å; F363-C366 WeakPolarHBondContact O-CB 3.49Å; F363-C366 PolarHBondContact O-N 3.31Å; F363-V369 HydrophobicContact CD1-CG2 4.21Å; F363-V369 HydrophobicContact CE1-CG1 4.24Å; F363-V369 HydrophobicContact CE1-CG2 4.11Å; F363-L373 HydrophobicContact CE1-CD1 4.16Å; F363-L373 HydrophobicContact CE2-CD1 3.97Å; F363-L373 HydrophobicContact CZ-CD1 3.7Å; F363-Y410 CarbonylContact C-O 3.06Å; F363-Y410 WeakPolarHBondContact CB-O 3.04Å; F363-L411 HydrophobicContact CB-CD2 3.89Å; F363-L411 HydrophobicContact CD2-CD2 4.11Å; F363-L411 HydrophobicContact CG-CD2 4.14Å; F363-I414 HydrophobicContact CB-CD1 4.29Å; F363-I414 HydrophobicContact CD1-CD1 4.33Å; F363-I414 HydrophobicContact CG-CD1 4.46Å
364	K	85	Confident	82.5	Confident	103 Å²	103	28.4 Å²	28.4	45%	0.448	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	120.6	178.7	-179.8	173.2	178.3	169.7	0	110.9	R347 S361 C366 E409 Y410	R347-K364 PolarHBondContact NH1-O 3.38Å; S361-K364 WeakPolarHBondContact O-CB 3.46Å; S361-K364 PolarHBondContact O-N 3.21Å; K364-C366 VanDerWaalsContact C-N 3.34Å; K364-E409 WeakPolarHBondContact CE-OE1 3.44Å; K364-E409 IonicContact NZ-OE1 3.8Å; K364-E409 PolarHBondContact NZ-OE1 2.73Å; K364-Y410 WeakPolarHBondContact CA-O 3.31Å; K364-Y410 HydrophobicContact CB-CD1 3.94Å; K364-Y410 HydrophobicContact CD-CD1 3.98Å; K364-Y410 HydrophobicContact CD-CE1 4.02Å; K364-Y410 HydrophobicContact CG-CD1 4.18Å; K364-Y410 PolarHBondContact N-O 2.7Å
365	G	84.1	Confident	82.9	Confident	28 Å²	28	28.4 Å²	28.4	29%	0.289	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.7	19.7	-175.4	0	0	0	0	0	115	F363 D413	F363-G365 PolarHBondContact O-N 3.26Å; F363-G365 VanDerWaalsContact O-N 3.14Å; G365-D413 WeakPolarHBondContact CA-OD2 3.05Å
366	C	88.4	Confident	83.5	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.147	C	C	.	.			trans	-87.2	144.7	175	-159.6	0	0	0	0	111.8	C349 F363 K364 D413 I414	C349-C366 HydrophobicContact CB-CB 4.2Å; C349-C366 WeakPolarHBondContact CB-SG 3.27Å; C349-C366 WeakPolarHBondContact SG-CB 3.47Å; C349-C366 CovalentContact SG-SG 2.03Å; C349-C366 PolarHBondContact SG-SG 2.97Å; F363-C366 HydrophobicContact CB-CB 4.41Å; F363-C366 WeakPolarHBondContact O-CA 3.47Å; F363-C366 WeakPolarHBondContact O-CB 3.49Å; F363-C366 PolarHBondContact O-N 3.31Å; K364-C366 VanDerWaalsContact C-N 3.34Å; C366-D413 CarbonylContact O-C 3.59Å; C366-D413 WeakPolarHBondContact O-CB 3.43Å; C366-I414 HydrophobicContact CB-CG1 4.45Å; C366-I414 WeakPolarHBondContact O-CA 3.47Å; C366-I414 PolarHBondContact O-N 3.21Å
367	N	90.1	Very high	83.8	Confident	15 Å²	15	26.7 Å²	26.7	8%	0.08	15%	0.147	C	C	.	.			trans	-119.4	-30.2	177.2	-50.1	125.1	0	0	0	113.9	C345 L346 R347 D413 R415 E416	C345-N367 PolarHBondContact O-OD1 2.94Å; L346-N367 HydrophobicContact CB-CB 4.36Å; L346-N367 HydrophobicContact CD2-CB 4.03Å; R347-N367 PolarHBondContact N-OD1 3.16Å; R347-N367 VanDerWaalsContact N-OD1 3.08Å; R347-N367 PolarHBondContact O-N 3.18Å; N367-D413 PolarHBondContact ND2-O 3.23Å; N367-D413 VanDerWaalsContact ND2-O 3.07Å; N367-R415 PolarHBondContact O-N 2.04Å; N367-E416 PolarHBondContact O-N 3.16Å
368	I	90.5	Very high	83.6	Confident	21 Å²	21	27.5 Å²	27.5	11%	0.108	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	122.2	179.4	-54	177.3	0	0	0	109.2	L346 R347 K348 C349 I370 E416 T418	L346-I368 HydrophobicContact CB-CD1 3.86Å; L346-I368 HydrophobicContact CB-CG1 4.22Å; L346-I368 HydrophobicContact CD1-CD1 4.09Å; R347-I368 PolarHBondContact O-N 2.86Å; K348-I368 WeakPolarHBondContact CA-O 3.38Å; K348-I368 HydrophobicContact CG-CB 4.25Å; K348-I368 HydrophobicContact CG-CD1 4.36Å; C349-I368 PolarHBondContact N-O 2.9Å; I368-I370 HydrophobicContact CG2-CG1 4.47Å; I368-E416 WeakPolarHBondContact CA-O 3.37Å; I368-E416 HydrophobicContact CB-CB 4.5Å; I368-E416 HydrophobicContact CG1-CB 4.23Å; I368-E416 HydrophobicContact CG2-CB 4.27Å; I368-E416 HydrophobicContact CG2-CG 4.23Å; I368-T418 HydrophobicContact CG2-CG2 4.19Å
369	V	91.1	Very high	83.1	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	113.5	174.2	-178.2	0	0	0	0	110	C349 G351 F363 I414 E416 I417 T418	C349-V369 CarbonylContact O-C 3.59Å; C349-V369 WeakPolarHBondContact O-CA 3.32Å; G351-V369 VanDerWaalsContact CA-CG1 3.44Å; F363-V369 HydrophobicContact CD1-CG2 4.21Å; F363-V369 HydrophobicContact CE1-CG1 4.24Å; F363-V369 HydrophobicContact CE1-CG2 4.11Å; V369-I414 HydrophobicContact CG2-CD1 4.12Å; V369-I414 HydrophobicContact CG2-CG1 4.34Å; V369-I414 HydrophobicContact CG2-CG2 3.94Å; V369-E416 PolarHBondContact N-O 3.21Å; V369-I417 HydrophobicContact CB-CG1 4.18Å; V369-I417 HydrophobicContact CG2-CG1 4.38Å; V369-T418 WeakPolarHBondContact O-CB 3.42Å; V369-T418 WeakPolarHBondContact O-CG2 3.06Å; V369-T418 PolarHBondContact O-N 2.75Å; V369-T418 PolarHBondContact O-OG1 2.92Å
370	I	87.4	Confident	82	Confident	60 Å²	60	26.5 Å²	26.5	31%	0.308	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	108.8	176.6	-58.4	-179.5	0	0	0	108.5	K348 C349 F350 G351 I368 T418	K348-I370 HydrophobicContact CB-CD1 3.88Å; K348-I370 HydrophobicContact CD-CD1 4.07Å; K348-I370 HydrophobicContact CG-CD1 4.05Å; C349-I370 PolarHBondContact O-N 2.65Å; F350-I370 CarbonylContact C-O 3.53Å; F350-I370 WeakPolarHBondContact CA-O 3.27Å; F350-I370 HydrophobicContact CD1-CB 3.86Å; F350-I370 HydrophobicContact CD1-CG2 3.95Å; F350-I370 HydrophobicContact CE1-CB 4.1Å; F350-I370 HydrophobicContact CE1-CD1 4.26Å; F350-I370 HydrophobicContact CE1-CG2 3.95Å; G351-I370 PolarHBondContact N-O 2.82Å; I368-I370 HydrophobicContact CG2-CG1 4.47Å; I370-T418 VanDerWaalsContact CA-OG1 3.28Å; I370-T418 WeakPolarHBondContact CA-OG1 3.31Å
371	G	88.5	Confident	80.2	Confident	13 Å²	13	28.4 Å²	28.4	13%	0.134	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	108.8	-170.2	-164.9	0	0	0	0	0	112.3	T418 H419	G371-T418 PolarHBondContact N-OG1 3.35Å; G371-T418 PolarHBondContact O-OG1 2.85Å; G371-H419 VanDerWaalsContact C-CG 3.48Å; G371-H419 WeakPolarHBondContact O-CB 3.21Å; G371-H419 PolarHBondContact O-N 2.79Å
372	A	90.6	Very high	78.3	Confident	18 Å²	18	30.6 Å²	30.6	15%	0.149	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	160.4	177.7	0	0	0	0	0	112.5	G351 G352 H419 Y420	G351-A372 CarbonylContact C-O 3.57Å; G351-A372 WeakPolarHBondContact CA-O 3.32Å; G352-A372 PolarHBondContact N-O 3.38Å; A372-H419 HydrophobicContact CB-CB 4.2Å; A372-Y420 WeakPolarHBondContact CA-O 3.27Å; A372-Y420 HydrophobicContact CB-CD1 3.81Å; A372-Y420 HydrophobicContact CB-CD2 4.14Å; A372-Y420 HydrophobicContact CB-CE1 3.44Å; A372-Y420 VanDerWaalsContact CB-CE1 3.44Å; A372-Y420 HydrophobicContact CB-CE2 3.79Å; A372-Y420 HydrophobicContact CB-CG 4.14Å
373	L	94.6	Very high	76.4	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	105.7	174.4	-174	60	0	0	0	110.2	V354 F363 I375 I414 I417 Y420 L421 K422 L435	V354-L373 HydrophobicContact CG2-CD1 3.93Å; F363-L373 HydrophobicContact CE1-CD1 4.16Å; F363-L373 HydrophobicContact CE2-CD1 3.97Å; F363-L373 HydrophobicContact CZ-CD1 3.7Å; L373-I375 HydrophobicContact CD2-CD1 4.3Å; L373-I375 HydrophobicContact CG-CD1 4.33Å; L373-I375 HydrophobicContact CG-CG1 4.08Å; L373-I414 HydrophobicContact CD2-CD1 4.16Å; L373-I417 HydrophobicContact CB-CD1 4.24Å; L373-I417 HydrophobicContact CD2-CD1 3.98Å; L373-Y420 PolarHBondContact N-O 3.2Å; L373-L421 HydrophobicContact CB-CD1 4.17Å; L373-L421 HydrophobicContact CD2-CD1 4.09Å; L373-L421 HydrophobicContact CG-CD1 4.21Å; L373-K422 PolarHBondContact O-N 2.89Å; L373-L435 HydrophobicContact CD2-CD2 4.47Å
374	D	91.8	Very high	74.1	Confident	18 Å²	18	31.1 Å²	31.1	10%	0.096	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	90.5	-173.2	-103.2	61.7	0	0	0	110.7	G352 D353 V354 Y420 K422	G352-D374 PolarHBondContact O-N 2.93Å; D353-D374 CarbonylContact C-O 3.58Å; D353-D374 WeakPolarHBondContact CA-O 3.32Å; V354-D374 PolarHBondContact N-O 3.2Å; D374-Y420 WeakPolarHBondContact OD1-CE2 3.47Å; D374-Y420 PolarHBondContact OD1-OH 2.8Å; D374-Y420 VanDerWaalsContact OD1-OH 3.09Å; D374-K422 WeakPolarHBondContact OD2-CD 3.2Å; D374-K422 WeakPolarHBondContact OD2-CE 3.45Å; D374-K422 IonicContact OD2-NZ 3.21Å; D374-K422 PolarHBondContact OD2-NZ 2.71Å
375	I	90.8	Very high	71.8	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	124.5	-178	-49	-178.9	0	0	0	110.3	V354 L373 M377 L411 L421 K422 V423 S424 F429 M434 L435	V354-I375 HydrophobicContact CB-CG1 4.38Å; V354-I375 HydrophobicContact CB-CG2 4.48Å; L373-I375 HydrophobicContact CD2-CD1 4.3Å; L373-I375 HydrophobicContact CG-CD1 4.33Å; L373-I375 HydrophobicContact CG-CG1 4.08Å; I375-M377 HydrophobicContact CG2-CG 3.87Å; I375-L411 HydrophobicContact CD1-CD1 4.21Å; I375-L421 HydrophobicContact CD1-CD1 4.28Å; I375-K422 PolarHBondContact N-O 2.86Å; I375-V423 HydrophobicContact CB-CG2 4.38Å; I375-V423 HydrophobicContact CD1-CG2 4.38Å; I375-V423 WeakPolarHBondContact O-CA 3.45Å; I375-S424 PolarHBondContact O-N 3.06Å; I375-F429 HydrophobicContact CG2-CE2 3.67Å; I375-F429 HydrophobicContact CG2-CZ 3.66Å; I375-M434 HydrophobicContact CD1-CE 4.11Å; I375-L435 HydrophobicContact CD1-CD1 4.27Å
376	M	84.6	Confident	69.6	Low	45 Å²	45	33.7 Å²	33.7	22%	0.222	18%	0.184	C	C	.	.			trans	-143.5	64	178.8	-166.3	-173.5	-67.1	0	0	110.8	V354 R355 Q378 S424 F425	V354-M376 CarbonylContact O-C 3.55Å; V354-M376 PolarHBondContact O-N 2.99Å; R355-M376 WeakPolarHBondContact CA-O 3.33Å; M376-Q378 HydrophobicContact CG-CG 4.01Å; M376-Q378 PolarHBondContact O-N 2.9Å; M376-Q378 PolarHBondContact SD-NE2 3.44Å; M376-S424 WeakPolarHBondContact CA-O 3.23Å; M376-S424 WeakPolarHBondContact CG-O 3.39Å; M376-F425 HydrophobicContact CE-CD2 4.29Å; M376-F425 HydrophobicContact CG-CB 4.24Å
377	M	74.7	Confident	67.1	Low	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.202	C	C	.	.			trans	-76	84.6	-177.6	-68.7	-59.3	-63.9	0	0	111	V354 S356 L357 I375 S379 F403 L407 S426 F429	V354-M377 HydrophobicContact CG1-SD 3.91Å; S356-M377 PolarHBondContact N-SD 3.38Å; S356-M377 VanDerWaalsContact N-SD 3.45Å; L357-M377 HydrophobicContact CD2-CE 4.49Å; I375-M377 HydrophobicContact CG2-CG 3.87Å; M377-S379 VanDerWaalsContact C-N 3.28Å; M377-S379 PolarHBondContact O-N 2.76Å; M377-F403 HydrophobicContact CB-CZ 4.37Å; M377-F403 HydrophobicContact CE-CE2 3.61Å; M377-F403 HydrophobicContact CE-CZ 3.47Å; M377-F403 VanDerWaalsContact CE-CZ 3.47Å; M377-L407 HydrophobicContact CE-CD2 4.25Å; M377-L407 HydrophobicContact SD-CD2 4.47Å; M377-S426 PolarHBondContact N-OG 2.92Å; M377-S426 WeakPolarHBondContact O-CA 3.36Å; M377-F429 HydrophobicContact CB-CE1 3.68Å; M377-F429 HydrophobicContact CB-CZ 3.84Å; M377-F429 HydrophobicContact CG-CE1 3.68Å; M377-F429 HydrophobicContact CG-CZ 3.49Å; M377-F429 VanDerWaalsContact CG-CZ 3.49Å
378	Q	64.3	Low	64.4	Low	58 Å²	58	41.3 Å²	41.3	27%	0.271	23%	0.228	S	C	.	.			trans	-75.7	-16.2	-178	-56.9	-158.2	23.1	0	0	113.8	M376	M376-Q378 HydrophobicContact CG-CG 4.01Å; M376-Q378 PolarHBondContact O-N 2.9Å; M376-Q378 PolarHBondContact SD-NE2 3.44Å
379	S	54.6	Low	61.5	Low	28 Å²	28	42.8 Å²	42.8	20%	0.196	24%	0.243	C	C	.	.			trans	-120.8	115.4	178.2	55.3	0	0	0	0	111.1	Y120 M377 F403	Y120-S379 PolarHBondContact OH-OG 3.08Å; M377-S379 VanDerWaalsContact C-N 3.28Å; M377-S379 PolarHBondContact O-N 2.76Å; S379-F403 WeakPolarHBondContact O-CE2 3.42Å; S379-F403 VanDerWaalsContact O-CZ 3.3Å; S379-F403 WeakPolarHBondContact O-CZ 3.42Å
380	G	48.2	Very low	58.8	Low	18 Å²	18	44.9 Å²	44.9	19%	0.186	26%	0.261	C	S	.	.	S	Bend	trans	-72.2	178.8	139.6	0	0	0	0	0	109.5
381	L	43.9	Very low	56.4	Low	40 Å²	40	47.8 Å²	47.8	21%	0.209	28%	0.281	C	S	.	.	S	Bend	trans	-60.8	145.6	173.8	-77.7	82.5	0	0	0	110.2	S383 F403	L381-S383 WeakPolarHBondContact O-CA 3.16Å; L381-S383 PolarHBondContact O-N 3.09Å; L381-S383 PolarHBondContact O-OG 2.75Å; L381-F403 HydrophobicContact CD1-CB 3.83Å; L381-F403 HydrophobicContact CD1-CD2 4.03Å; L381-F403 HydrophobicContact CD1-CG 4.38Å
382	D	38.1	Very low	54.1	Low	73 Å²	73	54.7 Å²	54.7	39%	0.39	31%	0.31	S	S	.	.			trans	-56	101.8	-175.2	-174.7	-5.1	0	0	0	111.5	K384 L386	D382-K384 PolarHBondContact O-N 3.01Å; D382-K384 VanDerWaalsContact O-N 3.13Å; D382-L386 PolarHBondContact O-N 3.49Å
383	S	36	Very low	51.3	Low	44 Å²	44	59.8 Å²	59.8	31%	0.308	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	10.2	-158.6	-34.7	0	0	0	0	112.9	L381 C387 C589	L381-S383 WeakPolarHBondContact O-CA 3.16Å; L381-S383 PolarHBondContact O-N 3.09Å; L381-S383 PolarHBondContact O-OG 2.75Å; S383-C387 VanDerWaalsContact O-CB 3.29Å; S383-C387 WeakPolarHBondContact O-CB 3.29Å; S383-C387 PolarHBondContact O-SG 2.78Å; S383-C589 VanDerWaalsContact OG-CB 3.31Å; S383-C589 WeakPolarHBondContact OG-CB 3.31Å; S383-C589 PolarHBondContact OG-SG 2.66Å; S383-C589 VanDerWaalsContact OG-SG 3.42Å
384	K	38.6	Very low	48.3	Very low	71 Å²	71	67 Å²	67	31%	0.309	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.7	-40.4	176.3	-67.5	-175.2	-179.1	-178.5	0	111.7	D382 C387 L388 D774 A777	D382-K384 PolarHBondContact O-N 3.01Å; D382-K384 VanDerWaalsContact O-N 3.13Å; K384-C387 PolarHBondContact O-N 2.71Å; K384-L388 WeakPolarHBondContact O-CB 3.26Å; K384-L388 WeakPolarHBondContact O-CD1 3.04Å; K384-L388 VanDerWaalsContact O-CG 3.23Å; K384-L388 WeakPolarHBondContact O-CG 3.36Å; K384-L388 PolarHBondContact O-N 3.11Å; K384-D774 IonicContact NZ-OD2 2.76Å; K384-D774 PolarHBondContact NZ-OD2 3.48Å; K384-A777 HydrophobicContact CD-CB 3.48Å; K384-A777 VanDerWaalsContact CD-CB 3.48Å
385	Q	38.2	Very low	45.6	Very low	117 Å²	117	73.2 Å²	73.2	55%	0.547	39%	0.386	S	S	.	.	H	α-helix	trans	-69.8	-43	176.4	-60.5	-164.3	19	0	0	112.9	A389	Q385-A389 PolarHBondContact O-N 3.23Å
386	L	37.6	Very low	42.6	Very low	67 Å²	67	75.5 Å²	75.5	35%	0.351	41%	0.405	S	S	.	.	H	α-helix	trans	-70.3	-37.3	172.3	-95.8	81.4	0	0	0	112.6	D382 A389 A390 V400	D382-L386 PolarHBondContact O-N 3.49Å; L386-A389 PolarHBondContact O-N 2.82Å; L386-A390 WeakPolarHBondContact O-CB 3.38Å; L386-A390 PolarHBondContact O-N 3.35Å; L386-V400 HydrophobicContact CD2-CG1 4.45Å
387	C	34.9	Very low	40	Very low	56 Å²	56	80.3 Å²	80.3	38%	0.378	43%	0.429	S	S	.	.	H	α-helix	trans	-69	-36.1	-178.5	-67.6	0	0	0	0	112.6	S383 K384 A390 V391	S383-C387 VanDerWaalsContact O-CB 3.29Å; S383-C387 WeakPolarHBondContact O-CB 3.29Å; S383-C387 PolarHBondContact O-SG 2.78Å; K384-C387 PolarHBondContact O-N 2.71Å; C387-A390 PolarHBondContact O-N 2.97Å; C387-V391 WeakPolarHBondContact O-CG2 3.22Å; C387-V391 PolarHBondContact O-N 2.79Å
388	L	34.3	Very low	37.8	Very low	120 Å²	120	86.6 Å²	86.6	63%	0.628	47%	0.467	S	S	*	.	H	α-helix	trans	-66.4	-41.8	171.5	-73	168.1	0	0	0	111.7	K384 A390 V391 Q392	K384-L388 WeakPolarHBondContact O-CB 3.26Å; K384-L388 WeakPolarHBondContact O-CD1 3.04Å; K384-L388 VanDerWaalsContact O-CG 3.23Å; K384-L388 WeakPolarHBondContact O-CG 3.36Å; K384-L388 PolarHBondContact O-N 3.11Å; L388-A390 VanDerWaalsContact C-N 3.33Å; L388-A390 PolarHBondContact O-N 3.35Å; L388-V391 PolarHBondContact O-N 2.86Å; L388-Q392 PolarHBondContact O-N 2.88Å; L388-Q392 VanDerWaalsContact O-N 3.12Å
389	A	29.8	Very low	36.2	Very low	51 Å²	51	89.2 Å²	89.2	42%	0.421	49%	0.487	S	S	.	.	H	α-helix	trans	-61.5	-39.9	175.8	0	0	0	0	0	112.6	Q385 L386 V391 Q392 F393	Q385-A389 PolarHBondContact O-N 3.23Å; L386-A389 PolarHBondContact O-N 2.82Å; A389-V391 VanDerWaalsContact C-N 3.34Å; A389-V391 PolarHBondContact O-N 3.04Å; A389-Q392 PolarHBondContact O-N 3.05Å; A389-F393 PolarHBondContact O-N 2.89Å
390	A	33.3	Very low	35.3	Very low	45 Å²	45	90.2 Å²	90.2	37%	0.372	49%	0.492	S	S	.	.	H	α-helix	trans	-65.8	-32.3	176.8	0	0	0	0	0	113.4	L386 C387 L388	L386-A390 WeakPolarHBondContact O-CB 3.38Å; L386-A390 PolarHBondContact O-N 3.35Å; C387-A390 PolarHBondContact O-N 2.97Å; L388-A390 VanDerWaalsContact C-N 3.33Å; L388-A390 PolarHBondContact O-N 3.35Å
391	V	38	Very low	35.1	Very low	120 Å²	120	90 Å²	90	73%	0.727	49%	0.49	S	S	*	.	H	α-helix	trans	-74.4	-32.6	174.9	171	0	0	0	0	111.8	C387 L388 A389	C387-V391 WeakPolarHBondContact O-CG2 3.22Å; C387-V391 PolarHBondContact O-N 2.79Å; L388-V391 PolarHBondContact O-N 2.86Å; A389-V391 VanDerWaalsContact C-N 3.34Å; A389-V391 PolarHBondContact O-N 3.04Å
392	Q	39.3	Very low	35.9	Very low	158 Å²	158	90.9 Å²	90.9	74%	0.738	50%	0.495	S	S	*	.	H	α-helix	trans	-87.4	-15.9	-172.9	-154.8	163.6	19.5	0	0	114.6	L388 A389	L388-Q392 PolarHBondContact O-N 2.88Å; L388-Q392 VanDerWaalsContact O-N 3.12Å; A389-Q392 PolarHBondContact O-N 3.05Å
393	F	33	Very low	37	Very low	125 Å²	125	87.7 Å²	87.7	55%	0.548	48%	0.478	S	S	.	.			trans	-124	104.1	174.8	-72.3	-83.4	0	0	0	112.5	A389 Y395 A396 T720	A389-F393 PolarHBondContact O-N 2.89Å; F393-Y395 PolarHBondContact O-N 3.29Å; F393-A396 HydrophobicContact CB-CB 4.31Å; F393-A396 PolarHBondContact O-N 2.94Å; F393-T720 HydrophobicContact CD1-CG2 4.47Å
394	H	30.6	Very low	38.6	Very low	153 Å²	153	86.7 Å²	86.7	71%	0.708	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	20.7	-176.5	-114.9	69.1	0	0	0	116.3	G721 A722	H394-G721 CarbonylContact C-O 3.56Å; H394-G721 VanDerWaalsContact C-O 3.28Å; H394-G721 WeakPolarHBondContact CB-O 3.44Å; H394-A722 HydrophobicContact CB-CB 3.8Å
395	Y	34.5	Very low	40.2	Very low	148 Å²	148	84.2 Å²	84.2	58%	0.58	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.1	1.9	179.5	-133.7	-121.1	0	0	0	114.1	F393	F393-Y395 PolarHBondContact O-N 3.29Å
396	A	27.4	Very low	41.9	Very low	49 Å²	49	82 Å²	82	41%	0.405	46%	0.455	S	S	.	.			trans	-101.7	39.4	-169	0	0	0	0	0	114.8	F393 V398	F393-A396 HydrophobicContact CB-CB 4.31Å; F393-A396 PolarHBondContact O-N 2.94Å; A396-V398 VanDerWaalsContact C-N 3.3Å; A396-V398 PolarHBondContact O-N 2.75Å
397	I	30.6	Very low	44	Very low	145 Å²	145	78.9 Å²	78.9	74%	0.744	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-2	-173.2	-70	174.5	0	0	0	113.8
398	V	28.6	Very low	46.4	Very low	132 Å²	132	78.6 Å²	78.6	80%	0.8	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	-11.1	-166.6	-174.4	0	0	0	0	114.3	A396	A396-V398 VanDerWaalsContact C-N 3.3Å; A396-V398 PolarHBondContact O-N 2.75Å
399	V	30.6	Very low	48.8	Very low	113 Å²	113	76.2 Å²	76.2	69%	0.685	42%	0.418	S	S	*	.			trans	-124	59.2	-172	-161.4	0	0	0	0	112.3
400	V	36	Very low	51.5	Low	49 Å²	49	75.5 Å²	75.5	30%	0.297	40%	0.404	S	S	.	.	S	Bend	trans	-113.4	118.4	158.2	-172.4	0	0	0	0	107.1	L386 N402 H590	L386-V400 HydrophobicContact CD2-CG1 4.45Å; V400-N402 PolarHBondContact O-N 2.79Å; V400-H590 HydrophobicContact CG1-CB 4.36Å; V400-H590 VanDerWaalsContact CG1-CD2 3.48Å; V400-H590 WeakPolarHBondContact CG1-CD2 3.44Å
401	G	44.4	Very low	54.3	Low	14 Å²	14	73.3 Å²	73.3	14%	0.144	39%	0.387	C	S	.	.			trans	-66.8	125.3	-169.8	0	0	0	0	0	112.6	F403	G401-F403 VanDerWaalsContact C-N 3.32Å; G401-F403 PolarHBondContact O-N 2.61Å
402	N	59.3	Low	56.8	Low	59 Å²	59	67.8 Å²	67.8	32%	0.316	35%	0.354	S	S	.	.			trans	-67.6	85.9	176.6	-179.6	7.6	0	0	0	111.3	V400 A404 G405 K406 N585	V400-N402 PolarHBondContact O-N 2.79Å; N402-A404 PolarHBondContact O-N 3.06Å; N402-G405 PolarHBondContact O-N 2.89Å; N402-G405 PolarHBondContact OD1-N 3.31Å; N402-K406 PolarHBondContact O-N 3.17Å; N402-N585 VanDerWaalsContact ND2-CG 3.28Å; N402-N585 PolarHBondContact ND2-OD1 2.79Å
403	F	62.9	Low	59.2	Low	6 Å²	6	63.4 Å²	63.4	3%	0.026	34%	0.335	C	S	.	.	H	α-helix	trans	-59.1	-45.8	-178.5	175.8	-97.9	0	0	0	112.2	L357 M377 S379 L381 G401 G405 K406 L407 S428 F429 D587	L357-F403 HydrophobicContact CD1-CD2 4.05Å; L357-F403 HydrophobicContact CD1-CE2 4.39Å; L357-F403 HydrophobicContact CD2-CD2 4.19Å; L357-F403 HydrophobicContact CD2-CE2 4.13Å; L357-F403 HydrophobicContact CG-CD2 4.27Å; L357-F403 HydrophobicContact CG-CE2 4.15Å; M377-F403 HydrophobicContact CB-CZ 4.37Å; M377-F403 HydrophobicContact CE-CE2 3.61Å; M377-F403 HydrophobicContact CE-CZ 3.47Å; M377-F403 VanDerWaalsContact CE-CZ 3.47Å; S379-F403 WeakPolarHBondContact O-CE2 3.42Å; S379-F403 VanDerWaalsContact O-CZ 3.3Å; S379-F403 WeakPolarHBondContact O-CZ 3.42Å; L381-F403 HydrophobicContact CD1-CB 3.83Å; L381-F403 HydrophobicContact CD1-CD2 4.03Å; L381-F403 HydrophobicContact CD1-CG 4.38Å; G401-F403 VanDerWaalsContact C-N 3.32Å; G401-F403 PolarHBondContact O-N 2.61Å; F403-G405 PolarHBondContact O-N 3.47Å; F403-K406 PolarHBondContact O-N 2.98Å; F403-L407 HydrophobicContact CD1-CD1 4.06Å; F403-L407 HydrophobicContact CE1-CD1 3.48Å; F403-L407 VanDerWaalsContact CE1-CD1 3.48Å; F403-L407 HydrophobicContact CE2-CD1 4.41Å; F403-L407 HydrophobicContact CZ-CD1 3.7Å; F403-L407 PolarHBondContact O-N 3.21Å; F403-S428 VanDerWaalsContact CE1-OG 3.27Å; F403-S428 WeakPolarHBondContact CE1-OG 3.32Å; F403-F429 HydrophobicContact CE1-CD1 4.48Å; F403-F429 HydrophobicContact CE1-CE1 4.22Å; F403-D587 HydrophobicContact CD1-CB 4.31Å
404	A	68.2	Low	62	Low	22 Å²	22	57.5 Å²	57.5	18%	0.182	31%	0.309	C	S	.	.	H	α-helix	trans	-58.9	-47.2	175.8	0	0	0	0	0	111.6	N402 K406 L407 E408	N402-A404 PolarHBondContact O-N 3.06Å; A404-K406 PolarHBondContact O-N 3.46Å; A404-L407 PolarHBondContact O-N 3Å; A404-E408 WeakPolarHBondContact O-CB 3.21Å; A404-E408 PolarHBondContact O-N 3.49Å
405	G	72.7	Confident	64.9	Low	20 Å²	20	54.6 Å²	54.6	21%	0.206	29%	0.292	C	S	.	.	H	α-helix	trans	-63.3	-35.8	177.2	0	0	0	0	0	113.8	N402 F403 E408 E409	N402-G405 PolarHBondContact O-N 2.89Å; N402-G405 PolarHBondContact OD1-N 3.31Å; F403-G405 PolarHBondContact O-N 3.47Å; G405-E408 PolarHBondContact O-N 3.01Å; G405-E409 PolarHBondContact O-N 3.29Å
406	K	73.2	Confident	67.7	Low	69 Å²	69	49 Å²	49	30%	0.3	27%	0.272	S	S	.	.	H	α-helix	trans	-70.1	-36.3	174.1	-81.5	-72.8	172	-167.5	0	113.1	L357 N402 F403 A404 E408 E409 Y410	L357-K406 HydrophobicContact CD2-CB 4.16Å; N402-K406 PolarHBondContact O-N 3.17Å; F403-K406 PolarHBondContact O-N 2.98Å; A404-K406 PolarHBondContact O-N 3.46Å; K406-E408 VanDerWaalsContact C-N 3.34Å; K406-E409 WeakPolarHBondContact CD-OE2 3.46Å; K406-E409 WeakPolarHBondContact CE-OE2 3.26Å; K406-E409 IonicContact NZ-OE1 2.65Å; K406-E409 IonicContact NZ-OE2 2.75Å; K406-E409 PolarHBondContact NZ-OE2 3.45Å; K406-E409 PolarHBondContact O-N 3.47Å; K406-Y410 WeakPolarHBondContact O-CD2 3.3Å; K406-Y410 VanDerWaalsContact O-CG 3.26Å; K406-Y410 PolarHBondContact O-N 3.22Å
407	L	83.3	Confident	71	Confident	3 Å²	3	46.7 Å²	46.7	2%	0.016	25%	0.252	C	S	.	.	H	α-helix	trans	-67.2	-36.1	170	-74.7	172.6	0	0	0	112	L357 A360 M377 F403 A404 Y410 L411 F429 M434	L357-L407 HydrophobicContact CD2-CD2 3.77Å; L357-L407 HydrophobicContact CD2-CG 3.79Å; A360-L407 HydrophobicContact CB-CD2 3.91Å; M377-L407 HydrophobicContact CE-CD2 4.25Å; M377-L407 HydrophobicContact SD-CD2 4.47Å; F403-L407 HydrophobicContact CD1-CD1 4.06Å; F403-L407 HydrophobicContact CE1-CD1 3.48Å; F403-L407 VanDerWaalsContact CE1-CD1 3.48Å; F403-L407 HydrophobicContact CE2-CD1 4.41Å; F403-L407 HydrophobicContact CZ-CD1 3.7Å; F403-L407 PolarHBondContact O-N 3.21Å; A404-L407 PolarHBondContact O-N 3Å; L407-Y410 PolarHBondContact O-N 2.94Å; L407-L411 HydrophobicContact CD2-CD1 4.23Å; L407-L411 WeakPolarHBondContact O-CB 3.36Å; L407-L411 PolarHBondContact O-N 2.74Å; L407-F429 HydrophobicContact CD1-CD1 4.45Å; L407-F429 HydrophobicContact CD1-CE1 3.48Å; L407-F429 VanDerWaalsContact CD1-CE1 3.48Å; L407-F429 HydrophobicContact CD1-CZ 4Å; L407-M434 HydrophobicContact CB-CB 4.06Å; L407-M434 HydrophobicContact CB-CG 4.43Å
408	E	84.4	Confident	74	Confident	49 Å²	49	40.2 Å²	40.2	23%	0.229	22%	0.22	C	C	.	.	H	α-helix	trans	-68.8	-34.1	175.5	-162.8	174.9	135.5	0	0	112.4	A404 G405 K406 Y410 G412 K436	A404-E408 WeakPolarHBondContact O-CB 3.21Å; A404-E408 PolarHBondContact O-N 3.49Å; G405-E408 PolarHBondContact O-N 3.01Å; K406-E408 VanDerWaalsContact C-N 3.34Å; E408-Y410 VanDerWaalsContact C-N 3.27Å; E408-Y410 PolarHBondContact O-N 3.33Å; E408-G412 WeakPolarHBondContact O-CA 3.28Å; E408-G412 PolarHBondContact O-N 2.95Å; E408-K436 HydrophobicContact CG-CD 4.14Å; E408-K436 WeakPolarHBondContact OE1-CD 3.4Å; E408-K436 VanDerWaalsContact OE1-CE 3.28Å; E408-K436 WeakPolarHBondContact OE1-CE 3.18Å; E408-K436 IonicContact OE1-NZ 2.82Å; E408-K436 PolarHBondContact OE1-NZ 2.8Å
409	E	84.6	Confident	77.2	Confident	71 Å²	71	35.8 Å²	35.8	33%	0.332	19%	0.19	S	C	.	.	H	α-helix	trans	-62.6	-31.9	170.6	-168.8	-167.3	139.3	0	0	112.5	K364 G405 K406	K364-E409 WeakPolarHBondContact CE-OE1 3.44Å; K364-E409 IonicContact NZ-OE1 3.8Å; K364-E409 PolarHBondContact NZ-OE1 2.73Å; G405-E409 PolarHBondContact O-N 3.29Å; K406-E409 WeakPolarHBondContact CD-OE2 3.46Å; K406-E409 WeakPolarHBondContact CE-OE2 3.26Å; K406-E409 IonicContact NZ-OE1 2.65Å; K406-E409 IonicContact NZ-OE2 2.75Å; K406-E409 PolarHBondContact NZ-OE2 3.45Å; K406-E409 PolarHBondContact O-N 3.47Å
410	Y	87.8	Confident	80.2	Confident	35 Å²	35	31.5 Å²	31.5	14%	0.137	16%	0.162	C	C	.	.	H	α-helix	trans	-98	-34.8	-173.3	-62.8	-15.4	0	0	0	114	L357 A360 F363 K364 K406 L407 E408	L357-Y410 HydrophobicContact CB-CE2 4.45Å; L357-Y410 VanDerWaalsContact O-CE2 3.3Å; L357-Y410 WeakPolarHBondContact O-CE2 3.02Å; A360-Y410 HydrophobicContact CB-CD2 3.85Å; F363-Y410 CarbonylContact C-O 3.06Å; F363-Y410 WeakPolarHBondContact CB-O 3.04Å; K364-Y410 WeakPolarHBondContact CA-O 3.31Å; K364-Y410 HydrophobicContact CB-CD1 3.94Å; K364-Y410 HydrophobicContact CD-CD1 3.98Å; K364-Y410 HydrophobicContact CD-CE1 4.02Å; K364-Y410 HydrophobicContact CG-CD1 4.18Å; K364-Y410 PolarHBondContact N-O 2.7Å; K406-Y410 WeakPolarHBondContact O-CD2 3.3Å; K406-Y410 VanDerWaalsContact O-CG 3.26Å; K406-Y410 PolarHBondContact O-N 3.22Å; L407-Y410 PolarHBondContact O-N 2.94Å; E408-Y410 VanDerWaalsContact C-N 3.27Å; E408-Y410 PolarHBondContact O-N 3.33Å
411	L	91.6	Very high	83.1	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-108	-15.3	-176.3	-57.8	177.6	0	0	0	113	F363 I375 L407 D413 I414 M434 L435	F363-L411 HydrophobicContact CB-CD2 3.89Å; F363-L411 HydrophobicContact CD2-CD2 4.11Å; F363-L411 HydrophobicContact CG-CD2 4.14Å; I375-L411 HydrophobicContact CD1-CD1 4.21Å; L407-L411 HydrophobicContact CD2-CD1 4.23Å; L407-L411 WeakPolarHBondContact O-CB 3.36Å; L407-L411 PolarHBondContact O-N 2.74Å; L411-D413 PolarHBondContact O-N 3.33Å; L411-D413 VanDerWaalsContact O-N 3.11Å; L411-I414 HydrophobicContact CB-CD1 4.32Å; L411-I414 HydrophobicContact CD2-CD1 3.9Å; L411-I414 WeakPolarHBondContact O-CB 3.4Å; L411-I414 WeakPolarHBondContact O-CG1 3.33Å; L411-I414 PolarHBondContact O-N 2.82Å; L411-M434 CarbonylContact C-O 3.5Å; L411-M434 WeakPolarHBondContact CB-O 3.45Å; L411-M434 HydrophobicContact CD1-CG 3.96Å; L411-L435 HydrophobicContact CB-CD2 4.04Å
412	G	89.4	Confident	85.6	Confident	3 Å²	3	29.7 Å²	29.7	3%	0.031	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-14.1	-170.5	0	0	0	0	0	115.7	E408 M434 N437	E408-G412 WeakPolarHBondContact O-CA 3.28Å; E408-G412 PolarHBondContact O-N 2.95Å; G412-M434 VanDerWaalsContact CA-O 3.25Å; G412-M434 WeakPolarHBondContact CA-O 3.46Å; G412-M434 PolarHBondContact N-O 2.99Å; G412-M434 VanDerWaalsContact N-O 3.16Å; G412-N437 WeakPolarHBondContact O-CB 3.31Å; G412-N437 PolarHBondContact O-ND2 3.28Å
413	D	89.9	Confident	87.3	Confident	67 Å²	67	26.9 Å²	26.9	36%	0.358	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-10.4	178.2	-78.1	-34.6	0	0	0	114.5	G365 C366 N367 L411 R415	G365-D413 WeakPolarHBondContact CA-OD2 3.05Å; C366-D413 CarbonylContact O-C 3.59Å; C366-D413 WeakPolarHBondContact O-CB 3.43Å; N367-D413 PolarHBondContact ND2-O 3.23Å; N367-D413 VanDerWaalsContact ND2-O 3.07Å; L411-D413 PolarHBondContact O-N 3.33Å; L411-D413 VanDerWaalsContact O-N 3.11Å; D413-R415 PolarHBondContact O-N 2.96Å
414	I	92.8	Very high	88.6	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.132	C	C	.	.			trans	-67.1	124.7	-176.5	-62.5	170.9	0	0	0	109.3	F363 C366 V369 L373 L411 I417 L435 N437 L438	F363-I414 HydrophobicContact CB-CD1 4.29Å; F363-I414 HydrophobicContact CD1-CD1 4.33Å; F363-I414 HydrophobicContact CG-CD1 4.46Å; C366-I414 HydrophobicContact CB-CG1 4.45Å; C366-I414 WeakPolarHBondContact O-CA 3.47Å; C366-I414 PolarHBondContact O-N 3.21Å; V369-I414 HydrophobicContact CG2-CD1 4.12Å; V369-I414 HydrophobicContact CG2-CG1 4.34Å; V369-I414 HydrophobicContact CG2-CG2 3.94Å; L373-I414 HydrophobicContact CD2-CD1 4.16Å; L411-I414 HydrophobicContact CB-CD1 4.32Å; L411-I414 HydrophobicContact CD2-CD1 3.9Å; L411-I414 WeakPolarHBondContact O-CB 3.4Å; L411-I414 WeakPolarHBondContact O-CG1 3.33Å; L411-I414 PolarHBondContact O-N 2.82Å; I414-I417 HydrophobicContact CG2-CG1 4.16Å; I414-L435 HydrophobicContact CB-CD2 4.22Å; I414-L435 HydrophobicContact CD1-CD2 3.99Å; I414-N437 CarbonylContact O-C 3.53Å; I414-L438 HydrophobicContact CG2-CD1 4.22Å; I414-L438 VanDerWaalsContact O-CA 3.28Å; I414-L438 WeakPolarHBondContact O-CA 3.4Å; I414-L438 PolarHBondContact O-N 2.96Å
415	R	91.5	Very high	89.4	Confident	92 Å²	92	30.8 Å²	30.8	35%	0.347	14%	0.144	S	C	.	.			trans	-110.2	-32	-179.7	-63.2	178.4	-173.9	-171.8	-0.3	112.9	N367 D413 N437 R439 V440	N367-R415 PolarHBondContact O-N 2.04Å; D413-R415 PolarHBondContact O-N 2.96Å; R415-N437 WeakPolarHBondContact CA-O 3.4Å; R415-N437 HydrophobicContact CG-CB 4.32Å; R415-R439 PolarHBondContact O-N 3.38Å; R415-V440 PolarHBondContact O-N 3.42Å
416	E	93.5	Very high	89.9	Confident	32 Å²	32	29.8 Å²	29.8	15%	0.15	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	136.8	-175	-178.2	174.6	128.4	0	0	111.4	N367 I368 V369 V440 R442	N367-E416 PolarHBondContact O-N 3.16Å; I368-E416 WeakPolarHBondContact CA-O 3.37Å; I368-E416 HydrophobicContact CB-CB 4.5Å; I368-E416 HydrophobicContact CG1-CB 4.23Å; I368-E416 HydrophobicContact CG2-CB 4.27Å; I368-E416 HydrophobicContact CG2-CG 4.23Å; V369-E416 PolarHBondContact N-O 3.21Å; E416-V440 CarbonylContact C-O 3.53Å; E416-V440 VanDerWaalsContact CA-O 3.31Å; E416-V440 WeakPolarHBondContact CA-O 3.06Å; E416-V440 HydrophobicContact CB-CB 4.44Å; E416-V440 HydrophobicContact CG-CB 4.16Å; E416-V440 HydrophobicContact CG-CG1 4.31Å; E416-R442 VanDerWaalsContact CD-NE 3.27Å; E416-R442 IonicContact OE1-CZ 2.62Å; E416-R442 VanDerWaalsContact OE1-CZ 3.3Å; E416-R442 IonicContact OE1-NE 2.63Å; E416-R442 PolarHBondContact OE1-NE 2.67Å; E416-R442 IonicContact OE1-NH2 2.67Å; E416-R442 PolarHBondContact OE1-NH2 3.03Å; E416-R442 IonicContact OE2-CZ 2.89Å; E416-R442 IonicContact OE2-NE 2.69Å; E416-R442 IonicContact OE2-NH2 2.97Å; E416-R442 PolarHBondContact OE2-NH2 3.1Å
417	I	95.5	Very high	90	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	127.9	166.2	-59.9	167.5	0	0	0	107.4	V369 L373 I414 L421 L438 V440 I441 R442	V369-I417 HydrophobicContact CB-CG1 4.18Å; V369-I417 HydrophobicContact CG2-CG1 4.38Å; L373-I417 HydrophobicContact CB-CD1 4.24Å; L373-I417 HydrophobicContact CD2-CD1 3.98Å; I414-I417 HydrophobicContact CG2-CG1 4.16Å; I417-L421 HydrophobicContact CD1-CB 3.96Å; I417-L421 HydrophobicContact CD1-CD1 4.03Å; I417-L421 HydrophobicContact CD1-CD2 4.43Å; I417-L421 HydrophobicContact CD1-CG 4.36Å; I417-L438 HydrophobicContact CD1-CD1 3.89Å; I417-L438 HydrophobicContact CD1-CD2 4.19Å; I417-L438 HydrophobicContact CG1-CD1 3.91Å; I417-V440 PolarHBondContact N-O 3Å; I417-I441 HydrophobicContact CB-CG1 4.41Å; I417-I441 CarbonylContact O-C 3.57Å; I417-I441 VanDerWaalsContact O-CA 3.28Å; I417-I441 WeakPolarHBondContact O-CA 3.24Å; I417-R442 PolarHBondContact O-N 2.84Å
418	T	93.5	Very high	89.3	Confident	9 Å²	9	28.4 Å²	28.4	6%	0.055	13%	0.133	C	C	.	.	S	Bend	trans	-81.7	-33.7	-173.8	53.8	0	0	0	0	113.3	I368 V369 I370 G371 R442 G443 Q444	I368-T418 HydrophobicContact CG2-CG2 4.19Å; V369-T418 WeakPolarHBondContact O-CB 3.42Å; V369-T418 WeakPolarHBondContact O-CG2 3.06Å; V369-T418 PolarHBondContact O-N 2.75Å; V369-T418 PolarHBondContact O-OG1 2.92Å; I370-T418 VanDerWaalsContact CA-OG1 3.28Å; I370-T418 WeakPolarHBondContact CA-OG1 3.31Å; G371-T418 PolarHBondContact N-OG1 3.35Å; G371-T418 PolarHBondContact O-OG1 2.85Å; T418-R442 WeakPolarHBondContact O-CB 3.33Å; T418-G443 PolarHBondContact O-N 2.77Å; T418-Q444 WeakPolarHBondContact O-CB 3.32Å; T418-Q444 WeakPolarHBondContact O-CG 3.22Å; T418-Q444 PolarHBondContact O-N 3.47Å
419	H	95.2	Very high	89.3	Confident	38 Å²	38	26.5 Å²	26.5	18%	0.176	12%	0.124	C	C	.	.	S	Bend	trans	-99.6	-115.3	177.3	-57.6	23.1	0	0	0	108.3	G371 A372 I441 G443 E445	G371-H419 VanDerWaalsContact C-CG 3.48Å; G371-H419 WeakPolarHBondContact O-CB 3.21Å; G371-H419 PolarHBondContact O-N 2.79Å; A372-H419 HydrophobicContact CB-CB 4.2Å; H419-I441 VanDerWaalsContact O-CG2 3.23Å; H419-I441 WeakPolarHBondContact O-CG2 3.4Å; H419-G443 VanDerWaalsContact O-CA 3.29Å; H419-G443 WeakPolarHBondContact O-CA 3.39Å; H419-G443 PolarHBondContact O-N 3.35Å; H419-E445 CarbonylContact C-O 3.08Å; H419-E445 WeakPolarHBondContact CA-O 3.49Å; H419-E445 HydrophobicContact CB-CB 4Å; H419-E445 WeakPolarHBondContact CD2-CB 3.42Å; H419-E445 IonicContact CD2-OE2 2.63Å; H419-E445 PolarHBondContact CD2-OE2 2.73Å; H419-E445 IonicContact NE2-OE2 3.28Å
420	Y	95.7	Very high	89.1	Confident	24 Å²	24	24.5 Å²	24.5	9%	0.094	12%	0.116	C	C	.	.			trans	-120.7	160.5	-179.7	66.2	-94.9	0	0	0	112.5	A372 L373 D374 K422 W447 Y451 A452	A372-Y420 WeakPolarHBondContact CA-O 3.27Å; A372-Y420 HydrophobicContact CB-CD1 3.81Å; A372-Y420 HydrophobicContact CB-CD2 4.14Å; A372-Y420 HydrophobicContact CB-CE1 3.44Å; A372-Y420 VanDerWaalsContact CB-CE1 3.44Å; A372-Y420 HydrophobicContact CB-CE2 3.79Å; A372-Y420 HydrophobicContact CB-CG 4.14Å; L373-Y420 PolarHBondContact N-O 3.2Å; D374-Y420 WeakPolarHBondContact OD1-CE2 3.47Å; D374-Y420 PolarHBondContact OD1-OH 2.8Å; D374-Y420 VanDerWaalsContact OD1-OH 3.09Å; Y420-K422 HydrophobicContact CD2-CB 4.12Å; Y420-K422 HydrophobicContact CE2-CB 3.94Å; Y420-K422 HydrophobicContact CE2-CD 4.25Å; Y420-W447 HydrophobicContact CD1-CB 4.12Å; Y420-W447 VanDerWaalsContact CD1-N 3.28Å; Y420-W447 HydrophobicContact CD2-CB 3.68Å; Y420-W447 HydrophobicContact CE1-CB 4.24Å; Y420-W447 HydrophobicContact CE2-CB 3.81Å; Y420-W447 HydrophobicContact CE2-CD2 4.37Å; Y420-W447 HydrophobicContact CE2-CE3 4.04Å; Y420-W447 HydrophobicContact CE2-CG 4.32Å; Y420-W447 HydrophobicContact CG-CB 3.85Å; Y420-W447 AromaticContact CZ-CE3 3.77Å; Y420-Y451 WeakPolarHBondContact CB-O 3.49Å; Y420-A452 WeakPolarHBondContact CA-O 3.46Å
421	L	96.8	Very high	89	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.005	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	132.4	169.9	173.6	63.3	0	0	0	109.8	L373 I375 I417 V423 L435 L438 I441 A452 I453 S454 W465	L373-L421 HydrophobicContact CB-CD1 4.17Å; L373-L421 HydrophobicContact CD2-CD1 4.09Å; L373-L421 HydrophobicContact CG-CD1 4.21Å; I375-L421 HydrophobicContact CD1-CD1 4.28Å; I417-L421 HydrophobicContact CD1-CB 3.96Å; I417-L421 HydrophobicContact CD1-CD1 4.03Å; I417-L421 HydrophobicContact CD1-CD2 4.43Å; I417-L421 HydrophobicContact CD1-CG 4.36Å; L421-V423 HydrophobicContact CD1-CG2 4.23Å; L421-V423 HydrophobicContact CG-CG2 4.36Å; L421-L435 HydrophobicContact CD1-CD1 4.01Å; L421-L435 HydrophobicContact CD2-CD1 3.91Å; L421-L438 HydrophobicContact CD2-CD2 3.96Å; L421-I441 HydrophobicContact CB-CD1 3.88Å; L421-I441 HydrophobicContact CD2-CD1 4.33Å; L421-A452 PolarHBondContact N-O 3.35Å; L421-I453 CarbonylContact O-C 3.54Å; L421-I453 VanDerWaalsContact O-CA 3.3Å; L421-I453 WeakPolarHBondContact O-CA 3.39Å; L421-S454 PolarHBondContact O-N 3.02Å; L421-W465 HydrophobicContact CD2-CZ2 4.49Å
422	K	95.9	Very high	89	Confident	24 Å²	24	23.8 Å²	23.8	10%	0.104	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	132.3	176	177.6	169.2	149.1	-148.3	0	110.1	L373 D374 I375 Y420 W447 S454	L373-K422 PolarHBondContact O-N 2.89Å; D374-K422 WeakPolarHBondContact OD2-CD 3.2Å; D374-K422 WeakPolarHBondContact OD2-CE 3.45Å; D374-K422 IonicContact OD2-NZ 3.21Å; D374-K422 PolarHBondContact OD2-NZ 2.71Å; I375-K422 PolarHBondContact N-O 2.86Å; Y420-K422 HydrophobicContact CD2-CB 4.12Å; Y420-K422 HydrophobicContact CE2-CB 3.94Å; Y420-K422 HydrophobicContact CE2-CD 4.25Å; K422-W447 HydrophobicContact CD-CD2 3.82Å; K422-W447 HydrophobicContact CD-CE3 4.11Å; K422-W447 HydrophobicContact CD-CG 4.26Å; K422-W447 HydrophobicContact CD-CH2 4.49Å; K422-W447 HydrophobicContact CD-CZ2 4.16Å; K422-W447 HydrophobicContact CD-CZ3 4.44Å; K422-W447 VanDerWaalsContact NZ-CZ3 3.3Å; K422-S454 CarbonylContact C-O 3.59Å; K422-S454 VanDerWaalsContact CA-O 3.28Å; K422-S454 WeakPolarHBondContact CA-O 3.39Å
423	V	94.3	Very high	88.8	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	110.6	178.7	-174.6	0	0	0	0	107.6	I375 L421 F429 L432 S454 V455 I456 N458	I375-V423 HydrophobicContact CB-CG2 4.38Å; I375-V423 HydrophobicContact CD1-CG2 4.38Å; I375-V423 WeakPolarHBondContact O-CA 3.45Å; L421-V423 HydrophobicContact CD1-CG2 4.23Å; L421-V423 HydrophobicContact CG-CG2 4.36Å; V423-F429 HydrophobicContact CG1-CD2 3.8Å; V423-F429 HydrophobicContact CG1-CE2 3.87Å; V423-L432 HydrophobicContact CG1-CD2 4.15Å; V423-L432 HydrophobicContact CG2-CD2 4.41Å; V423-S454 PolarHBondContact N-O 2.88Å; V423-V455 HydrophobicContact CB-CG2 4.42Å; V423-V455 VanDerWaalsContact O-CA 3.31Å; V423-V455 WeakPolarHBondContact O-CA 3.3Å; V423-I456 PolarHBondContact O-N 3.01Å; V423-N458 PolarHBondContact O-ND2 3.04Å
424	S	90.8	Very high	88.6	Confident	6 Å²	6	22.8 Å²	22.8	4%	0.042	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	150.2	-173.7	62.4	0	0	0	0	113.6	I375 M376 S426 I456 N458	I375-S424 PolarHBondContact O-N 3.06Å; M376-S424 WeakPolarHBondContact CA-O 3.23Å; M376-S424 WeakPolarHBondContact CG-O 3.39Å; S424-S426 PolarHBondContact O-N 3.18Å; S424-S426 PolarHBondContact O-OG 3.03Å; S424-I456 WeakPolarHBondContact CA-O 3.05Å; S424-N458 WeakPolarHBondContact CA-OD1 3.41Å
425	F	85.5	Confident	88.5	Confident	103 Å²	103	22.8 Å²	22.8	45%	0.452	11%	0.11	S	C	.	.	S	Bend	trans	47.1	35.5	175.9	-55.1	-78.3	0	0	0	114.1	M376 P427 I456 E457 N458	M376-F425 HydrophobicContact CE-CD2 4.29Å; M376-F425 HydrophobicContact CG-CB 4.24Å; F425-P427 VanDerWaalsContact C-CD 3.48Å; F425-P427 WeakPolarHBondContact O-CD 3.25Å; F425-I456 PolarHBondContact N-O 3.1Å; F425-E457 HydrophobicContact CD1-CB 3.6Å; F425-E457 HydrophobicContact CD1-CG 4.24Å; F425-E457 HydrophobicContact CE1-CB 3.53Å; F425-E457 HydrophobicContact CE1-CG 3.62Å; F425-E457 HydrophobicContact CG-CB 4.28Å; F425-E457 HydrophobicContact CZ-CB 4.16Å; F425-E457 HydrophobicContact CZ-CG 4.01Å; F425-N458 PolarHBondContact N-OD1 2.04Å
426	S	83.8	Confident	88.2	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.111	C	C	.	.			trans	-107.5	78.7	-175.7	-59.9	0	0	0	0	110.1	M377 S424 S428 F429 N458	M377-S426 PolarHBondContact N-OG 2.92Å; M377-S426 WeakPolarHBondContact O-CA 3.36Å; S424-S426 PolarHBondContact O-N 3.18Å; S424-S426 PolarHBondContact O-OG 3.03Å; S426-S428 VanDerWaalsContact C-N 3.31Å; S426-S428 PolarHBondContact O-N 3Å; S426-F429 PolarHBondContact O-N 2.72Å; S426-N458 PolarHBondContact N-OD1 2.84Å
427	P	73.5	Confident	88	Confident	40 Å²	40	23 Å²	23	26%	0.26	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-27.1	-171.5	28.3	-36.8	0	0	0	113.5	F425 F429 H460 A588	F425-P427 VanDerWaalsContact C-CD 3.48Å; F425-P427 WeakPolarHBondContact O-CD 3.25Å; P427-F429 PolarHBondContact O-N 2.99Å; P427-H460 WeakPolarHBondContact O-CB 3.31Å; P427-H460 PolarHBondContact O-CD2 3.03Å; P427-A588 WeakPolarHBondContact O-CB 3.38Å
428	S	70.3	Confident	87.8	Confident	3 Å²	3	23 Å²	23	2%	0.021	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-15.9	178.2	49.2	0	0	0	0	113.7	F403 S426 V430 D587 A588	F403-S428 VanDerWaalsContact CE1-OG 3.27Å; F403-S428 WeakPolarHBondContact CE1-OG 3.32Å; S426-S428 VanDerWaalsContact C-N 3.31Å; S426-S428 PolarHBondContact O-N 3Å; S428-V430 PolarHBondContact O-N 3.33Å; S428-D587 WeakPolarHBondContact O-CA 3.28Å; S428-D587 WeakPolarHBondContact O-CB 3.29Å; S428-A588 PolarHBondContact O-N 2.82Å
429	F	83.3	Confident	87.6	Confident	9 Å²	9	26 Å²	26	4%	0.039	13%	0.126	C	C	.	.			trans	-82.8	106.4	-175.1	-71	9.3	0	0	0	111.9	I375 M377 F403 L407 V423 S426 P427 L432 M434 H460 L461	I375-F429 HydrophobicContact CG2-CE2 3.67Å; I375-F429 HydrophobicContact CG2-CZ 3.66Å; M377-F429 HydrophobicContact CB-CE1 3.68Å; M377-F429 HydrophobicContact CB-CZ 3.84Å; M377-F429 HydrophobicContact CG-CE1 3.68Å; M377-F429 HydrophobicContact CG-CZ 3.49Å; M377-F429 VanDerWaalsContact CG-CZ 3.49Å; F403-F429 HydrophobicContact CE1-CD1 4.48Å; F403-F429 HydrophobicContact CE1-CE1 4.22Å; L407-F429 HydrophobicContact CD1-CD1 4.45Å; L407-F429 HydrophobicContact CD1-CE1 3.48Å; L407-F429 VanDerWaalsContact CD1-CE1 3.48Å; L407-F429 HydrophobicContact CD1-CZ 4Å; V423-F429 HydrophobicContact CG1-CD2 3.8Å; V423-F429 HydrophobicContact CG1-CE2 3.87Å; S426-F429 PolarHBondContact O-N 2.72Å; P427-F429 PolarHBondContact O-N 2.99Å; F429-L432 HydrophobicContact CD2-CD2 4.42Å; F429-M434 HydrophobicContact CD2-CE 3.97Å; F429-M434 HydrophobicContact CE2-CE 3.46Å; F429-M434 VanDerWaalsContact CE2-CE 3.46Å; F429-M434 HydrophobicContact CE2-SD 4.4Å; F429-M434 HydrophobicContact CZ-CE 4.09Å; F429-H460 CarbonylContact O-C 3.44Å; F429-L461 WeakPolarHBondContact O-CA 3.28Å; F429-L461 PolarHBondContact O-N 3.05Å; F429-L461 VanDerWaalsContact O-N 3.17Å
430	V	80.6	Confident	87.5	Confident	28 Å²	28	25.7 Å²	25.7	17%	0.17	13%	0.126	C	C	.	.	S	Bend	trans	-81.5	-27.6	170.9	-178.8	0	0	0	0	111.8	S428 S462 K463 A588	S428-V430 PolarHBondContact O-N 3.33Å; V430-S462 WeakPolarHBondContact CG1-OG 3.09Å; V430-S462 PolarHBondContact O-N 2.81Å; V430-S462 PolarHBondContact O-OG 2.9Å; V430-K463 PolarHBondContact O-N 2.87Å; V430-A588 HydrophobicContact CG2-CB 4.4Å
431	S	86.5	Confident	87.5	Confident	20 Å²	20	24.5 Å²	24.5	14%	0.14	12%	0.122	C	C	.	.	B	Isolated β-bridge	trans	-148.1	156.5	179.5	168.3	0	0	0	0	111.5	N433 K463 L464	S431-N433 PolarHBondContact O-N 3.25Å; S431-N433 WeakPolarHBondContact OG-CB 3.23Å; S431-N433 PolarHBondContact OG-N 2.94Å; S431-K463 WeakPolarHBondContact CA-O 3.29Å; S431-L464 PolarHBondContact OG-O 2.86Å
432	L	89.8	Confident	87.4	Confident	1 Å²	1	27.8 Å²	27.8	1%	0.005	13%	0.134	C	C	.	.	S	Bend	trans	-84.2	13.6	172.3	-55.7	-173.5	0	0	0	113.9	V423 F429 M434 L435 V455 L461 L464 W465	V423-L432 HydrophobicContact CG1-CD2 4.15Å; V423-L432 HydrophobicContact CG2-CD2 4.41Å; F429-L432 HydrophobicContact CD2-CD2 4.42Å; L432-M434 HydrophobicContact CD2-CE 4.2Å; L432-M434 PolarHBondContact O-N 3.43Å; L432-M434 VanDerWaalsContact O-N 3.12Å; L432-L435 PolarHBondContact O-N 3.35Å; L432-L435 VanDerWaalsContact O-N 3.11Å; L432-V455 HydrophobicContact CD1-CG2 4.5Å; L432-L461 HydrophobicContact CD2-CD1 3.8Å; L432-L461 HydrophobicContact CD2-CD2 4.14Å; L432-L461 HydrophobicContact CG-CD1 4.06Å; L432-L461 HydrophobicContact CG-CD2 4.47Å; L432-L464 HydrophobicContact CD1-CD2 3.78Å; L432-L464 HydrophobicContact CG-CD2 4.29Å; L432-L464 PolarHBondContact N-O 2.94Å; L432-W465 HydrophobicContact CB-CD2 4.44Å; L432-W465 HydrophobicContact CB-CG 4.39Å; L432-W465 HydrophobicContact CD1-CH2 4.17Å; L432-W465 HydrophobicContact CD1-CZ2 3.7Å; L432-W465 PolarHBondContact O-NE1 3.26Å
433	N	86.7	Confident	87.2	Confident	36 Å²	36	26.8 Å²	26.8	19%	0.193	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-66.5	-12.4	-172.9	-156.1	68.1	0	0	0	115	S431 L435 K436	S431-N433 PolarHBondContact O-N 3.25Å; S431-N433 WeakPolarHBondContact OG-CB 3.23Å; S431-N433 PolarHBondContact OG-N 2.94Å; N433-L435 PolarHBondContact O-N 3.38Å; N433-L435 VanDerWaalsContact O-N 3.07Å; N433-K436 VanDerWaalsContact O-CB 3.29Å; N433-K436 WeakPolarHBondContact O-CB 3.25Å; N433-K436 PolarHBondContact O-N 3.38Å
434	M	84.9	Confident	87.1	Confident	12 Å²	12	32.7 Å²	32.7	6%	0.059	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-60.3	-16	169.3	74.4	-65.9	175.2	0	0	113.1	I375 L407 L411 G412 F429 L432	I375-M434 HydrophobicContact CD1-CE 4.11Å; L407-M434 HydrophobicContact CB-CB 4.06Å; L407-M434 HydrophobicContact CB-CG 4.43Å; L411-M434 CarbonylContact C-O 3.5Å; L411-M434 WeakPolarHBondContact CB-O 3.45Å; L411-M434 HydrophobicContact CD1-CG 3.96Å; G412-M434 VanDerWaalsContact CA-O 3.25Å; G412-M434 WeakPolarHBondContact CA-O 3.46Å; G412-M434 PolarHBondContact N-O 2.99Å; G412-M434 VanDerWaalsContact N-O 3.16Å; F429-M434 HydrophobicContact CD2-CE 3.97Å; F429-M434 HydrophobicContact CE2-CE 3.46Å; F429-M434 VanDerWaalsContact CE2-CE 3.46Å; F429-M434 HydrophobicContact CE2-SD 4.4Å; F429-M434 HydrophobicContact CZ-CE 4.09Å; L432-M434 HydrophobicContact CD2-CE 4.2Å; L432-M434 PolarHBondContact O-N 3.43Å; L432-M434 VanDerWaalsContact O-N 3.12Å
435	L	90.4	Very high	87.2	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.005	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-102.7	33.3	170.8	-69.8	168.5	0	0	0	112.6	L373 I375 L411 I414 L421 L432 N433 N437 L438	L373-L435 HydrophobicContact CD2-CD2 4.47Å; I375-L435 HydrophobicContact CD1-CD1 4.27Å; L411-L435 HydrophobicContact CB-CD2 4.04Å; I414-L435 HydrophobicContact CB-CD2 4.22Å; I414-L435 HydrophobicContact CD1-CD2 3.99Å; L421-L435 HydrophobicContact CD1-CD1 4.01Å; L421-L435 HydrophobicContact CD2-CD1 3.91Å; L432-L435 PolarHBondContact O-N 3.35Å; L432-L435 VanDerWaalsContact O-N 3.11Å; N433-L435 PolarHBondContact O-N 3.38Å; N433-L435 VanDerWaalsContact O-N 3.07Å; L435-N437 PolarHBondContact O-N 3.38Å; L435-L438 HydrophobicContact CB-CB 4.26Å; L435-L438 HydrophobicContact CD1-CD2 4.47Å; L435-L438 VanDerWaalsContact O-CB 3.3Å; L435-L438 WeakPolarHBondContact O-CB 3.35Å; L435-L438 PolarHBondContact O-N 3.46Å
436	K	86.2	Confident	87.6	Confident	81 Å²	81	34.6 Å²	34.6	35%	0.352	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-30.4	-175.1	59.1	-178.4	178.8	-176.2	0	116	E408 N433 R439	E408-K436 HydrophobicContact CG-CD 4.14Å; E408-K436 WeakPolarHBondContact OE1-CD 3.4Å; E408-K436 VanDerWaalsContact OE1-CE 3.28Å; E408-K436 WeakPolarHBondContact OE1-CE 3.18Å; E408-K436 IonicContact OE1-NZ 2.82Å; E408-K436 PolarHBondContact OE1-NZ 2.8Å; N433-K436 VanDerWaalsContact O-CB 3.29Å; N433-K436 WeakPolarHBondContact O-CB 3.25Å; N433-K436 PolarHBondContact O-N 3.38Å; K436-R439 PolarHBondContact O-NH1 2.91Å; K436-R439 PolarHBondContact O-NH2 2.69Å; K436-R439 VanDerWaalsContact O-NH2 3.14Å
437	N	87.9	Confident	88	Confident	47 Å²	47	37.8 Å²	37.8	25%	0.251	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	1.3	179	-75.2	-43.2	0	0	0	115.1	G412 I414 R415 L435 R439	G412-N437 WeakPolarHBondContact O-CB 3.31Å; G412-N437 PolarHBondContact O-ND2 3.28Å; I414-N437 CarbonylContact O-C 3.53Å; R415-N437 WeakPolarHBondContact CA-O 3.4Å; R415-N437 HydrophobicContact CG-CB 4.32Å; L435-N437 PolarHBondContact O-N 3.38Å; N437-R439 WeakPolarHBondContact O-CG 3.35Å; N437-R439 PolarHBondContact O-N 2.73Å; N437-R439 PolarHBondContact O-NH1 3.42Å
438	L	92	Very high	88.8	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.194	C	C	.	.			trans	-65.4	126.9	-179.4	-175.1	64.7	0	0	0	110.9	I414 I417 L421 L435 I441 L474	I414-L438 HydrophobicContact CG2-CD1 4.22Å; I414-L438 VanDerWaalsContact O-CA 3.28Å; I414-L438 WeakPolarHBondContact O-CA 3.4Å; I414-L438 PolarHBondContact O-N 2.96Å; I417-L438 HydrophobicContact CD1-CD1 3.89Å; I417-L438 HydrophobicContact CD1-CD2 4.19Å; I417-L438 HydrophobicContact CG1-CD1 3.91Å; L421-L438 HydrophobicContact CD2-CD2 3.96Å; L435-L438 HydrophobicContact CB-CB 4.26Å; L435-L438 HydrophobicContact CD1-CD2 4.47Å; L435-L438 VanDerWaalsContact O-CB 3.3Å; L435-L438 WeakPolarHBondContact O-CB 3.35Å; L435-L438 PolarHBondContact O-N 3.46Å; L438-I441 HydrophobicContact CD1-CG1 4.49Å; L438-I441 HydrophobicContact CD2-CD1 4.25Å; L438-I441 HydrophobicContact CD2-CG1 4.4Å; L438-L474 HydrophobicContact CD2-CD1 4.38Å; L438-L474 HydrophobicContact CG-CD1 4Å
439	R	90.1	Very high	89.7	Confident	73 Å²	73	49.3 Å²	49.3	28%	0.275	23%	0.234	S	C	.	.			trans	-127.6	-26.6	-178.1	-58	-57.6	171.9	-105.1	-1.8	113.9	R415 K436 N437 G472 K475	R415-R439 PolarHBondContact O-N 3.38Å; K436-R439 PolarHBondContact O-NH1 2.91Å; K436-R439 PolarHBondContact O-NH2 2.69Å; K436-R439 VanDerWaalsContact O-NH2 3.14Å; N437-R439 WeakPolarHBondContact O-CG 3.35Å; N437-R439 PolarHBondContact O-N 2.73Å; N437-R439 PolarHBondContact O-NH1 3.42Å; R439-G472 WeakPolarHBondContact CD-O 3.36Å; R439-G472 PolarHBondContact NE-O 2.63Å; R439-K475 PolarHBondContact O-N 2.95Å
440	V	92.5	Very high	90.1	Very high	30 Å²	30	52.2 Å²	52.2	18%	0.182	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	133.4	-176.9	-177.4	0	0	0	0	111.2	R415 E416 I417 R442 K475 E477	R415-V440 PolarHBondContact O-N 3.42Å; E416-V440 CarbonylContact C-O 3.53Å; E416-V440 VanDerWaalsContact CA-O 3.31Å; E416-V440 WeakPolarHBondContact CA-O 3.06Å; E416-V440 HydrophobicContact CB-CB 4.44Å; E416-V440 HydrophobicContact CG-CB 4.16Å; E416-V440 HydrophobicContact CG-CG1 4.31Å; I417-V440 PolarHBondContact N-O 3Å; V440-R442 HydrophobicContact CG1-CG 3.97Å; V440-K475 CarbonylContact C-O 3.54Å; V440-K475 WeakPolarHBondContact CA-O 3.21Å; V440-E477 HydrophobicContact CG1-CG 4.1Å
441	I	95.3	Very high	90.8	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	119.3	160.6	-56.6	178.9	0	0	0	107.5	I417 H419 L421 L438 A452 I453 L474 K475 I476 E477	I417-I441 HydrophobicContact CB-CG1 4.41Å; I417-I441 CarbonylContact O-C 3.57Å; I417-I441 VanDerWaalsContact O-CA 3.28Å; I417-I441 WeakPolarHBondContact O-CA 3.24Å; H419-I441 VanDerWaalsContact O-CG2 3.23Å; H419-I441 WeakPolarHBondContact O-CG2 3.4Å; L421-I441 HydrophobicContact CB-CD1 3.88Å; L421-I441 HydrophobicContact CD2-CD1 4.33Å; L438-I441 HydrophobicContact CD1-CG1 4.49Å; L438-I441 HydrophobicContact CD2-CD1 4.25Å; L438-I441 HydrophobicContact CD2-CG1 4.4Å; I441-A452 HydrophobicContact CG2-CB 4.14Å; I441-I453 HydrophobicContact CD1-CD1 3.74Å; I441-I453 HydrophobicContact CD1-CG1 3.53Å; I441-L474 HydrophobicContact CG1-CD1 4.41Å; I441-K475 PolarHBondContact N-O 3.49Å; I441-I476 CarbonylContact O-C 3.35Å; I441-I476 WeakPolarHBondContact O-CA 3.47Å; I441-E477 PolarHBondContact O-N 3.45Å
442	R	94.5	Very high	91.2	Very high	70 Å²	70	50.9 Å²	50.9	26%	0.264	24%	0.235	S	C	.	.			trans	-83.9	-30.3	-172.9	-51.1	-168.4	174.8	-85.5	-0.2	114.2	E416 I417 T418 V440 Q444 E477 Q478	E416-R442 VanDerWaalsContact CD-NE 3.27Å; E416-R442 IonicContact OE1-CZ 2.62Å; E416-R442 VanDerWaalsContact OE1-CZ 3.3Å; E416-R442 IonicContact OE1-NE 2.63Å; E416-R442 PolarHBondContact OE1-NE 2.67Å; E416-R442 IonicContact OE1-NH2 2.67Å; E416-R442 PolarHBondContact OE1-NH2 3.03Å; E416-R442 IonicContact OE2-CZ 2.89Å; E416-R442 IonicContact OE2-NE 2.69Å; E416-R442 IonicContact OE2-NH2 2.97Å; E416-R442 PolarHBondContact OE2-NH2 3.1Å; I417-R442 PolarHBondContact O-N 2.84Å; T418-R442 WeakPolarHBondContact O-CB 3.33Å; V440-R442 HydrophobicContact CG1-CG 3.97Å; R442-Q444 HydrophobicContact CB-CG 4.13Å; R442-E477 VanDerWaalsContact CG-OE2 3.27Å; R442-E477 WeakPolarHBondContact CG-OE2 3.35Å; R442-E477 IonicContact CZ-OE2 3.65Å; R442-E477 IonicContact NH1-OE1 3.64Å; R442-E477 IonicContact NH1-OE2 3.31Å; R442-E477 PolarHBondContact NH1-OE2 2.84Å; R442-Q478 PolarHBondContact O-N 2.82Å
443	G	92.7	Very high	91.4	Very high	2 Å²	2	50.9 Å²	50.9	2%	0.021	24%	0.235	C	C	.	.			trans	68.3	32.3	-178.4	0	0	0	0	0	114.3	T418 H419 E445 L446	T418-G443 PolarHBondContact O-N 2.77Å; H419-G443 VanDerWaalsContact O-CA 3.29Å; H419-G443 WeakPolarHBondContact O-CA 3.39Å; H419-G443 PolarHBondContact O-N 3.35Å; G443-E445 CarbonylContact C-O 3.17Å; G443-E445 PolarHBondContact O-N 2.99Å; G443-L446 VanDerWaalsContact CA-CD2 3.49Å
444	Q	92.2	Very high	91.9	Very high	125 Å²	125	49.2 Å²	49.2	58%	0.584	23%	0.227	S	C	*	.	S	Bend	trans	-61.7	-34.1	177.4	-69	176.3	-17	0	0	112.5	T418 R442	T418-Q444 WeakPolarHBondContact O-CB 3.32Å; T418-Q444 WeakPolarHBondContact O-CG 3.22Å; T418-Q444 PolarHBondContact O-N 3.47Å; R442-Q444 HydrophobicContact CB-CG 4.13Å
445	E	92.3	Very high	92.4	Very high	114 Å²	114	48.7 Å²	48.7	53%	0.533	22%	0.224	S	C	.	.	S	Bend	trans	-123.7	150.5	158	-162.8	-171.8	160	0	0	107.5	H419 G443	H419-E445 CarbonylContact C-O 3.08Å; H419-E445 WeakPolarHBondContact CA-O 3.49Å; H419-E445 HydrophobicContact CB-CB 4Å; H419-E445 WeakPolarHBondContact CD2-CB 3.42Å; H419-E445 IonicContact CD2-OE2 2.63Å; H419-E445 PolarHBondContact CD2-OE2 2.73Å; H419-E445 IonicContact NE2-OE2 3.28Å; G443-E445 CarbonylContact C-O 3.17Å; G443-E445 PolarHBondContact O-N 2.99Å
446	L	94	Very high	92.5	Very high	34 Å²	34	50.5 Å²	50.5	18%	0.178	23%	0.233	C	C	.	.			trans	-125.7	139.3	-173.5	-63.9	178.9	0	0	0	111	G443 N448 E449 A452	G443-L446 VanDerWaalsContact CA-CD2 3.49Å; L446-N448 PolarHBondContact O-N 2.99Å; L446-E449 PolarHBondContact O-N 3.15Å; L446-A452 HydrophobicContact CD2-CB 4.1Å
447	W	91.7	Very high	92.7	Very high	67 Å²	67	49.9 Å²	49.9	25%	0.254	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-61.5	127.1	174.6	177.4	-117.9	0	0	0	109.8	Y420 K422 E449 K450 Y451	Y420-W447 HydrophobicContact CD1-CB 4.12Å; Y420-W447 VanDerWaalsContact CD1-N 3.28Å; Y420-W447 HydrophobicContact CD2-CB 3.68Å; Y420-W447 HydrophobicContact CE1-CB 4.24Å; Y420-W447 HydrophobicContact CE2-CB 3.81Å; Y420-W447 HydrophobicContact CE2-CD2 4.37Å; Y420-W447 HydrophobicContact CE2-CE3 4.04Å; Y420-W447 HydrophobicContact CE2-CG 4.32Å; Y420-W447 HydrophobicContact CG-CB 3.85Å; Y420-W447 AromaticContact CZ-CE3 3.77Å; K422-W447 HydrophobicContact CD-CD2 3.82Å; K422-W447 HydrophobicContact CD-CE3 4.11Å; K422-W447 HydrophobicContact CD-CG 4.26Å; K422-W447 HydrophobicContact CD-CH2 4.49Å; K422-W447 HydrophobicContact CD-CZ2 4.16Å; K422-W447 HydrophobicContact CD-CZ3 4.44Å; K422-W447 VanDerWaalsContact NZ-CZ3 3.3Å; W447-E449 PolarHBondContact O-N 2.82Å; W447-K450 PolarHBondContact O-N 3.14Å; W447-K450 VanDerWaalsContact O-N 3.1Å; W447-Y451 PolarHBondContact N-O 2.76Å; W447-Y451 VanDerWaalsContact O-CD2 3.31Å; W447-Y451 WeakPolarHBondContact O-CD2 3.39Å; W447-Y451 PolarHBondContact O-N 2.97Å
448	N	89.9	Confident	92.7	Very high	102 Å²	102	47.6 Å²	47.6	55%	0.545	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.4	41	-170.4	-60.9	-39.2	0	0	0	113.1	L446 K450 Y451	L446-N448 PolarHBondContact O-N 2.99Å; N448-K450 WeakPolarHBondContact O-CB 3.5Å; N448-K450 PolarHBondContact O-N 3.31Å; N448-Y451 HydrophobicContact CB-CD2 4.43Å; N448-Y451 HydrophobicContact CB-CE2 4.43Å
449	E	90.4	Very high	92.3	Very high	184 Å²	184	52.8 Å²	52.8	86%	0.86	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	60	9.2	-180	-56.5	176.7	179.1	0	0	114.8	L446 W447	L446-E449 PolarHBondContact O-N 3.15Å; W447-E449 PolarHBondContact O-N 2.82Å
450	K	91.7	Very high	92.1	Very high	69 Å²	69	53.2 Å²	53.2	30%	0.3	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136.5	-35.5	-167.1	-175.6	175.6	170	-165.8	0	115.6	W447 N448 K480 D511	W447-K450 PolarHBondContact O-N 3.14Å; W447-K450 VanDerWaalsContact O-N 3.1Å; N448-K450 WeakPolarHBondContact O-CB 3.5Å; N448-K450 PolarHBondContact O-N 3.31Å; K450-K480 HydrophobicContact CG-CG 4.37Å; K450-K480 PolarHBondContact O-N 3.39Å; K450-D511 VanDerWaalsContact CE-OD2 3.3Å; K450-D511 WeakPolarHBondContact CE-OD2 3.5Å; K450-D511 IonicContact NZ-OD1 3.72Å; K450-D511 PolarHBondContact NZ-OD1 2.82Å; K450-D511 IonicContact NZ-OD2 3.61Å; K450-D511 PolarHBondContact NZ-OD2 3.29Å
451	Y	94.2	Very high	91.9	Very high	21 Å²	21	51.8 Å²	51.8	8%	0.082	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	132.1	-167.7	-48.8	-72.4	0	0	0	113.2	Y420 W447 N448 K480 Q482 D511	Y420-Y451 WeakPolarHBondContact CB-O 3.49Å; W447-Y451 PolarHBondContact N-O 2.76Å; W447-Y451 VanDerWaalsContact O-CD2 3.31Å; W447-Y451 WeakPolarHBondContact O-CD2 3.39Å; W447-Y451 PolarHBondContact O-N 2.97Å; N448-Y451 HydrophobicContact CB-CD2 4.43Å; N448-Y451 HydrophobicContact CB-CE2 4.43Å; Y451-K480 CarbonylContact C-O 3.57Å; Y451-K480 VanDerWaalsContact CA-O 3.31Å; Y451-K480 WeakPolarHBondContact CA-O 3.44Å; Y451-K480 HydrophobicContact CD1-CB 3.98Å; Y451-K480 HydrophobicContact CE1-CB 4.45Å; Y451-Q482 HydrophobicContact CD1-CB 3.58Å; Y451-Q482 HydrophobicContact CD1-CG 4.46Å; Y451-Q482 HydrophobicContact CD2-CB 4.22Å; Y451-Q482 HydrophobicContact CE1-CB 3.84Å; Y451-Q482 HydrophobicContact CE1-CG 4.31Å; Y451-Q482 HydrophobicContact CE2-CB 4.46Å; Y451-Q482 HydrophobicContact CE2-CG 4.46Å; Y451-Q482 HydrophobicContact CG-CB 3.77Å; Y451-D511 HydrophobicContact CE1-CB 4.2Å; Y451-D511 PolarHBondContact OH-OD1 3.16Å
452	A	95.1	Very high	91.4	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	-25.5	172	0	0	0	0	0	112.4	Y420 L421 I441 L446 I476 Q478 K480	Y420-A452 WeakPolarHBondContact CA-O 3.46Å; L421-A452 PolarHBondContact N-O 3.35Å; I441-A452 HydrophobicContact CG2-CB 4.14Å; L446-A452 HydrophobicContact CD2-CB 4.1Å; A452-I476 HydrophobicContact CB-CG2 3.65Å; A452-Q478 VanDerWaalsContact CB-O 3.28Å; A452-Q478 WeakPolarHBondContact CB-O 3.34Å; A452-K480 PolarHBondContact N-O 3.48Å
453	I	95.5	Very high	91	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	126.2	171.3	-61.9	-175.3	0	0	0	108.4	L421 I441 V455 W465 L474 I476 K480 L481 Q482 F483	L421-I453 CarbonylContact O-C 3.54Å; L421-I453 VanDerWaalsContact O-CA 3.3Å; L421-I453 WeakPolarHBondContact O-CA 3.39Å; I441-I453 HydrophobicContact CD1-CD1 3.74Å; I441-I453 HydrophobicContact CD1-CG1 3.53Å; I453-V455 HydrophobicContact CG2-CG2 3.79Å; I453-W465 HydrophobicContact CD1-CH2 4.11Å; I453-L474 HydrophobicContact CD1-CD2 4.15Å; I453-I476 HydrophobicContact CD1-CD1 3.75Å; I453-I476 HydrophobicContact CD1-CG1 4.48Å; I453-I476 HydrophobicContact CG1-CD1 4.12Å; I453-K480 PolarHBondContact N-O 2.63Å; I453-L481 HydrophobicContact CB-CD2 3.87Å; I453-L481 HydrophobicContact CD1-CD2 3.98Å; I453-L481 HydrophobicContact CG1-CD2 4.19Å; I453-L481 CarbonylContact O-C 3.53Å; I453-Q482 PolarHBondContact O-N 2.93Å; I453-F483 HydrophobicContact CG2-CE2 4.19Å; I453-F483 HydrophobicContact CG2-CZ 4.14Å
454	S	95.6	Very high	90.8	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.014	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	112.9	174	-172.7	0	0	0	0	111	L421 K422 V423 I456 Q482	L421-S454 PolarHBondContact O-N 3.02Å; K422-S454 CarbonylContact C-O 3.59Å; K422-S454 VanDerWaalsContact CA-O 3.28Å; K422-S454 WeakPolarHBondContact CA-O 3.39Å; V423-S454 PolarHBondContact N-O 2.88Å; S454-I456 WeakPolarHBondContact OG-CD1 3.29Å; S454-Q482 WeakPolarHBondContact CA-O 3.27Å; S454-Q482 PolarHBondContact OG-OE1 3.23Å
455	V	95.4	Very high	90.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	105.4	-175.5	-179.2	0	0	0	0	109.2	V423 L432 I453 N458 L461 Q482 F483 H484 N486	V423-V455 HydrophobicContact CB-CG2 4.42Å; V423-V455 VanDerWaalsContact O-CA 3.31Å; V423-V455 WeakPolarHBondContact O-CA 3.3Å; L432-V455 HydrophobicContact CD1-CG2 4.5Å; I453-V455 HydrophobicContact CG2-CG2 3.79Å; V455-N458 WeakPolarHBondContact CG1-ND2 3.38Å; V455-L461 HydrophobicContact CG1-CD2 3.57Å; V455-Q482 PolarHBondContact N-O 3.34Å; V455-F483 HydrophobicContact CB-CD1 3.64Å; V455-F483 HydrophobicContact CB-CE1 3.55Å; V455-F483 HydrophobicContact CB-CG 4.34Å; V455-F483 HydrophobicContact CB-CZ 4.18Å; V455-F483 HydrophobicContact CG1-CD1 4.04Å; V455-F483 HydrophobicContact CG1-CE1 3.92Å; V455-F483 HydrophobicContact CG2-CD1 4.27Å; V455-F483 HydrophobicContact CG2-CE1 3.68Å; V455-F483 HydrophobicContact CG2-CZ 3.9Å; V455-F483 WeakPolarHBondContact O-CA 3.48Å; V455-H484 PolarHBondContact O-N 3.3Å; V455-N486 PolarHBondContact O-ND2 3.18Å
456	I	93	Very high	89.1	Confident	40 Å²	40	49.4 Å²	49.4	21%	0.205	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	132.7	-164.2	-63.7	179.7	0	0	0	112.6	V423 S424 F425 S454 N458 Q482 H484	V423-I456 PolarHBondContact O-N 3.01Å; S424-I456 WeakPolarHBondContact CA-O 3.05Å; F425-I456 PolarHBondContact N-O 3.1Å; S454-I456 WeakPolarHBondContact OG-CD1 3.29Å; I456-N458 VanDerWaalsContact C-N 3.32Å; I456-N458 PolarHBondContact N-ND2 3.47Å; I456-N458 PolarHBondContact O-N 2.76Å; I456-N458 PolarHBondContact O-ND2 2.85Å; I456-Q482 HydrophobicContact CD1-CG 4.19Å; I456-H484 WeakPolarHBondContact CA-O 3.29Å
457	E	89.8	Confident	87.5	Confident	67 Å²	67	50.3 Å²	50.3	31%	0.313	24%	0.239	S	C	.	.	S	Bend	trans	61	32.8	172.4	-61.2	-83.8	-170.4	0	0	114.1	F425 H484 N485	F425-E457 HydrophobicContact CD1-CB 3.6Å; F425-E457 HydrophobicContact CD1-CG 4.24Å; F425-E457 HydrophobicContact CE1-CB 3.53Å; F425-E457 HydrophobicContact CE1-CG 3.62Å; F425-E457 HydrophobicContact CG-CB 4.28Å; F425-E457 HydrophobicContact CZ-CB 4.16Å; F425-E457 HydrophobicContact CZ-CG 4.01Å; E457-H484 PolarHBondContact N-O 3.46Å; E457-H484 VanDerWaalsContact N-O 3.13Å; E457-N485 VanDerWaalsContact CA-O 3.24Å; E457-N485 WeakPolarHBondContact CA-O 3.02Å; E457-N485 VanDerWaalsContact CD-ND2 3.34Å; E457-N485 HydrophobicContact CG-CB 4.1Å; E457-N485 PolarHBondContact N-O 2.78Å; E457-N485 PolarHBondContact OE1-ND2 2.91Å
458	N	89.6	Confident	85.7	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.255	C	S	.	.			trans	-96.4	98.1	176.9	-52.9	-71.2	0	0	0	109.6	V423 S424 F425 S426 V455 I456 H460 L461 N486	V423-N458 PolarHBondContact O-ND2 3.04Å; S424-N458 WeakPolarHBondContact CA-OD1 3.41Å; F425-N458 PolarHBondContact N-OD1 2.04Å; S426-N458 PolarHBondContact N-OD1 2.84Å; V455-N458 WeakPolarHBondContact CG1-ND2 3.38Å; I456-N458 VanDerWaalsContact C-N 3.32Å; I456-N458 PolarHBondContact N-ND2 3.47Å; I456-N458 PolarHBondContact O-N 2.76Å; I456-N458 PolarHBondContact O-ND2 2.85Å; N458-H460 PolarHBondContact O-N 3.08Å; N458-L461 HydrophobicContact CB-CB 3.82Å; N458-L461 HydrophobicContact CB-CD2 4.13Å; N458-L461 PolarHBondContact O-N 3.27Å; N458-N486 WeakPolarHBondContact CB-OD1 3.26Å; N458-N486 PolarHBondContact N-OD1 2.82Å; N458-N486 PolarHBondContact ND2-OD1 2.81Å; N458-N486 VanDerWaalsContact ND2-OD1 3.15Å
459	Q	83.8	Confident	83.7	Confident	109 Å²	109	54.8 Å²	54.8	51%	0.509	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-45.6	-163.2	-65	-170.7	0.6	0	0	114.2	H488	Q459-H488 PolarHBondContact O-CD2 3.1Å
460	H	84.9	Confident	81.6	Confident	82 Å²	82	48.9 Å²	48.9	38%	0.38	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	2.4	-176	-57.5	-92.8	0	0	0	113.9	P427 F429 N458 S462 A588	P427-H460 WeakPolarHBondContact O-CB 3.31Å; P427-H460 PolarHBondContact O-CD2 3.03Å; F429-H460 CarbonylContact O-C 3.44Å; N458-H460 PolarHBondContact O-N 3.08Å; H460-S462 PolarHBondContact O-N 2.89Å; H460-S462 VanDerWaalsContact O-N 3.11Å; H460-A588 HydrophobicContact CB-CB 3.78Å
461	L	88.9	Confident	79.2	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.294	C	S	.	.			trans	-64.3	115.9	179.9	-174.3	66.1	0	0	0	109.3	F429 L432 V455 N458 K463 H488 L489	F429-L461 WeakPolarHBondContact O-CA 3.28Å; F429-L461 PolarHBondContact O-N 3.05Å; F429-L461 VanDerWaalsContact O-N 3.17Å; L432-L461 HydrophobicContact CD2-CD1 3.8Å; L432-L461 HydrophobicContact CD2-CD2 4.14Å; L432-L461 HydrophobicContact CG-CD1 4.06Å; L432-L461 HydrophobicContact CG-CD2 4.47Å; V455-L461 HydrophobicContact CG1-CD2 3.57Å; N458-L461 HydrophobicContact CB-CB 3.82Å; N458-L461 HydrophobicContact CB-CD2 4.13Å; N458-L461 PolarHBondContact O-N 3.27Å; L461-K463 WeakPolarHBondContact CD1-O 3.34Å; L461-H488 CarbonylContact O-C 3.49Å; L461-L489 HydrophobicContact CD2-CD2 4.27Å; L461-L489 WeakPolarHBondContact O-CA 3.43Å; L461-L489 WeakPolarHBondContact O-CB 3.47Å; L461-L489 PolarHBondContact O-N 3.38Å
462	S	85	Confident	77.4	Confident	35 Å²	35	51.6 Å²	51.6	25%	0.245	30%	0.302	C	S	.	.			trans	-115.9	-27.5	-172.9	67.6	0	0	0	0	113.3	V430 H460 H488	V430-S462 WeakPolarHBondContact CG1-OG 3.09Å; V430-S462 PolarHBondContact O-N 2.81Å; V430-S462 PolarHBondContact O-OG 2.9Å; H460-S462 PolarHBondContact O-N 2.89Å; H460-S462 VanDerWaalsContact O-N 3.11Å; S462-H488 WeakPolarHBondContact CA-O 3.44Å
463	K	85.7	Confident	76.3	Confident	82 Å²	82	59 Å²	59	36%	0.357	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-135.2	158.3	179.1	-63	-174.8	-179.4	-177.3	0	110.5	V430 S431 L461 V583	V430-K463 PolarHBondContact O-N 2.87Å; S431-K463 WeakPolarHBondContact CA-O 3.29Å; L461-K463 WeakPolarHBondContact CD1-O 3.34Å; K463-V583 HydrophobicContact CD-CG1 4.39Å; K463-V583 HydrophobicContact CD-CG2 4.08Å
464	L	88.2	Confident	76	Confident	12 Å²	12	59 Å²	59	6%	0.063	34%	0.335	C	S	.	.			trans	-89	-134.7	168.9	-57	179.7	0	0	0	109.1	S431 L432 F483 L489 L497	S431-L464 PolarHBondContact OG-O 2.86Å; L432-L464 HydrophobicContact CD1-CD2 3.78Å; L432-L464 HydrophobicContact CG-CD2 4.29Å; L432-L464 PolarHBondContact N-O 2.94Å; L464-F483 HydrophobicContact CD1-CZ 4.47Å; L464-F483 HydrophobicContact CD2-CE1 3.95Å; L464-F483 HydrophobicContact CD2-CZ 4.44Å; L464-L489 HydrophobicContact CD2-CD1 3.92Å; L464-L489 HydrophobicContact CD2-CD2 3.86Å; L464-L489 HydrophobicContact CG-CD1 4.02Å; L464-L497 HydrophobicContact CD1-CB 4.14Å; L464-L497 HydrophobicContact CD1-CD2 4.07Å
465	W	81.1	Confident	75.7	Confident	25 Å²	25	64.1 Å²	64.1	10%	0.095	36%	0.357	C	S	.	.			trans	-88.5	154.5	172.7	-36.6	-95	0	0	0	111.2	L421 L432 I453 F467 L474 L497	L421-W465 HydrophobicContact CD2-CZ2 4.49Å; L432-W465 HydrophobicContact CB-CD2 4.44Å; L432-W465 HydrophobicContact CB-CG 4.39Å; L432-W465 HydrophobicContact CD1-CH2 4.17Å; L432-W465 HydrophobicContact CD1-CZ2 3.7Å; L432-W465 PolarHBondContact O-NE1 3.26Å; I453-W465 HydrophobicContact CD1-CH2 4.11Å; W465-F467 HydrophobicContact CB-CD1 4.22Å; W465-F467 HydrophobicContact CB-CD2 4.21Å; W465-F467 HydrophobicContact CB-CE1 3.73Å; W465-F467 HydrophobicContact CB-CE2 3.74Å; W465-F467 HydrophobicContact CB-CG 4.43Å; W465-F467 HydrophobicContact CB-CZ 3.48Å; W465-F467 VanDerWaalsContact CB-CZ 3.48Å; W465-F467 AromaticContact CD2-CE2 3.83Å; W465-F467 HydrophobicContact CD2-CE2 3.83Å; W465-F467 AromaticContact CD2-CZ 3.71Å; W465-F467 HydrophobicContact CD2-CZ 3.71Å; W465-F467 AromaticContact CE3-CE2 3.58Å; W465-F467 HydrophobicContact CE3-CE2 3.58Å; W465-F467 AromaticContact CE3-CZ 3.97Å; W465-F467 HydrophobicContact CE3-CZ 3.97Å; W465-F467 HydrophobicContact CG-CE1 4.11Å; W465-F467 AromaticContact CG-CE2 3.92Å; W465-F467 HydrophobicContact CG-CE2 3.92Å; W465-F467 AromaticContact CG-CZ 3.5Å; W465-F467 HydrophobicContact CG-CZ 3.5Å; W465-F467 HydrophobicContact CZ3-CE2 4.48Å; W465-L474 HydrophobicContact CE3-CD2 4.44Å; W465-L474 HydrophobicContact CH2-CD2 3.91Å; W465-L474 HydrophobicContact CZ2-CD2 4.24Å; W465-L474 HydrophobicContact CZ3-CD2 4.02Å; W465-L497 HydrophobicContact CH2-CD1 4.42Å; W465-L497 HydrophobicContact CH2-CD2 4.13Å; W465-L497 HydrophobicContact CZ3-CD1 3.72Å; W465-L497 HydrophobicContact CZ3-CD2 3.87Å; W465-L497 HydrophobicContact CZ3-CG 4.34Å
466	N	66.7	Low	75.5	Confident	107 Å²	107	64.9 Å²	64.9	57%	0.572	36%	0.361	S	S	*	.			trans	-101.4	84.3	174.1	-174.4	16.5	0	0	0	112	T468	N466-T468 VanDerWaalsContact C-N 3.27Å; N466-T468 PolarHBondContact O-N 2.89Å; N466-T468 WeakPolarHBondContact OD1-CG2 3.38Å; N466-T468 PolarHBondContact OD1-OG1 3.06Å
467	F	62	Low	75.5	Confident	53 Å²	53	66.5 Å²	66.5	23%	0.232	37%	0.367	C	S	.	.			trans	-83.4	15.3	-178.6	-60	-52.4	0	0	0	114.9	W465 N469 L474	W465-F467 HydrophobicContact CB-CD1 4.22Å; W465-F467 HydrophobicContact CB-CD2 4.21Å; W465-F467 HydrophobicContact CB-CE1 3.73Å; W465-F467 HydrophobicContact CB-CE2 3.74Å; W465-F467 HydrophobicContact CB-CG 4.43Å; W465-F467 HydrophobicContact CB-CZ 3.48Å; W465-F467 VanDerWaalsContact CB-CZ 3.48Å; W465-F467 AromaticContact CD2-CE2 3.83Å; W465-F467 HydrophobicContact CD2-CE2 3.83Å; W465-F467 AromaticContact CD2-CZ 3.71Å; W465-F467 HydrophobicContact CD2-CZ 3.71Å; W465-F467 AromaticContact CE3-CE2 3.58Å; W465-F467 HydrophobicContact CE3-CE2 3.58Å; W465-F467 AromaticContact CE3-CZ 3.97Å; W465-F467 HydrophobicContact CE3-CZ 3.97Å; W465-F467 HydrophobicContact CG-CE1 4.11Å; W465-F467 AromaticContact CG-CE2 3.92Å; W465-F467 HydrophobicContact CG-CE2 3.92Å; W465-F467 AromaticContact CG-CZ 3.5Å; W465-F467 HydrophobicContact CG-CZ 3.5Å; W465-F467 HydrophobicContact CZ3-CE2 4.48Å; F467-N469 PolarHBondContact O-N 2.87Å; F467-L474 HydrophobicContact CE2-CB 3.82Å; F467-L474 HydrophobicContact CE2-CD2 4.39Å; F467-L474 HydrophobicContact CZ-CB 4.04Å; F467-L474 HydrophobicContact CZ-CD2 4.47Å
468	T	52.8	Low	75.6	Confident	96 Å²	96	69.1 Å²	69.1	59%	0.589	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-19.1	-162.8	50.8	0	0	0	0	116.4	N466	N466-T468 VanDerWaalsContact C-N 3.27Å; N466-T468 PolarHBondContact O-N 2.89Å; N466-T468 WeakPolarHBondContact OD1-CG2 3.38Å; N466-T468 PolarHBondContact OD1-OG1 3.06Å
469	N	48.2	Very low	75.7	Confident	166 Å²	166	70 Å²	70	89%	0.888	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.7	38.9	-171.5	-75.3	-26.2	0	0	0	114.5	F467	F467-N469 PolarHBondContact O-N 2.87Å
470	G	45.5	Very low	76.1	Confident	61 Å²	61	67.6 Å²	67.6	63%	0.629	38%	0.377	S	S	*	.	S	Bend	trans	-166.5	157.6	179.7	0	0	0	0	0	117.7	G472	G470-G472 PolarHBondContact O-N 2.81Å
471	A	41.1	Very low	76.6	Confident	120 Å²	120	64 Å²	64	99%	0.992	36%	0.36	S	S	*	.	S	Bend	trans	-76.2	75.4	-176.1	0	0	0	0	0	113.1
472	G	57.1	Low	76.9	Confident	26 Å²	26	65.1 Å²	65.1	27%	0.268	37%	0.365	S	S	.	.			trans	174.5	90.7	171.7	0	0	0	0	0	114.2	R439 G470	R439-G472 WeakPolarHBondContact CD-O 3.36Å; R439-G472 PolarHBondContact NE-O 2.63Å; G470-G472 PolarHBondContact O-N 2.81Å
473	K	73.2	Confident	77.4	Confident	155 Å²	155	63.4 Å²	63.4	67%	0.674	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-66.5	147.5	166.4	-69	-179.7	172.4	-172.2	0	110.2	K475 T500	K473-K475 PolarHBondContact O-N 2.98Å; K473-T500 HydrophobicContact CB-CG2 3.95Å; K473-T500 HydrophobicContact CD-CG2 4Å; K473-T500 HydrophobicContact CG-CG2 3.95Å
474	L	87.7	Confident	77.8	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.01	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-67.2	122.5	170.7	-178.8	57.5	0	0	0	110.1	L438 I441 I453 W465 F467 L497 T501	L438-L474 HydrophobicContact CD2-CD1 4.38Å; L438-L474 HydrophobicContact CG-CD1 4Å; I441-L474 HydrophobicContact CG1-CD1 4.41Å; I453-L474 HydrophobicContact CD1-CD2 4.15Å; W465-L474 HydrophobicContact CE3-CD2 4.44Å; W465-L474 HydrophobicContact CH2-CD2 3.91Å; W465-L474 HydrophobicContact CZ2-CD2 4.24Å; W465-L474 HydrophobicContact CZ3-CD2 4.02Å; F467-L474 HydrophobicContact CE2-CB 3.82Å; F467-L474 HydrophobicContact CE2-CD2 4.39Å; F467-L474 HydrophobicContact CZ-CB 4.04Å; F467-L474 HydrophobicContact CZ-CD2 4.47Å; L474-L497 HydrophobicContact CD2-CD1 4.14Å; L474-T501 WeakPolarHBondContact O-CG2 3.39Å
475	K	89.9	Confident	77.9	Confident	109 Å²	109	64 Å²	64	47%	0.474	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	134	172.5	-173.4	-167.7	179.6	-164.5	0	109.5	R439 V440 I441 K473 E477	R439-K475 PolarHBondContact O-N 2.95Å; V440-K475 CarbonylContact C-O 3.54Å; V440-K475 WeakPolarHBondContact CA-O 3.21Å; I441-K475 PolarHBondContact N-O 3.49Å; K473-K475 PolarHBondContact O-N 2.98Å; K475-E477 HydrophobicContact CD-CG 4.1Å; K475-E477 HydrophobicContact CG-CG 4.47Å; K475-E477 IonicContact NZ-OE1 3.72Å; K475-E477 PolarHBondContact NZ-OE1 3.18Å
476	I	91.9	Very high	78.5	Confident	15 Å²	15	62.8 Å²	62.8	8%	0.077	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	124.7	166	-62.1	171.6	0	0	0	106.2	I441 A452 I453 Q478 L481 T501 L503	I441-I476 CarbonylContact O-C 3.35Å; I441-I476 WeakPolarHBondContact O-CA 3.47Å; A452-I476 HydrophobicContact CB-CG2 3.65Å; I453-I476 HydrophobicContact CD1-CD1 3.75Å; I453-I476 HydrophobicContact CD1-CG1 4.48Å; I453-I476 HydrophobicContact CG1-CD1 4.12Å; I476-Q478 VanDerWaalsContact CG2-O 3.3Å; I476-Q478 WeakPolarHBondContact CG2-O 3.42Å; I476-L481 HydrophobicContact CD1-CD2 3.58Å; I476-T501 HydrophobicContact CD1-CG2 3.8Å; I476-T501 HydrophobicContact CG1-CG2 4.01Å; I476-L503 HydrophobicContact CB-CD1 4.28Å; I476-L503 HydrophobicContact CD1-CD1 3.72Å; I476-L503 HydrophobicContact CG2-CD1 4.29Å
477	E	92.2	Very high	79.5	Confident	75 Å²	75	58.6 Å²	58.6	35%	0.35	33%	0.333	S	S	.	.			trans	-89	-33.9	-176.1	-48	-160.9	119.1	0	0	112.7	V440 I441 R442 K475	V440-E477 HydrophobicContact CG1-CG 4.1Å; I441-E477 PolarHBondContact O-N 3.45Å; R442-E477 VanDerWaalsContact CG-OE2 3.27Å; R442-E477 WeakPolarHBondContact CG-OE2 3.35Å; R442-E477 IonicContact CZ-OE2 3.65Å; R442-E477 IonicContact NH1-OE1 3.64Å; R442-E477 IonicContact NH1-OE2 3.31Å; R442-E477 PolarHBondContact NH1-OE2 2.84Å; K475-E477 HydrophobicContact CD-CG 4.1Å; K475-E477 HydrophobicContact CG-CG 4.47Å; K475-E477 IonicContact NZ-OE1 3.72Å; K475-E477 PolarHBondContact NZ-OE1 3.18Å
478	Q	92.4	Very high	80.7	Confident	122 Å²	122	59.6 Å²	59.6	57%	0.57	34%	0.338	S	S	*	.	S	Bend	trans	-145.9	153.5	174	-57	-171.9	39.1	0	0	109.8	R442 A452 I476	R442-Q478 PolarHBondContact O-N 2.82Å; A452-Q478 VanDerWaalsContact CB-O 3.28Å; A452-Q478 WeakPolarHBondContact CB-O 3.34Å; I476-Q478 VanDerWaalsContact CG2-O 3.3Å; I476-Q478 WeakPolarHBondContact CG2-O 3.42Å
479	G	91.6	Very high	82.5	Confident	19 Å²	19	55 Å²	55	20%	0.196	31%	0.31	C	S	.	.			trans	88.2	162.9	173.8	0	0	0	0	0	115.9
480	K	92.5	Very high	84.4	Confident	57 Å²	57	47.9 Å²	47.9	25%	0.248	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	171.7	-169.3	-53.8	-151	173.5	-153.2	0	113.8	K450 Y451 A452 I453 E506	K450-K480 HydrophobicContact CG-CG 4.37Å; K450-K480 PolarHBondContact O-N 3.39Å; Y451-K480 CarbonylContact C-O 3.57Å; Y451-K480 VanDerWaalsContact CA-O 3.31Å; Y451-K480 WeakPolarHBondContact CA-O 3.44Å; Y451-K480 HydrophobicContact CD1-CB 3.98Å; Y451-K480 HydrophobicContact CE1-CB 4.45Å; A452-K480 PolarHBondContact N-O 3.48Å; I453-K480 PolarHBondContact N-O 2.63Å; K480-E506 HydrophobicContact CD-CB 4.33Å; K480-E506 WeakPolarHBondContact CD-OE2 3.22Å; K480-E506 WeakPolarHBondContact CE-OE1 3.46Å; K480-E506 WeakPolarHBondContact CE-OE2 3.32Å; K480-E506 WeakPolarHBondContact CG-OE2 3.04Å; K480-E506 IonicContact NZ-OE1 2.64Å; K480-E506 PolarHBondContact NZ-OE1 2.66Å; K480-E506 IonicContact NZ-OE2 2.71Å; K480-E506 PolarHBondContact NZ-OE2 2.86Å
481	L	94.2	Very high	86.4	Confident	7 Å²	7	48.7 Å²	48.7	4%	0.037	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	142.9	169.3	-57	-179.3	0	0	0	110.6	I453 I476 F483 L497 A498 L503 L507 V512	I453-L481 HydrophobicContact CB-CD2 3.87Å; I453-L481 HydrophobicContact CD1-CD2 3.98Å; I453-L481 HydrophobicContact CG1-CD2 4.19Å; I453-L481 CarbonylContact O-C 3.53Å; I476-L481 HydrophobicContact CD1-CD2 3.58Å; L481-F483 HydrophobicContact CB-CD2 4.16Å; L481-F483 HydrophobicContact CB-CE2 4.06Å; L481-F483 HydrophobicContact CD1-CE2 4.48Å; L481-F483 HydrophobicContact CD2-CE2 4.4Å; L481-L497 HydrophobicContact CD1-CD2 3.97Å; L481-L497 HydrophobicContact CD1-CG 4.12Å; L481-L497 HydrophobicContact CD2-CD2 4.04Å; L481-A498 HydrophobicContact CD1-CB 3.95Å; L481-L503 HydrophobicContact CD2-CD1 4.16Å; L481-L503 HydrophobicContact CG-CD1 3.94Å; L481-L507 HydrophobicContact CD1-CD2 4.42Å; L481-V512 HydrophobicContact CB-CG2 4.31Å
482	Q	95.1	Very high	88.4	Confident	23 Å²	23	47.1 Å²	47.1	11%	0.107	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	124.4	168.4	-175.4	176.9	38.8	0	0	110.3	Y451 I453 S454 V455 I456 D511	Y451-Q482 HydrophobicContact CD1-CB 3.58Å; Y451-Q482 HydrophobicContact CD1-CG 4.46Å; Y451-Q482 HydrophobicContact CD2-CB 4.22Å; Y451-Q482 HydrophobicContact CE1-CB 3.84Å; Y451-Q482 HydrophobicContact CE1-CG 4.31Å; Y451-Q482 HydrophobicContact CE2-CB 4.46Å; Y451-Q482 HydrophobicContact CE2-CG 4.46Å; Y451-Q482 HydrophobicContact CG-CB 3.77Å; I453-Q482 PolarHBondContact O-N 2.93Å; S454-Q482 WeakPolarHBondContact CA-O 3.27Å; S454-Q482 PolarHBondContact OG-OE1 3.23Å; V455-Q482 PolarHBondContact N-O 3.34Å; I456-Q482 HydrophobicContact CD1-CG 4.19Å; Q482-D511 CarbonylContact C-O 3.49Å; Q482-D511 VanDerWaalsContact CA-O 3.29Å; Q482-D511 WeakPolarHBondContact CA-O 3.3Å
483	F	95.5	Very high	89.9	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	116.7	-179.6	-75.9	-99.1	0	0	0	110.5	I453 V455 L464 L481 L489 I494 L497 D511 V512 S513 N517	I453-F483 HydrophobicContact CG2-CE2 4.19Å; I453-F483 HydrophobicContact CG2-CZ 4.14Å; V455-F483 HydrophobicContact CB-CD1 3.64Å; V455-F483 HydrophobicContact CB-CE1 3.55Å; V455-F483 HydrophobicContact CB-CG 4.34Å; V455-F483 HydrophobicContact CB-CZ 4.18Å; V455-F483 HydrophobicContact CG1-CD1 4.04Å; V455-F483 HydrophobicContact CG1-CE1 3.92Å; V455-F483 HydrophobicContact CG2-CD1 4.27Å; V455-F483 HydrophobicContact CG2-CE1 3.68Å; V455-F483 HydrophobicContact CG2-CZ 3.9Å; V455-F483 WeakPolarHBondContact O-CA 3.48Å; L464-F483 HydrophobicContact CD1-CZ 4.47Å; L464-F483 HydrophobicContact CD2-CE1 3.95Å; L464-F483 HydrophobicContact CD2-CZ 4.44Å; L481-F483 HydrophobicContact CB-CD2 4.16Å; L481-F483 HydrophobicContact CB-CE2 4.06Å; L481-F483 HydrophobicContact CD1-CE2 4.48Å; L481-F483 HydrophobicContact CD2-CE2 4.4Å; F483-L489 HydrophobicContact CD1-CD2 3.84Å; F483-L489 HydrophobicContact CE1-CD2 3.95Å; F483-I494 HydrophobicContact CB-CD1 3.79Å; F483-I494 HydrophobicContact CB-CG2 4.39Å; F483-I494 HydrophobicContact CD1-CD1 3.81Å; F483-I494 HydrophobicContact CD1-CG1 3.94Å; F483-I494 HydrophobicContact CD1-CG2 4.38Å; F483-I494 HydrophobicContact CD2-CG2 3.58Å; F483-I494 HydrophobicContact CE1-CG1 4.25Å; F483-I494 HydrophobicContact CE2-CG2 3.87Å; F483-I494 HydrophobicContact CG-CD1 3.86Å; F483-I494 HydrophobicContact CG-CG1 4.17Å; F483-I494 HydrophobicContact CG-CG2 3.88Å; F483-I494 HydrophobicContact CZ-CG2 4.39Å; F483-L497 HydrophobicContact CE2-CD2 4.05Å; F483-L497 HydrophobicContact CZ-CD2 3.9Å; F483-D511 PolarHBondContact N-O 2.91Å; F483-V512 HydrophobicContact CB-CG1 4.16Å; F483-V512 HydrophobicContact CB-CG2 4.22Å; F483-V512 HydrophobicContact CD2-CG2 4.16Å; F483-S513 PolarHBondContact O-N 3.02Å; F483-N517 PolarHBondContact O-ND2 3.26Å
484	H	93.9	Very high	90.7	Very high	40 Å²	40	41.4 Å²	41.4	19%	0.185	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	145.6	178	-73.7	-84.1	0	0	0	111.9	V455 I456 E457 N486 F510 D511	V455-H484 PolarHBondContact O-N 3.3Å; I456-H484 WeakPolarHBondContact CA-O 3.29Å; E457-H484 PolarHBondContact N-O 3.46Å; E457-H484 VanDerWaalsContact N-O 3.13Å; H484-N486 VanDerWaalsContact C-N 3.33Å; H484-N486 PolarHBondContact N-ND2 3.19Å; H484-N486 PolarHBondContact O-N 2.93Å; H484-N486 PolarHBondContact O-ND2 3.33Å; H484-F510 PolarHBondContact CE1-O 2.96Å; H484-F510 PolarHBondContact NE2-O 2.92Å; H484-D511 PolarHBondContact CD2-O 2.85Å; H484-D511 PolarHBondContact NE2-O 2.82Å; H484-D511 VanDerWaalsContact NE2-O 3.15Å
485	N	91.1	Very high	90.6	Very high	66 Å²	66	42.9 Å²	42.9	35%	0.353	20%	0.202	S	C	.	.	S	Bend	trans	55.5	44.9	174.7	-59.4	-3.8	0	0	0	112.6	E457 P487 S516	E457-N485 VanDerWaalsContact CA-O 3.24Å; E457-N485 WeakPolarHBondContact CA-O 3.02Å; E457-N485 VanDerWaalsContact CD-ND2 3.34Å; E457-N485 HydrophobicContact CG-CB 4.1Å; E457-N485 PolarHBondContact N-O 2.78Å; E457-N485 PolarHBondContact OE1-ND2 2.91Å; N485-P487 VanDerWaalsContact C-CD 3.45Å; N485-P487 VanDerWaalsContact O-CD 3.23Å; N485-P487 WeakPolarHBondContact O-CD 3.37Å; N485-S516 CarbonylContact C-O 3.55Å; N485-S516 WeakPolarHBondContact CA-O 3.4Å; N485-S516 PolarHBondContact N-O 2.76Å; N485-S516 VanDerWaalsContact N-O 3.14Å; N485-S516 PolarHBondContact N-OG 3.26Å; N485-S516 VanDerWaalsContact N-OG 3.16Å; N485-S516 VanDerWaalsContact OD1-CB 3.31Å; N485-S516 WeakPolarHBondContact OD1-CB 3.33Å
486	N	93.5	Very high	90.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-110.7	76.6	170.3	-52.3	-74	0	0	0	108	V455 N458 H484 H488 L489 S516 N517 G518	V455-N486 PolarHBondContact O-ND2 3.18Å; N458-N486 WeakPolarHBondContact CB-OD1 3.26Å; N458-N486 PolarHBondContact N-OD1 2.82Å; N458-N486 PolarHBondContact ND2-OD1 2.81Å; N458-N486 VanDerWaalsContact ND2-OD1 3.15Å; H484-N486 VanDerWaalsContact C-N 3.33Å; H484-N486 PolarHBondContact N-ND2 3.19Å; H484-N486 PolarHBondContact O-N 2.93Å; H484-N486 PolarHBondContact O-ND2 3.33Å; N486-H488 VanDerWaalsContact C-N 3.26Å; N486-H488 PolarHBondContact O-N 2.89Å; N486-H488 VanDerWaalsContact O-N 3.13Å; N486-L489 HydrophobicContact CB-CB 3.83Å; N486-L489 HydrophobicContact CB-CD2 4.13Å; N486-L489 PolarHBondContact O-N 3.23Å; N486-S516 PolarHBondContact N-O 3.07Å; N486-N517 WeakPolarHBondContact CB-OD1 3.23Å; N486-N517 PolarHBondContact ND2-OD1 3.08Å; N486-N517 WeakPolarHBondContact O-CA 3.41Å; N486-G518 PolarHBondContact O-N 3.12Å
487	P	88.1	Confident	90.2	Very high	18 Å²	18	41.5 Å²	41.5	12%	0.117	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-19.9	-160	24.5	-34.1	0	0	0	114.7	N485 G518 N519 K520 A521	N485-P487 VanDerWaalsContact C-CD 3.45Å; N485-P487 VanDerWaalsContact O-CD 3.23Å; N485-P487 WeakPolarHBondContact O-CD 3.37Å; P487-G518 CarbonylContact O-C 3.58Å; P487-G518 WeakPolarHBondContact O-CA 3.24Å; P487-G518 PolarHBondContact O-N 2.85Å; P487-N519 WeakPolarHBondContact CA-OD1 3.17Å; P487-N519 WeakPolarHBondContact CB-OD1 3Å; P487-N519 PolarHBondContact O-N 2.92Å; P487-K520 HydrophobicContact CB-CB 4.06Å; P487-K520 HydrophobicContact CB-CD 4.03Å; P487-K520 HydrophobicContact CB-CG 3.88Å; P487-K520 HydrophobicContact CG-CD 4.5Å; P487-K520 WeakPolarHBondContact O-CA 3.36Å; P487-K520 PolarHBondContact O-N 2.65Å; P487-A521 PolarHBondContact O-N 3.33Å
488	H	87.2	Confident	90	Very high	74 Å²	74	37.9 Å²	37.9	34%	0.343	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-7.7	174.7	-73.2	-98.1	0	0	0	113.9	Q459 L461 S462 N486 C490 A521	Q459-H488 PolarHBondContact O-CD2 3.1Å; L461-H488 CarbonylContact O-C 3.49Å; S462-H488 WeakPolarHBondContact CA-O 3.44Å; N486-H488 VanDerWaalsContact C-N 3.26Å; N486-H488 PolarHBondContact O-N 2.89Å; N486-H488 VanDerWaalsContact O-N 3.13Å; H488-C490 PolarHBondContact O-N 2.92Å; H488-A521 WeakPolarHBondContact O-CB 3.23Å
489	L	90.8	Very high	89.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.181	C	C	.	.	S	Bend	trans	-88.9	97.5	-177	178.8	65.1	0	0	0	110.8	L461 L464 F483 N486 Y491 Y493 I494 N517 G518	L461-L489 HydrophobicContact CD2-CD2 4.27Å; L461-L489 WeakPolarHBondContact O-CA 3.43Å; L461-L489 WeakPolarHBondContact O-CB 3.47Å; L461-L489 PolarHBondContact O-N 3.38Å; L464-L489 HydrophobicContact CD2-CD1 3.92Å; L464-L489 HydrophobicContact CD2-CD2 3.86Å; L464-L489 HydrophobicContact CG-CD1 4.02Å; F483-L489 HydrophobicContact CD1-CD2 3.84Å; F483-L489 HydrophobicContact CE1-CD2 3.95Å; N486-L489 HydrophobicContact CB-CB 3.83Å; N486-L489 HydrophobicContact CB-CD2 4.13Å; N486-L489 PolarHBondContact O-N 3.23Å; L489-Y491 PolarHBondContact O-N 3.48Å; L489-Y493 HydrophobicContact CD1-CD2 4.15Å; L489-I494 HydrophobicContact CD2-CD1 4.01Å; L489-I494 HydrophobicContact CD2-CG1 3.99Å; L489-I494 HydrophobicContact CG-CD1 4.39Å; L489-I494 HydrophobicContact CG-CG1 4.33Å; L489-N517 CarbonylContact O-C 3.59Å; L489-G518 VanDerWaalsContact O-CA 3.32Å; L489-G518 WeakPolarHBondContact O-CA 3.31Å; L489-G518 PolarHBondContact O-N 3.21Å
490	C	87.6	Confident	89.1	Confident	16 Å²	16	38.9 Å²	38.9	11%	0.108	19%	0.186	C	C	.	.			trans	-52.9	126.6	177.4	-71.9	0	0	0	0	112.6	H488 R492 Y493 C523	H488-C490 PolarHBondContact O-N 2.92Å; C490-R492 PolarHBondContact O-N 3.26Å; C490-Y493 HydrophobicContact CB-CD2 3.86Å; C490-Y493 HydrophobicContact CB-CE2 3.91Å; C490-Y493 WeakPolarHBondContact O-CD2 3.29Å; C490-Y493 PolarHBondContact O-N 3.22Å; C490-C523 WeakPolarHBondContact CA-SG 3.5Å; C490-C523 HydrophobicContact CB-CB 3.9Å; C490-C523 WeakPolarHBondContact CB-SG 3.43Å; C490-C523 VanDerWaalsContact SG-CA 3.5Å; C490-C523 WeakPolarHBondContact SG-CB 3.47Å; C490-C523 CovalentContact SG-SG 2.04Å; C490-C523 PolarHBondContact SG-SG 2.87Å
491	Y	87.6	Confident	88.8	Confident	78 Å²	78	37.2 Å²	37.2	31%	0.306	18%	0.181	S	C	.	.	H	α-helix	trans	-49	-31.2	179.4	-178.5	-98.2	0	0	0	113.7	L489 Y493 I494 V495 V512 P514	L489-Y491 PolarHBondContact O-N 3.48Å; Y491-Y493 VanDerWaalsContact C-N 3.27Å; Y491-Y493 PolarHBondContact O-N 3.06Å; Y491-I494 PolarHBondContact O-N 3.32Å; Y491-V495 HydrophobicContact CD1-CG2 3.73Å; Y491-V495 HydrophobicContact CE1-CG2 3.36Å; Y491-V495 PolarHBondContact O-N 2.99Å; Y491-V495 VanDerWaalsContact O-N 3.09Å; Y491-V512 HydrophobicContact CD2-CG1 4.2Å; Y491-V512 HydrophobicContact CE2-CG1 3.77Å; Y491-P514 HydrophobicContact CD1-CB 4.49Å; Y491-P514 HydrophobicContact CD2-CB 3.79Å; Y491-P514 HydrophobicContact CE1-CB 4.48Å; Y491-P514 HydrophobicContact CE2-CB 3.75Å; Y491-P514 HydrophobicContact CE2-CG 4.44Å; Y491-P514 HydrophobicContact CG-CB 4.17Å
492	R	84.1	Confident	88.2	Confident	88 Å²	88	39.6 Å²	39.6	33%	0.332	21%	0.207	S	C	.	.	H	α-helix	trans	-50.5	-42	174	-161.2	-174.2	71.9	61.6	-4.3	113	C490 I494 V495 E496 F526	C490-R492 PolarHBondContact O-N 3.26Å; R492-I494 VanDerWaalsContact C-N 3.32Å; R492-I494 PolarHBondContact O-N 3.15Å; R492-V495 PolarHBondContact O-N 2.87Å; R492-E496 IonicContact CZ-OE2 2.67Å; R492-E496 IonicContact NH1-OE2 2.68Å; R492-E496 PolarHBondContact NH1-OE2 3.35Å; R492-E496 IonicContact NH2-OE2 2.92Å; R492-E496 WeakPolarHBondContact O-CB 3.48Å; R492-E496 PolarHBondContact O-N 2.81Å; R492-F526 HydrophobicContact CG-CE2 4.32Å
493	Y	87.4	Confident	87.6	Confident	60 Å²	60	39.8 Å²	39.8	24%	0.235	21%	0.209	C	C	.	.	H	α-helix	trans	-68.9	-29.6	-179.8	-61.5	-58.9	0	0	0	112.8	L489 C490 Y491 L497	L489-Y493 HydrophobicContact CD1-CD2 4.15Å; C490-Y493 HydrophobicContact CB-CD2 3.86Å; C490-Y493 HydrophobicContact CB-CE2 3.91Å; C490-Y493 WeakPolarHBondContact O-CD2 3.29Å; C490-Y493 PolarHBondContact O-N 3.22Å; Y491-Y493 VanDerWaalsContact C-N 3.27Å; Y491-Y493 PolarHBondContact O-N 3.06Å; Y493-L497 WeakPolarHBondContact O-CB 3.32Å; Y493-L497 PolarHBondContact O-N 3.26Å
494	I	89.8	Confident	86.4	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-76	-37.2	177.4	-50.2	167.1	0	0	0	110.1	F483 L489 Y491 R492 L497 A498 V512 N517	F483-I494 HydrophobicContact CB-CD1 3.79Å; F483-I494 HydrophobicContact CB-CG2 4.39Å; F483-I494 HydrophobicContact CD1-CD1 3.81Å; F483-I494 HydrophobicContact CD1-CG1 3.94Å; F483-I494 HydrophobicContact CD1-CG2 4.38Å; F483-I494 HydrophobicContact CD2-CG2 3.58Å; F483-I494 HydrophobicContact CE1-CG1 4.25Å; F483-I494 HydrophobicContact CE2-CG2 3.87Å; F483-I494 HydrophobicContact CG-CD1 3.86Å; F483-I494 HydrophobicContact CG-CG1 4.17Å; F483-I494 HydrophobicContact CG-CG2 3.88Å; F483-I494 HydrophobicContact CZ-CG2 4.39Å; L489-I494 HydrophobicContact CD2-CD1 4.01Å; L489-I494 HydrophobicContact CD2-CG1 3.99Å; L489-I494 HydrophobicContact CG-CD1 4.39Å; L489-I494 HydrophobicContact CG-CG1 4.33Å; Y491-I494 PolarHBondContact O-N 3.32Å; R492-I494 VanDerWaalsContact C-N 3.32Å; R492-I494 PolarHBondContact O-N 3.15Å; I494-L497 WeakPolarHBondContact O-CB 3.43Å; I494-L497 PolarHBondContact O-N 2.76Å; I494-A498 PolarHBondContact O-N 2.78Å; I494-V512 HydrophobicContact CB-CG1 4.4Å; I494-V512 HydrophobicContact CD1-CG1 4.24Å; I494-V512 HydrophobicContact CG2-CG1 3.68Å; I494-V512 HydrophobicContact CG2-CG2 4.32Å; I494-N517 HydrophobicContact CD1-CB 3.69Å
495	V	86.7	Confident	85	Confident	33 Å²	33	44.4 Å²	44.4	20%	0.2	26%	0.258	C	S	.	.	H	α-helix	trans	-65.9	-42.7	171.5	178.1	0	0	0	0	111.2	Y491 R492 L497 A498 L499 L507	Y491-V495 HydrophobicContact CD1-CG2 3.73Å; Y491-V495 HydrophobicContact CE1-CG2 3.36Å; Y491-V495 PolarHBondContact O-N 2.99Å; Y491-V495 VanDerWaalsContact O-N 3.09Å; R492-V495 PolarHBondContact O-N 2.87Å; V495-L497 VanDerWaalsContact C-N 3.34Å; V495-L497 PolarHBondContact O-N 3.28Å; V495-A498 PolarHBondContact O-N 3.46Å; V495-L499 HydrophobicContact CG1-CD1 3.99Å; V495-L499 HydrophobicContact CG1-CG 4.43Å; V495-L499 WeakPolarHBondContact O-CG 3.47Å; V495-L499 PolarHBondContact O-N 3.45Å; V495-L507 HydrophobicContact CG2-CD1 4.24Å
496	E	85.2	Confident	83.8	Confident	84 Å²	84	45.1 Å²	45.1	39%	0.393	26%	0.259	S	S	.	.	H	α-helix	trans	-61.4	-40.3	175.7	-171.2	178.2	159.6	0	0	111.9	R492 T500	R492-E496 IonicContact CZ-OE2 2.67Å; R492-E496 IonicContact NH1-OE2 2.68Å; R492-E496 PolarHBondContact NH1-OE2 3.35Å; R492-E496 IonicContact NH2-OE2 2.92Å; R492-E496 WeakPolarHBondContact O-CB 3.48Å; R492-E496 PolarHBondContact O-N 2.81Å; E496-T500 VanDerWaalsContact O-CB 3.31Å; E496-T500 WeakPolarHBondContact O-CB 3.34Å; E496-T500 PolarHBondContact O-N 3.07Å; E496-T500 PolarHBondContact O-OG1 3.02Å
497	L	87.8	Confident	83.2	Confident	11 Å²	11	47.4 Å²	47.4	6%	0.058	27%	0.271	C	S	.	.	H	α-helix	trans	-59.1	-51.4	169.8	171.8	61.7	0	0	0	111.6	L464 W465 L474 L481 F483 Y493 I494 V495 L499 T500 T501	L464-L497 HydrophobicContact CD1-CB 4.14Å; L464-L497 HydrophobicContact CD1-CD2 4.07Å; W465-L497 HydrophobicContact CH2-CD1 4.42Å; W465-L497 HydrophobicContact CH2-CD2 4.13Å; W465-L497 HydrophobicContact CZ3-CD1 3.72Å; W465-L497 HydrophobicContact CZ3-CD2 3.87Å; W465-L497 HydrophobicContact CZ3-CG 4.34Å; L474-L497 HydrophobicContact CD2-CD1 4.14Å; L481-L497 HydrophobicContact CD1-CD2 3.97Å; L481-L497 HydrophobicContact CD1-CG 4.12Å; L481-L497 HydrophobicContact CD2-CD2 4.04Å; F483-L497 HydrophobicContact CE2-CD2 4.05Å; F483-L497 HydrophobicContact CZ-CD2 3.9Å; Y493-L497 WeakPolarHBondContact O-CB 3.32Å; Y493-L497 PolarHBondContact O-N 3.26Å; I494-L497 WeakPolarHBondContact O-CB 3.43Å; I494-L497 PolarHBondContact O-N 2.76Å; V495-L497 VanDerWaalsContact C-N 3.34Å; V495-L497 PolarHBondContact O-N 3.28Å; L497-L499 VanDerWaalsContact C-N 3.32Å; L497-L499 PolarHBondContact O-N 2.9Å; L497-T500 CarbonylContact O-C 3.42Å; L497-T500 WeakPolarHBondContact O-CA 3.1Å; L497-T500 WeakPolarHBondContact O-CB 3.22Å; L497-T500 PolarHBondContact O-N 2.79Å; L497-T501 HydrophobicContact CD1-CG2 3.71Å; L497-T501 HydrophobicContact CG-CG2 4.43Å; L497-T501 PolarHBondContact O-N 3.33Å; L497-T501 PolarHBondContact O-OG1 3.05Å; L497-T501 VanDerWaalsContact O-OG1 3.14Å
498	A	87.9	Confident	83	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-63.6	-35.6	-177.3	0	0	0	0	0	112.9	L481 I494 V495 T500 T501 G502 L503 S504 L507	L481-A498 HydrophobicContact CD1-CB 3.95Å; I494-A498 PolarHBondContact O-N 2.78Å; V495-A498 PolarHBondContact O-N 3.46Å; A498-T500 VanDerWaalsContact C-N 3.35Å; A498-T501 PolarHBondContact O-OG1 3.37Å; A498-G502 CarbonylContact O-C 3.52Å; A498-G502 PolarHBondContact O-N 2.76Å; A498-L503 PolarHBondContact O-N 3.37Å; A498-S504 PolarHBondContact O-N 3.37Å; A498-S504 VanDerWaalsContact O-N 3.17Å; A498-L507 HydrophobicContact CB-CD1 3.76Å; A498-L507 HydrophobicContact CB-CD2 3.98Å; A498-L507 HydrophobicContact CB-CG 4Å
499	L	84.8	Confident	82.8	Confident	113 Å²	113	53.2 Å²	53.2	59%	0.592	30%	0.297	S	S	*	.	H	α-helix	trans	-66.6	-36.4	170.7	-71.5	166.5	0	0	0	111.8	V495 L497	V495-L499 HydrophobicContact CG1-CD1 3.99Å; V495-L499 HydrophobicContact CG1-CG 4.43Å; V495-L499 WeakPolarHBondContact O-CG 3.47Å; V495-L499 PolarHBondContact O-N 3.45Å; L497-L499 VanDerWaalsContact C-N 3.32Å; L497-L499 PolarHBondContact O-N 2.9Å
500	T	81	Confident	82.6	Confident	48 Å²	48	60.8 Å²	60.8	29%	0.294	33%	0.33	S	S	.	.	H	α-helix	trans	-73.1	-35.1	179.7	-61.9	0	0	0	0	112.8	K473 E496 L497 A498	K473-T500 HydrophobicContact CB-CG2 3.95Å; K473-T500 HydrophobicContact CD-CG2 4Å; K473-T500 HydrophobicContact CG-CG2 3.95Å; E496-T500 VanDerWaalsContact O-CB 3.31Å; E496-T500 WeakPolarHBondContact O-CB 3.34Å; E496-T500 PolarHBondContact O-N 3.07Å; E496-T500 PolarHBondContact O-OG1 3.02Å; L497-T500 CarbonylContact O-C 3.42Å; L497-T500 WeakPolarHBondContact O-CA 3.1Å; L497-T500 WeakPolarHBondContact O-CB 3.22Å; L497-T500 PolarHBondContact O-N 2.79Å; A498-T500 VanDerWaalsContact C-N 3.35Å
501	T	85.4	Confident	82.7	Confident	22 Å²	22	60.5 Å²	60.5	14%	0.135	33%	0.327	C	S	.	.	H	α-helix	trans	-87.9	-14.7	178.3	56.7	0	0	0	0	113.9	L474 I476 L497 A498	L474-T501 WeakPolarHBondContact O-CG2 3.39Å; I476-T501 HydrophobicContact CD1-CG2 3.8Å; I476-T501 HydrophobicContact CG1-CG2 4.01Å; L497-T501 HydrophobicContact CD1-CG2 3.71Å; L497-T501 HydrophobicContact CG-CG2 4.43Å; L497-T501 PolarHBondContact O-N 3.33Å; L497-T501 PolarHBondContact O-OG1 3.05Å; L497-T501 VanDerWaalsContact O-OG1 3.14Å; A498-T501 PolarHBondContact O-OG1 3.37Å
502	G	81.7	Confident	82.8	Confident	58 Å²	58	56.9 Å²	56.9	60%	0.598	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.3	5.3	-174.9	0	0	0	0	0	114.9	A498 S504	A498-G502 CarbonylContact O-C 3.52Å; A498-G502 PolarHBondContact O-N 2.76Å; G502-S504 VanDerWaalsContact C-N 3.32Å; G502-S504 PolarHBondContact O-N 2.97Å
503	L	83.6	Confident	83	Confident	26 Å²	26	53.5 Å²	53.5	14%	0.136	30%	0.303	C	S	.	.			trans	-87.5	10.8	-179.2	-59.9	179.2	0	0	0	114	I476 L481 A498 G505 E506	I476-L503 HydrophobicContact CB-CD1 4.28Å; I476-L503 HydrophobicContact CD1-CD1 3.72Å; I476-L503 HydrophobicContact CG2-CD1 4.29Å; L481-L503 HydrophobicContact CD2-CD1 4.16Å; L481-L503 HydrophobicContact CG-CD1 3.94Å; A498-L503 PolarHBondContact O-N 3.37Å; L503-G505 PolarHBondContact O-N 3.25Å; L503-E506 WeakPolarHBondContact O-CB 3.3Å; L503-E506 PolarHBondContact O-N 2.73Å
504	S	68.6	Low	82.9	Confident	61 Å²	61	53.2 Å²	53.2	43%	0.427	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-60.8	-26.6	-175.7	57.4	0	0	0	0	114.4	A498 G502 E506	A498-S504 PolarHBondContact O-N 3.37Å; A498-S504 VanDerWaalsContact O-N 3.17Å; G502-S504 VanDerWaalsContact C-N 3.32Å; G502-S504 PolarHBondContact O-N 2.97Å; S504-E506 PolarHBondContact O-N 2.68Å
505	G	66.2	Low	82.6	Confident	77 Å²	77	60.1 Å²	60.1	79%	0.794	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-75.5	-3.5	173.4	0	0	0	0	0	114.8	L503	L503-G505 PolarHBondContact O-N 3.25Å
506	E	65.7	Low	82.6	Confident	81 Å²	81	59.2 Å²	59.2	38%	0.379	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-113.8	1.3	-171.7	-55.1	-141	110.5	0	0	114.8	K480 L503 S504 H508	K480-E506 HydrophobicContact CD-CB 4.33Å; K480-E506 WeakPolarHBondContact CD-OE2 3.22Å; K480-E506 WeakPolarHBondContact CE-OE1 3.46Å; K480-E506 WeakPolarHBondContact CE-OE2 3.32Å; K480-E506 WeakPolarHBondContact CG-OE2 3.04Å; K480-E506 IonicContact NZ-OE1 2.64Å; K480-E506 PolarHBondContact NZ-OE1 2.66Å; K480-E506 IonicContact NZ-OE2 2.71Å; K480-E506 PolarHBondContact NZ-OE2 2.86Å; L503-E506 WeakPolarHBondContact O-CB 3.3Å; L503-E506 PolarHBondContact O-N 2.73Å; S504-E506 PolarHBondContact O-N 2.68Å; E506-H508 PolarHBondContact O-N 2.94Å
507	L	80.6	Confident	82.8	Confident	47 Å²	47	55.4 Å²	55.4	25%	0.246	32%	0.32	C	S	.	.			trans	-72.5	85.7	-177.2	-67.7	-178.8	0	0	0	112.3	L481 V495 A498 V512	L481-L507 HydrophobicContact CD1-CD2 4.42Å; V495-L507 HydrophobicContact CG2-CD1 4.24Å; A498-L507 HydrophobicContact CB-CD1 3.76Å; A498-L507 HydrophobicContact CB-CD2 3.98Å; A498-L507 HydrophobicContact CB-CG 4Å; L507-V512 HydrophobicContact CD2-CB 4.27Å; L507-V512 HydrophobicContact CD2-CG2 3.87Å
508	H	84.3	Confident	82.7	Confident	102 Å²	102	55.3 Å²	55.3	47%	0.472	32%	0.322	S	S	.	.			trans	-87	143.1	171.6	-162.9	-82.6	0	0	0	111.4	E506 F510 D511 V512	E506-H508 PolarHBondContact O-N 2.94Å; H508-F510 VanDerWaalsContact C-N 3.3Å; H508-F510 AromaticContact CE1-CD2 3.25Å; H508-F510 WeakPolarHBondContact CE1-CD2 3.16Å; H508-F510 AromaticContact CE1-CE2 3.6Å; H508-F510 AromaticContact CE1-CG 3.92Å; H508-F510 AromaticContact ND1-CD2 3.47Å; H508-F510 WeakPolarHBondContact ND1-CD2 3.43Å; H508-F510 AromaticContact ND1-CG 3.79Å; H508-F510 PolarHBondContact ND1-N 3.28Å; H508-F510 PolarHBondContact O-N 2.96Å; H508-D511 WeakPolarHBondContact O-CA 3.36Å; H508-D511 WeakPolarHBondContact O-CB 3.42Å; H508-D511 PolarHBondContact O-N 2.92Å; H508-V512 PolarHBondContact O-N 2.79Å
509	E	82.2	Confident	82.5	Confident	113 Å²	113	59.1 Å²	59.1	53%	0.528	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-35.6	-174.5	-164.5	-173	170.9	0	0	113.9	D511 V512 S513	E509-D511 PolarHBondContact O-N 2.99Å; E509-V512 CarbonylContact O-C 3.44Å; E509-S513 WeakPolarHBondContact O-CA 2.95Å; E509-S513 PolarHBondContact O-N 2.73Å
510	F	85.8	Confident	82.2	Confident	159 Å²	159	60.2 Å²	60.2	70%	0.697	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-20	173.1	-59.2	-40.2	0	0	0	114.1	H484 H508	H484-F510 PolarHBondContact CE1-O 2.96Å; H484-F510 PolarHBondContact NE2-O 2.92Å; H508-F510 VanDerWaalsContact C-N 3.3Å; H508-F510 AromaticContact CE1-CD2 3.25Å; H508-F510 WeakPolarHBondContact CE1-CD2 3.16Å; H508-F510 AromaticContact CE1-CE2 3.6Å; H508-F510 AromaticContact CE1-CG 3.92Å; H508-F510 AromaticContact ND1-CD2 3.47Å; H508-F510 WeakPolarHBondContact ND1-CD2 3.43Å; H508-F510 AromaticContact ND1-CG 3.79Å; H508-F510 PolarHBondContact ND1-N 3.28Å; H508-F510 PolarHBondContact O-N 2.96Å
511	D	89.7	Confident	82	Confident	10 Å²	10	58.6 Å²	58.6	5%	0.053	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-42.9	-179.1	-60.8	-19.3	0	0	0	110.4	K450 Y451 Q482 F483 H484 H508 E509	K450-D511 VanDerWaalsContact CE-OD2 3.3Å; K450-D511 WeakPolarHBondContact CE-OD2 3.5Å; K450-D511 IonicContact NZ-OD1 3.72Å; K450-D511 PolarHBondContact NZ-OD1 2.82Å; K450-D511 IonicContact NZ-OD2 3.61Å; K450-D511 PolarHBondContact NZ-OD2 3.29Å; Y451-D511 HydrophobicContact CE1-CB 4.2Å; Y451-D511 PolarHBondContact OH-OD1 3.16Å; Q482-D511 CarbonylContact C-O 3.49Å; Q482-D511 VanDerWaalsContact CA-O 3.29Å; Q482-D511 WeakPolarHBondContact CA-O 3.3Å; F483-D511 PolarHBondContact N-O 2.91Å; H484-D511 PolarHBondContact CD2-O 2.85Å; H484-D511 PolarHBondContact NE2-O 2.82Å; H484-D511 VanDerWaalsContact NE2-O 3.15Å; H508-D511 WeakPolarHBondContact O-CA 3.36Å; H508-D511 WeakPolarHBondContact O-CB 3.42Å; H508-D511 PolarHBondContact O-N 2.92Å; E509-D511 PolarHBondContact O-N 2.99Å
512	V	91.1	Very high	81.3	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.006	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-132.4	101.5	175.3	179.1	0	0	0	0	108.7	L481 F483 Y491 I494 L507 H508 E509	L481-V512 HydrophobicContact CB-CG2 4.31Å; F483-V512 HydrophobicContact CB-CG1 4.16Å; F483-V512 HydrophobicContact CB-CG2 4.22Å; F483-V512 HydrophobicContact CD2-CG2 4.16Å; Y491-V512 HydrophobicContact CD2-CG1 4.2Å; Y491-V512 HydrophobicContact CE2-CG1 3.77Å; I494-V512 HydrophobicContact CB-CG1 4.4Å; I494-V512 HydrophobicContact CD1-CG1 4.24Å; I494-V512 HydrophobicContact CG2-CG1 3.68Å; I494-V512 HydrophobicContact CG2-CG2 4.32Å; L507-V512 HydrophobicContact CD2-CB 4.27Å; L507-V512 HydrophobicContact CD2-CG2 3.87Å; H508-V512 PolarHBondContact O-N 2.79Å; E509-V512 CarbonylContact O-C 3.44Å
513	S	87.4	Confident	80.7	Confident	17 Å²	17	59.4 Å²	59.4	12%	0.119	33%	0.328	C	S	.	.			trans	-88.1	124.2	-178.2	-177.9	0	0	0	0	112	F483 E509 M515 S516 N517	F483-S513 PolarHBondContact O-N 3.02Å; E509-S513 WeakPolarHBondContact O-CA 2.95Å; E509-S513 PolarHBondContact O-N 2.73Å; S513-M515 PolarHBondContact O-N 3.44Å; S513-M515 PolarHBondContact OG-N 3.29Å; S513-S516 PolarHBondContact O-N 2.74Å; S513-N517 PolarHBondContact O-N 2.87Å; S513-N517 PolarHBondContact O-ND2 3.4Å
514	P	85	Confident	79.8	Confident	55 Å²	55	63.9 Å²	63.9	36%	0.357	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-16.9	173.1	29.6	-33.9	0	0	0	112.7	Y491	Y491-P514 HydrophobicContact CD1-CB 4.49Å; Y491-P514 HydrophobicContact CD2-CB 3.79Å; Y491-P514 HydrophobicContact CE1-CB 4.48Å; Y491-P514 HydrophobicContact CE2-CB 3.75Å; Y491-P514 HydrophobicContact CE2-CG 4.44Å; Y491-P514 HydrophobicContact CG-CB 4.17Å
515	M	83.9	Confident	79	Confident	144 Å²	144	64.1 Å²	64.1	71%	0.709	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-13.2	-178.5	-59.9	-57.8	-63.6	0	0	113.7	S513	S513-M515 PolarHBondContact O-N 3.44Å; S513-M515 PolarHBondContact OG-N 3.29Å
516	S	87.8	Confident	78.2	Confident	14 Å²	14	69.4 Å²	69.4	10%	0.098	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.7	2.9	-178.6	74.8	0	0	0	0	114.9	N485 N486 S513	N485-S516 CarbonylContact C-O 3.55Å; N485-S516 WeakPolarHBondContact CA-O 3.4Å; N485-S516 PolarHBondContact N-O 2.76Å; N485-S516 VanDerWaalsContact N-O 3.14Å; N485-S516 PolarHBondContact N-OG 3.26Å; N485-S516 VanDerWaalsContact N-OG 3.16Å; N485-S516 VanDerWaalsContact OD1-CB 3.31Å; N485-S516 WeakPolarHBondContact OD1-CB 3.33Å; N486-S516 PolarHBondContact N-O 3.07Å; S513-S516 PolarHBondContact O-N 2.74Å
517	N	89.2	Confident	77.1	Confident	4 Å²	4	69.8 Å²	69.8	2%	0.021	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-120	117.3	174	-62	-81.2	0	0	0	109.1	F483 N486 L489 I494 S513 N519	F483-N517 PolarHBondContact O-ND2 3.26Å; N486-N517 WeakPolarHBondContact CB-OD1 3.23Å; N486-N517 PolarHBondContact ND2-OD1 3.08Å; N486-N517 WeakPolarHBondContact O-CA 3.41Å; L489-N517 CarbonylContact O-C 3.59Å; I494-N517 HydrophobicContact CD1-CB 3.69Å; S513-N517 PolarHBondContact O-N 2.87Å; S513-N517 PolarHBondContact O-ND2 3.4Å; N517-N519 VanDerWaalsContact C-N 3.35Å
518	G	84.9	Confident	75.2	Confident	9 Å²	9	74.3 Å²	74.3	9%	0.093	39%	0.386	C	S	.	.	S	Bend	trans	81.5	7.7	-177.9	0	0	0	0	0	114.8	N486 P487 L489 K520 A521	N486-G518 PolarHBondContact O-N 3.12Å; P487-G518 CarbonylContact O-C 3.58Å; P487-G518 WeakPolarHBondContact O-CA 3.24Å; P487-G518 PolarHBondContact O-N 2.85Å; L489-G518 VanDerWaalsContact O-CA 3.32Å; L489-G518 WeakPolarHBondContact O-CA 3.31Å; L489-G518 PolarHBondContact O-N 3.21Å; G518-K520 PolarHBondContact O-N 2.98Å; G518-K520 VanDerWaalsContact O-N 3.13Å; G518-A521 PolarHBondContact O-N 2.98Å
519	N	82.6	Confident	73.3	Confident	80 Å²	80	71.8 Å²	71.8	43%	0.428	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-1.1	-178.4	70.1	-57.1	0	0	0	115	P487 N517 N626	P487-N519 WeakPolarHBondContact CA-OD1 3.17Å; P487-N519 WeakPolarHBondContact CB-OD1 3Å; P487-N519 PolarHBondContact O-N 2.92Å; N517-N519 VanDerWaalsContact C-N 3.35Å; N519-N626 PolarHBondContact O-ND2 3Å
520	K	80.4	Confident	71.6	Confident	136 Å²	136	70 Å²	70	59%	0.591	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.6	4.1	163.9	-66	-171.9	177.7	-173.9	0	113.1	P487 G518	P487-K520 HydrophobicContact CB-CB 4.06Å; P487-K520 HydrophobicContact CB-CD 4.03Å; P487-K520 HydrophobicContact CB-CG 3.88Å; P487-K520 HydrophobicContact CG-CD 4.5Å; P487-K520 WeakPolarHBondContact O-CA 3.36Å; P487-K520 PolarHBondContact O-N 2.65Å; G518-K520 PolarHBondContact O-N 2.98Å; G518-K520 VanDerWaalsContact O-N 3.13Å
521	A	75.4	Confident	69.9	Low	15 Å²	15	72.9 Å²	72.9	12%	0.124	38%	0.379	C	S	.	.	S	Bend	trans	-100	147.1	178.6	0	0	0	0	0	111.9	P487 H488 G518 C523	P487-A521 PolarHBondContact O-N 3.33Å; H488-A521 WeakPolarHBondContact O-CB 3.23Å; G518-A521 PolarHBondContact O-N 2.98Å; A521-C523 PolarHBondContact O-N 3Å
522	V	70.3	Confident	68.1	Low	55 Å²	55	79.5 Å²	79.5	33%	0.333	41%	0.41	S	S	.	.			trans	-87.8	90	172.6	179.6	0	0	0	0	107.1	M624	V522-M624 HydrophobicContact CG1-CB 4.16Å; V522-M624 HydrophobicContact CG1-CG 4.4Å; V522-M624 HydrophobicContact CG2-CB 3.99Å
523	C	71	Confident	66.2	Low	42 Å²	42	83.7 Å²	83.7	28%	0.284	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-90.8	129.1	-173.8	-57	0	0	0	0	111.9	C490 A521 T525	C490-C523 WeakPolarHBondContact CA-SG 3.5Å; C490-C523 HydrophobicContact CB-CB 3.9Å; C490-C523 WeakPolarHBondContact CB-SG 3.43Å; C490-C523 VanDerWaalsContact SG-CA 3.5Å; C490-C523 WeakPolarHBondContact SG-CB 3.47Å; C490-C523 CovalentContact SG-SG 2.04Å; C490-C523 PolarHBondContact SG-SG 2.87Å; A521-C523 PolarHBondContact O-N 3Å; C523-T525 PolarHBondContact O-N 3.34Å
524	E	63	Low	64.9	Low	120 Å²	120	84.9 Å²	84.9	56%	0.561	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-51.2	129.1	170.7	-69.5	157.2	-155.5	0	0	111.2
525	T	52.7	Low	64.1	Low	65 Å²	65	85 Å²	85	40%	0.399	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-83	151	178.1	35.9	0	0	0	0	111.2	C523 V527 R631	C523-T525 PolarHBondContact O-N 3.34Å; T525-V527 PolarHBondContact O-N 3.5Å; T525-R631 PolarHBondContact OG1-NE 3.03Å; T525-R631 PolarHBondContact OG1-NH2 3.5Å
526	F	49.4	Very low	64.1	Low	188 Å²	188	78.6 Å²	78.6	83%	0.825	40%	0.398	S	S	*	.	S	Bend	trans	-66.3	20.2	-171.8	-115	-85.6	0	0	0	116.3	R492	R492-F526 HydrophobicContact CG-CE2 4.32Å
527	V	42.9	Very low	64.1	Low	90 Å²	90	85.1 Å²	85.1	55%	0.545	43%	0.427	S	S	.	.	S	Bend	trans	-96.7	134.3	-177.1	-178.8	0	0	0	0	109.8	T525 L529	T525-V527 PolarHBondContact O-N 3.5Å; V527-L529 VanDerWaalsContact C-N 3.29Å; V527-L529 PolarHBondContact O-N 3.08Å
528	T	41	Very low	64.1	Low	141 Å²	141	86 Å²	86	87%	0.865	43%	0.432	S	S	*	.			trans	-73.8	75.1	178.8	53.2	0	0	0	0	112.1
529	L	43.8	Very low	64.4	Low	50 Å²	50	89.7 Å²	89.7	26%	0.262	45%	0.449	S	S	.	.			trans	-79.2	150.2	153.9	-58.9	-169.8	0	0	0	108.7	V527 E533 M559	V527-L529 VanDerWaalsContact C-N 3.29Å; V527-L529 PolarHBondContact O-N 3.08Å; L529-E533 WeakPolarHBondContact CB-OE2 3.42Å; L529-E533 WeakPolarHBondContact CD1-OE2 3.41Å; L529-E533 WeakPolarHBondContact CD2-OE2 3.49Å; L529-M559 HydrophobicContact CD2-SD 4.26Å
530	T	45.9	Very low	64.7	Low	74 Å²	74	88 Å²	88	45%	0.454	44%	0.443	S	S	.	.			trans	-72.7	155.6	173.8	63.6	0	0	0	0	110.1	E532 E533	T530-E532 WeakPolarHBondContact CB-OE2 3.42Å; T530-E532 PolarHBondContact O-N 3.26Å; T530-E532 VanDerWaalsContact O-N 3.11Å; T530-E532 PolarHBondContact OG1-OE2 2.02Å; T530-E533 PolarHBondContact O-N 3.29Å; T530-E533 VanDerWaalsContact O-N 3.12Å
531	R	50.3	Low	65.2	Low	220 Å²	220	86.3 Å²	86.3	83%	0.83	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-59.9	-23.3	-178.9	-170.4	174.4	179.7	172.7	-0.7	112.7
532	E	51.6	Low	65.9	Low	150 Å²	150	90.9 Å²	90.9	70%	0.701	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-66.3	-31.7	178.2	-60.6	137.4	161.2	0	0	112.5	T530 L534	T530-E532 WeakPolarHBondContact CB-OE2 3.42Å; T530-E532 PolarHBondContact O-N 3.26Å; T530-E532 VanDerWaalsContact O-N 3.11Å; T530-E532 PolarHBondContact OG1-OE2 2.02Å; E532-L534 PolarHBondContact O-N 2.91Å
533	E	51.8	Low	67	Low	89 Å²	89	90.8 Å²	90.8	42%	0.416	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-76	-6.8	-175.2	-64.6	-170.9	164.1	0	0	114.5	L529 T530	L529-E533 WeakPolarHBondContact CB-OE2 3.42Å; L529-E533 WeakPolarHBondContact CD1-OE2 3.41Å; L529-E533 WeakPolarHBondContact CD2-OE2 3.49Å; T530-E533 PolarHBondContact O-N 3.29Å; T530-E533 VanDerWaalsContact O-N 3.12Å
534	L	60.5	Low	67.9	Low	42 Å²	42	89.2 Å²	89.2	22%	0.22	45%	0.445	C	S	.	.	G	3₁₀ helix	trans	-123.2	-0.5	-179.6	-62.1	176.8	0	0	0	113.3	E532 F555 R631 G633 I634	E532-L534 PolarHBondContact O-N 2.91Å; L534-F555 HydrophobicContact CD2-CE2 4.49Å; L534-F555 HydrophobicContact CD2-CZ 4.26Å; L534-R631 HydrophobicContact CD2-CB 4.08Å; L534-G633 CarbonylContact O-C 3.57Å; L534-G633 WeakPolarHBondContact O-CA 3.39Å; L534-I634 PolarHBondContact O-N 3.45Å; L534-I634 VanDerWaalsContact O-N 3.15Å
535	E	68.5	Low	69.1	Low	57 Å²	57	85 Å²	85	27%	0.266	43%	0.429	S	S	.	.	B	Isolated β-bridge	trans	-89.7	136.7	179.4	-171	158.2	-166.4	0	0	110.8	I634 K636	E535-I634 WeakPolarHBondContact CA-O 3.24Å; E535-K636 VanDerWaalsContact OE1-CD 3.28Å; E535-K636 WeakPolarHBondContact OE1-CD 3.43Å; E535-K636 WeakPolarHBondContact OE1-CE 3.42Å; E535-K636 WeakPolarHBondContact OE1-CG 3.36Å; E535-K636 IonicContact OE1-NZ 3.44Å; E535-K636 PolarHBondContact OE1-NZ 2.89Å; E535-K636 IonicContact OE2-NZ 2.73Å; E535-K636 PolarHBondContact OE2-NZ 2.95Å
536	I	83.3	Confident	70.9	Confident	10 Å²	10	85.6 Å²	85.6	5%	0.051	43%	0.429	C	S	.	.			trans	-105.9	127.5	175.1	-57.1	168.7	0	0	0	107.8	W552 F555 Y568 I620 T622 I634 S635	I536-W552 HydrophobicContact CG2-CB 4.01Å; I536-F555 HydrophobicContact CD1-CD2 4.47Å; I536-F555 HydrophobicContact CG1-CD2 4.33Å; I536-Y568 HydrophobicContact CD1-CD1 4.14Å; I536-Y568 HydrophobicContact CD1-CE1 4.2Å; I536-I620 HydrophobicContact CB-CG2 3.89Å; I536-I620 HydrophobicContact CD1-CG2 4.07Å; I536-I620 HydrophobicContact CG2-CG2 3.57Å; I536-T622 HydrophobicContact CD1-CG2 3.98Å; I536-I634 PolarHBondContact N-O 3.38Å; I536-S635 VanDerWaalsContact O-CA 3.27Å; I536-S635 WeakPolarHBondContact O-CA 3.49Å; I536-S635 WeakPolarHBondContact O-CB 3.46Å
537	E	86.8	Confident	72.9	Confident	150 Å²	150	77.7 Å²	77.7	70%	0.701	40%	0.396	S	S	*	.			trans	-90.6	143.3	172.2	-57.3	-155.9	139.2	0	0	110.7	W552	E537-W552 VanDerWaalsContact O-CB 3.27Å; E537-W552 WeakPolarHBondContact O-CB 3.44Å
538	I	89.9	Confident	75.3	Confident	22 Å²	22	73.4 Å²	73.4	11%	0.113	37%	0.371	C	S	.	.			trans	-120.2	117.7	178.7	-54.6	176.3	0	0	0	108.3	L550 R551 I620 V638	I538-L550 HydrophobicContact CG2-CB 3.99Å; I538-L550 HydrophobicContact CG2-CD1 4.17Å; I538-L550 HydrophobicContact CG2-CD2 4.15Å; I538-L550 HydrophobicContact CG2-CG 4.32Å; I538-R551 CarbonylContact C-O 3.49Å; I538-R551 WeakPolarHBondContact CA-O 3.32Å; I538-I620 HydrophobicContact CD1-CB 3.96Å; I538-I620 HydrophobicContact CD1-CG2 3.77Å; I538-I620 HydrophobicContact CG1-CG2 3.9Å; I538-V638 HydrophobicContact CB-CG2 4.19Å
539	D	91	Very high	77.8	Confident	88 Å²	88	68 Å²	68	47%	0.471	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	153.8	170.3	171.2	47.3	0	0	0	110.9	L550 R551	D539-L550 CarbonylContact O-C 3.57Å; D539-L550 VanDerWaalsContact O-CA 3.25Å; D539-L550 WeakPolarHBondContact O-CA 3.34Å; D539-R551 HydrophobicContact CB-CB 4.27Å; D539-R551 PolarHBondContact N-O 3.08Å; D539-R551 PolarHBondContact O-N 2.7Å
540	C	89.4	Confident	80.3	Confident	43 Å²	43	65.6 Å²	65.6	29%	0.291	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	93.6	179.9	-175.7	0	0	0	0	110.8	V549 L550 V640	C540-V549 CarbonylContact C-O 3.6Å; C540-L550 HydrophobicContact CB-CD2 4.01Å; C540-V640 HydrophobicContact CB-CG2 4.42Å
541	H	89.8	Confident	82.5	Confident	102 Å²	102	67.7 Å²	67.7	47%	0.472	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-24.7	-168.2	-175.4	-80.2	0	0	0	114.8	V549 R551	H541-V549 HydrophobicContact CB-CG1 4.4Å; H541-V549 PolarHBondContact N-O 2.67Å; H541-R551 PolarHBondContact CD2-NH1 3.12Å; H541-R551 PolarHBondContact CD2-NH2 3.49Å; H541-R551 VanDerWaalsContact CD2-NH2 3.31Å; H541-R551 PolarHBondContact CE1-NH2 2.94Å; H541-R551 VanDerWaalsContact NE2-CZ 3.32Å; H541-R551 PolarHBondContact NE2-NH1 2.9Å; H541-R551 VanDerWaalsContact NE2-NH1 3.18Å; H541-R551 PolarHBondContact NE2-NH2 3.24Å
542	F	91.7	Very high	84.5	Confident	111 Å²	111	57.7 Å²	57.7	49%	0.487	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	145.7	178.6	178.1	-96	0	0	0	111.8	V548 V549	F542-V548 WeakPolarHBondContact O-CA 3.21Å; F542-V549 HydrophobicContact CB-CB 4.01Å; F542-V549 HydrophobicContact CB-CG2 3.91Å; F542-V549 HydrophobicContact CD1-CG2 4.2Å; F542-V549 PolarHBondContact O-N 3Å
543	V	92.3	Very high	86.3	Confident	53 Å²	53	57.3 Å²	57.3	32%	0.321	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	111.8	178.4	-176.8	0	0	0	0	109.6	V548 V640 R641	V543-V548 HydrophobicContact CG1-CG2 4.3Å; V543-V640 HydrophobicContact CG1-CG1 4.23Å; V543-V640 HydrophobicContact CG2-CG1 3.59Å; V543-R641 WeakPolarHBondContact CG1-O 3.44Å
544	G	90.5	Very high	87.8	Confident	9 Å²	9	56.6 Å²	56.6	9%	0.093	29%	0.294	C	S	.	.			trans	-100.6	-168	172	0	0	0	0	0	112.3	T547 A643	G544-T547 PolarHBondContact N-O 2.63Å; G544-A643 PolarHBondContact O-N 2.81Å
545	S	89	Confident	89	Confident	32 Å²	32	55.5 Å²	55.5	22%	0.224	29%	0.288	C	S	.	.	S	Bend	trans	-74.4	-27.6	177.9	57.7	0	0	0	0	113.4	P612 F644	S545-P612 WeakPolarHBondContact O-CA 3.47Å; S545-P612 WeakPolarHBondContact O-CG 3.4Å; S545-F644 WeakPolarHBondContact CB-O 3.24Å
546	D	89.3	Confident	89.6	Confident	76 Å²	76	56.9 Å²	56.9	41%	0.406	30%	0.297	S	S	.	.	S	Bend	trans	-132.1	4.8	-174.6	56.8	-3.2	0	0	0	112.3	T608 D609 L610	D546-T608 CarbonylContact O-C 3.52Å; D546-T608 VanDerWaalsContact O-C 3.3Å; D546-D609 PolarHBondContact O-N 2.74Å; D546-D609 VanDerWaalsContact O-N 3.1Å; D546-L610 WeakPolarHBondContact CA-O 3.49Å; D546-L610 WeakPolarHBondContact O-CB 3.16Å; D546-L610 PolarHBondContact O-N 3.13Å
547	T	91.5	Very high	89.4	Confident	22 Å²	22	58.1 Å²	58.1	14%	0.135	31%	0.305	C	S	.	.			trans	-139.4	138.9	-161.7	29.8	0	0	0	0	111.5	G544 F606 L607 T608	G544-T547 PolarHBondContact N-O 2.63Å; T547-F606 HydrophobicContact CG2-CZ 4.19Å; T547-L607 WeakPolarHBondContact CA-O 3.09Å; T547-T608 HydrophobicContact CG2-CG2 4.11Å
548	V	93.7	Very high	88.9	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.006	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	137.9	172.5	169.7	0	0	0	0	108.8	F542 V543 L550 L607 L610 V640 T642	F542-V548 WeakPolarHBondContact O-CA 3.21Å; V543-V548 HydrophobicContact CG1-CG2 4.3Å; V548-L550 HydrophobicContact CG1-CD2 3.74Å; V548-L550 HydrophobicContact CG1-CG 4.06Å; V548-L607 HydrophobicContact CB-CD1 4.23Å; V548-L607 HydrophobicContact CG1-CD1 4.29Å; V548-L607 PolarHBondContact N-O 3.32Å; V548-L607 VanDerWaalsContact N-O 3.08Å; V548-L607 WeakPolarHBondContact O-CB 3.49Å; V548-L607 PolarHBondContact O-N 3.46Å; V548-L610 HydrophobicContact CB-CD1 3.79Å; V548-L610 HydrophobicContact CG2-CD1 3.55Å; V548-V640 HydrophobicContact CG1-CG1 4.44Å; V548-V640 HydrophobicContact CG2-CG1 4.13Å; V548-T642 HydrophobicContact CG2-CG2 4.22Å
549	V	94.2	Very high	88	Confident	26 Å²	26	61.5 Å²	61.5	16%	0.158	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	118.3	176.3	-173.2	0	0	0	0	109.7	C540 H541 F542 A605 F606	C540-V549 CarbonylContact C-O 3.6Å; H541-V549 HydrophobicContact CB-CG1 4.4Å; H541-V549 PolarHBondContact N-O 2.67Å; F542-V549 HydrophobicContact CB-CB 4.01Å; F542-V549 HydrophobicContact CB-CG2 3.91Å; F542-V549 HydrophobicContact CD1-CG2 4.2Å; F542-V549 PolarHBondContact O-N 3Å; V549-A605 WeakPolarHBondContact CA-O 3.48Å; V549-F606 HydrophobicContact CG2-CD2 3.7Å; V549-F606 HydrophobicContact CG2-CE2 4.08Å
550	L	94.4	Very high	87.2	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	153.1	177.6	-56.3	178.3	0	0	0	110.7	I538 D539 C540 V548 W552 L570 G604 A605 L607 F618	I538-L550 HydrophobicContact CG2-CB 3.99Å; I538-L550 HydrophobicContact CG2-CD1 4.17Å; I538-L550 HydrophobicContact CG2-CD2 4.15Å; I538-L550 HydrophobicContact CG2-CG 4.32Å; D539-L550 CarbonylContact O-C 3.57Å; D539-L550 VanDerWaalsContact O-CA 3.25Å; D539-L550 WeakPolarHBondContact O-CA 3.34Å; C540-L550 HydrophobicContact CB-CD2 4.01Å; V548-L550 HydrophobicContact CG1-CD2 3.74Å; V548-L550 HydrophobicContact CG1-CG 4.06Å; L550-W552 HydrophobicContact CB-CZ3 4.47Å; L550-L570 HydrophobicContact CD1-CD1 4.07Å; L550-L570 HydrophobicContact CD1-CD2 4.09Å; L550-G604 CarbonylContact O-C 3.59Å; L550-G604 WeakPolarHBondContact O-CA 3.38Å; L550-A605 HydrophobicContact CB-CB 4.41Å; L550-A605 PolarHBondContact N-O 3.45Å; L550-A605 PolarHBondContact O-N 2.89Å; L550-L607 HydrophobicContact CD1-CD1 4.04Å; L550-L607 HydrophobicContact CG-CD1 4.33Å; L550-F618 HydrophobicContact CD1-CB 4.24Å; L550-F618 HydrophobicContact CD1-CD1 3.64Å; L550-F618 HydrophobicContact CD1-CE1 4.18Å; L550-F618 HydrophobicContact CD1-CG 3.91Å
551	R	93.5	Very high	86.7	Confident	117 Å²	117	59.1 Å²	59.1	44%	0.442	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	155.4	173	-70.9	-174.3	179.4	160.9	10	111.6	I538 D539 H541 R603	I538-R551 CarbonylContact C-O 3.49Å; I538-R551 WeakPolarHBondContact CA-O 3.32Å; D539-R551 HydrophobicContact CB-CB 4.27Å; D539-R551 PolarHBondContact N-O 3.08Å; D539-R551 PolarHBondContact O-N 2.7Å; H541-R551 PolarHBondContact CD2-NH1 3.12Å; H541-R551 PolarHBondContact CD2-NH2 3.49Å; H541-R551 VanDerWaalsContact CD2-NH2 3.31Å; H541-R551 PolarHBondContact CE1-NH2 2.94Å; H541-R551 VanDerWaalsContact NE2-CZ 3.32Å; H541-R551 PolarHBondContact NE2-NH1 2.9Å; H541-R551 VanDerWaalsContact NE2-NH1 3.18Å; H541-R551 PolarHBondContact NE2-NH2 3.24Å; R551-R603 VanDerWaalsContact CA-O 3.28Å; R551-R603 WeakPolarHBondContact CA-O 3.33Å
552	W	92.5	Very high	86.3	Confident	10 Å²	10	60.1 Å²	60.1	4%	0.038	32%	0.318	C	S	.	.			trans	-156.4	151.7	175.1	58.2	83	0	0	0	111.5	I536 E537 L550 Y568 Y598 E602 R603 G604 A605 I620	I536-W552 HydrophobicContact CG2-CB 4.01Å; E537-W552 VanDerWaalsContact O-CB 3.27Å; E537-W552 WeakPolarHBondContact O-CB 3.44Å; L550-W552 HydrophobicContact CB-CZ3 4.47Å; W552-Y568 AromaticContact CD1-CE1 3.85Å; W552-Y568 AromaticContact CD1-CE2 3.98Å; W552-Y568 AromaticContact CD1-CZ 3.72Å; W552-Y568 HydrophobicContact CZ2-CD2 4.28Å; W552-Y568 HydrophobicContact CZ2-CG 4.49Å; W552-Y568 AromaticContact NE1-CD1 3.89Å; W552-Y568 AromaticContact NE1-CD2 3.37Å; W552-Y568 AromaticContact NE1-CE1 3.82Å; W552-Y568 AromaticContact NE1-CE2 3.29Å; W552-Y568 VanDerWaalsContact NE1-CE2 3.29Å; W552-Y568 AromaticContact NE1-CG 3.68Å; W552-Y568 AromaticContact NE1-CZ 3.52Å; W552-Y598 HydrophobicContact CH2-CD1 4.41Å; W552-Y598 AromaticContact CH2-CD2 3.75Å; W552-Y598 HydrophobicContact CH2-CD2 3.75Å; W552-Y598 HydrophobicContact CH2-CE2 4.07Å; W552-Y598 AromaticContact CH2-CG 3.95Å; W552-Y598 HydrophobicContact CH2-CG 3.95Å; W552-Y598 HydrophobicContact CZ2-CD2 4.11Å; W552-Y598 AromaticContact CZ2-CG 3.98Å; W552-Y598 HydrophobicContact CZ2-CG 3.98Å; W552-E602 PolarHBondContact NE1-O 3.33Å; W552-R603 PolarHBondContact N-O 3Å; W552-R603 WeakPolarHBondContact O-CD 3.47Å; W552-G604 WeakPolarHBondContact CH2-O 2.93Å; W552-G604 VanDerWaalsContact CZ3-C 3.45Å; W552-A605 HydrophobicContact CH2-CB 3.88Å; W552-A605 HydrophobicContact CZ3-CB 3.77Å; W552-I620 HydrophobicContact CD2-CD1 3.47Å; W552-I620 VanDerWaalsContact CD2-CD1 3.47Å; W552-I620 VanDerWaalsContact CE2-CD1 3.46Å; W552-I620 HydrophobicContact CE3-CD1 3.65Å; W552-I620 HydrophobicContact CG-CD1 4.07Å; W552-I620 HydrophobicContact CH2-CD1 3.84Å; W552-I620 HydrophobicContact CZ2-CD1 3.67Å; W552-I620 HydrophobicContact CZ3-CD1 3.82Å
553	D	87.7	Confident	85.8	Confident	142 Å²	142	63.1 Å²	63.1	76%	0.759	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-75.4	170	-179.6	-88.2	-37.1	0	0	0	114.1	F555 Y568	D553-F555 PolarHBondContact O-N 2.82Å; D553-Y568 PolarHBondContact O-OH 2.93Å
554	S	85	Confident	85.3	Confident	74 Å²	74	62.2 Å²	62.2	52%	0.517	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-70.6	119.5	176.2	57.2	0	0	0	0	112.4	N556	S554-N556 PolarHBondContact O-N 3.05Å
555	F	85.5	Confident	85.1	Confident	20 Å²	20	62.7 Å²	62.7	9%	0.088	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-56.9	131.4	171.8	-175.2	-111.4	0	0	0	111.9	L534 I536 D553 T557 M560 F565 Y568 T622	L534-F555 HydrophobicContact CD2-CE2 4.49Å; L534-F555 HydrophobicContact CD2-CZ 4.26Å; I536-F555 HydrophobicContact CD1-CD2 4.47Å; I536-F555 HydrophobicContact CG1-CD2 4.33Å; D553-F555 PolarHBondContact O-N 2.82Å; F555-T557 HydrophobicContact CD1-CG2 4.16Å; F555-T557 PolarHBondContact O-N 3.2Å; F555-T557 VanDerWaalsContact O-N 3.12Å; F555-M560 HydrophobicContact CE1-CE 3.89Å; F555-M560 HydrophobicContact CE1-SD 4.44Å; F555-M560 HydrophobicContact CZ-CE 4.29Å; F555-F565 HydrophobicContact CB-CE1 4.31Å; F555-F565 HydrophobicContact CB-CE2 4.43Å; F555-F565 HydrophobicContact CB-CZ 4Å; F555-F565 HydrophobicContact CD1-CD2 4.33Å; F555-F565 HydrophobicContact CD1-CE2 4.32Å; F555-Y568 HydrophobicContact CB-CE1 4.01Å; F555-Y568 PolarHBondContact N-OH 3.18Å; F555-T622 HydrophobicContact CB-CG2 4.28Å; F555-T622 HydrophobicContact CD1-CG2 3.7Å; F555-T622 HydrophobicContact CD2-CG2 3.76Å; F555-T622 HydrophobicContact CE1-CG2 3.88Å; F555-T622 HydrophobicContact CE2-CG2 3.96Å; F555-T622 HydrophobicContact CG-CG2 3.63Å; F555-T622 HydrophobicContact CZ-CG2 4.01Å
556	N	80.9	Confident	85	Confident	86 Å²	86	65.1 Å²	65.1	46%	0.46	33%	0.329	S	S	.	.			trans	-79.5	95.1	-171.2	-178.4	5.2	0	0	0	112.5	S554 T558	S554-N556 PolarHBondContact O-N 3.05Å; N556-T558 VanDerWaalsContact C-N 3.33Å; N556-T558 PolarHBondContact O-N 3.38Å; N556-T558 WeakPolarHBondContact OD1-CB 3.42Å; N556-T558 VanDerWaalsContact OD1-CG2 3.29Å; N556-T558 WeakPolarHBondContact OD1-CG2 3.33Å; N556-T558 PolarHBondContact OD1-N 3.22Å; N556-T558 VanDerWaalsContact OD1-N 3.1Å; N556-T558 PolarHBondContact OD1-OG1 2.63Å
557	T	78.6	Confident	85.1	Confident	35 Å²	35	61.5 Å²	61.5	22%	0.215	31%	0.309	C	S	.	.			trans	-85.6	8.2	177.8	65.6	0	0	0	0	114.6	F555 M559 M560 H562 F565	F555-T557 HydrophobicContact CD1-CG2 4.16Å; F555-T557 PolarHBondContact O-N 3.2Å; F555-T557 VanDerWaalsContact O-N 3.12Å; T557-M559 VanDerWaalsContact C-N 3.27Å; T557-M559 PolarHBondContact O-N 2.95Å; T557-M560 WeakPolarHBondContact O-CG 3.44Å; T557-M560 PolarHBondContact O-N 3.47Å; T557-M560 VanDerWaalsContact O-N 3.1Å; T557-H562 WeakPolarHBondContact OG1-CB 3.32Å; T557-F565 HydrophobicContact CG2-CB 3.81Å; T557-F565 HydrophobicContact CG2-CD1 3.78Å; T557-F565 HydrophobicContact CG2-CG 4Å
558	T	77	Confident	85.1	Confident	117 Å²	117	60.5 Å²	60.5	72%	0.718	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-27.3	-171.8	54.7	0	0	0	0	115	N556	N556-T558 VanDerWaalsContact C-N 3.33Å; N556-T558 PolarHBondContact O-N 3.38Å; N556-T558 WeakPolarHBondContact OD1-CB 3.42Å; N556-T558 VanDerWaalsContact OD1-CG2 3.29Å; N556-T558 WeakPolarHBondContact OD1-CG2 3.33Å; N556-T558 PolarHBondContact OD1-N 3.22Å; N556-T558 VanDerWaalsContact OD1-N 3.1Å; N556-T558 PolarHBondContact OD1-OG1 2.63Å
559	M	70.5	Confident	85	Confident	126 Å²	126	62.2 Å²	62.2	62%	0.621	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	11.9	177.4	-73.6	-148	172.9	0	0	114.5	L529 T557	L529-M559 HydrophobicContact CD2-SD 4.26Å; T557-M559 VanDerWaalsContact C-N 3.27Å; T557-M559 PolarHBondContact O-N 2.95Å
560	M	74.5	Confident	84.9	Confident	31 Å²	31	61 Å²	61	15%	0.153	30%	0.304	C	S	.	.	S	Bend	trans	-145.5	171.4	-179.1	67.8	-171	86.5	0	0	112.1	F555 T557 H562 M624 R631	F555-M560 HydrophobicContact CE1-CE 3.89Å; F555-M560 HydrophobicContact CE1-SD 4.44Å; F555-M560 HydrophobicContact CZ-CE 4.29Å; T557-M560 WeakPolarHBondContact O-CG 3.44Å; T557-M560 PolarHBondContact O-N 3.47Å; T557-M560 VanDerWaalsContact O-N 3.1Å; M560-H562 PolarHBondContact O-N 3.21Å; M560-H562 VanDerWaalsContact O-N 3.12Å; M560-M624 HydrophobicContact SD-CE 3.45Å; M560-M624 WeakPolarHBondContact SD-CE 3.32Å; M560-R631 HydrophobicContact CE-CB 3.91Å
561	D	79	Confident	84.7	Confident	51 Å²	51	62.5 Å²	62.5	27%	0.273	31%	0.309	S	S	.	.			trans	-70.5	106.9	168.5	-175.2	-10.1	0	0	0	109.1	R563 M564	D561-R563 PolarHBondContact O-N 2.6Å; D561-R563 VanDerWaalsContact OD1-CB 3.3Å; D561-R563 WeakPolarHBondContact OD1-CB 3.43Å; D561-R563 WeakPolarHBondContact OD1-CG 3.37Å; D561-R563 IonicContact OD1-CZ 3.77Å; D561-R563 PolarHBondContact OD1-N 3.1Å; D561-R563 VanDerWaalsContact OD1-N 3.09Å; D561-R563 IonicContact OD1-NE 2.9Å; D561-R563 PolarHBondContact OD1-NE 3.36Å; D561-R563 IonicContact OD1-NH2 3.78Å; D561-R563 IonicContact OD2-CZ 3.32Å; D561-R563 VanDerWaalsContact OD2-CZ 3.32Å; D561-R563 IonicContact OD2-NE 3.15Å; D561-R563 PolarHBondContact OD2-NE 2.97Å; D561-R563 VanDerWaalsContact OD2-NE 3.15Å; D561-R563 IonicContact OD2-NH2 2.68Å; D561-R563 PolarHBondContact OD2-NH2 3.32Å; D561-M564 HydrophobicContact CB-CE 4.17Å; D561-M564 HydrophobicContact CB-CG 3.93Å; D561-M564 VanDerWaalsContact O-CB 3.3Å; D561-M564 WeakPolarHBondContact O-CB 3.32Å; D561-M564 VanDerWaalsContact O-CG 3.32Å; D561-M564 WeakPolarHBondContact O-CG 3.49Å; D561-M564 PolarHBondContact O-N 3.25Å; D561-M564 VanDerWaalsContact OD2-CE 3.23Å; D561-M564 WeakPolarHBondContact OD2-CE 3.35Å
562	H	80.1	Confident	84.6	Confident	123 Å²	123	58 Å²	58	57%	0.569	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-54	-24.5	-179.3	66.2	-88.1	0	0	0	113.5	T557 M560 M564 F565	T557-H562 WeakPolarHBondContact OG1-CB 3.32Å; M560-H562 PolarHBondContact O-N 3.21Å; M560-H562 VanDerWaalsContact O-N 3.12Å; H562-M564 PolarHBondContact O-N 2.77Å; H562-F565 PolarHBondContact O-N 2.89Å; H562-F565 VanDerWaalsContact O-N 3.1Å
563	R	81.9	Confident	84.4	Confident	173 Å²	173	59.4 Å²	59.4	65%	0.653	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-68	-12.9	176.6	-56.3	174.7	-65.4	175.8	3.8	113	D561	D561-R563 PolarHBondContact O-N 2.6Å; D561-R563 VanDerWaalsContact OD1-CB 3.3Å; D561-R563 WeakPolarHBondContact OD1-CB 3.43Å; D561-R563 WeakPolarHBondContact OD1-CG 3.37Å; D561-R563 IonicContact OD1-CZ 3.77Å; D561-R563 PolarHBondContact OD1-N 3.1Å; D561-R563 VanDerWaalsContact OD1-N 3.09Å; D561-R563 IonicContact OD1-NE 2.9Å; D561-R563 PolarHBondContact OD1-NE 3.36Å; D561-R563 IonicContact OD1-NH2 3.78Å; D561-R563 IonicContact OD2-CZ 3.32Å; D561-R563 VanDerWaalsContact OD2-CZ 3.32Å; D561-R563 IonicContact OD2-NE 3.15Å; D561-R563 PolarHBondContact OD2-NE 2.97Å; D561-R563 VanDerWaalsContact OD2-NE 3.15Å; D561-R563 IonicContact OD2-NH2 2.68Å; D561-R563 PolarHBondContact OD2-NH2 3.32Å
564	M	82.1	Confident	84.5	Confident	35 Å²	35	56.1 Å²	56.1	17%	0.172	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-84.7	-13	174.5	-51.4	-61.1	147.7	0	0	112.4	D561 H562 M624 V625 S627 A630	D561-M564 HydrophobicContact CB-CE 4.17Å; D561-M564 HydrophobicContact CB-CG 3.93Å; D561-M564 VanDerWaalsContact O-CB 3.3Å; D561-M564 WeakPolarHBondContact O-CB 3.32Å; D561-M564 VanDerWaalsContact O-CG 3.32Å; D561-M564 WeakPolarHBondContact O-CG 3.49Å; D561-M564 PolarHBondContact O-N 3.25Å; D561-M564 VanDerWaalsContact OD2-CE 3.23Å; D561-M564 WeakPolarHBondContact OD2-CE 3.35Å; H562-M564 PolarHBondContact O-N 2.77Å; M564-M624 HydrophobicContact CB-CE 4.23Å; M564-M624 CarbonylContact O-C 3.42Å; M564-M624 VanDerWaalsContact O-CA 3.26Å; M564-M624 WeakPolarHBondContact O-CA 3.41Å; M564-V625 HydrophobicContact CB-CB 4.26Å; M564-V625 PolarHBondContact O-N 3.23Å; M564-V625 HydrophobicContact SD-CB 3.96Å; M564-V625 HydrophobicContact SD-CG1 4.06Å; M564-S627 VanDerWaalsContact SD-CB 3.52Å; M564-A630 HydrophobicContact CB-CB 4.42Å
565	F	87	Confident	84.6	Confident	19 Å²	19	53.6 Å²	53.6	8%	0.083	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	112.2	175.4	174.4	-129.6	0	0	0	110.2	F555 T557 H562 G567 Y568 T622 M624	F555-F565 HydrophobicContact CB-CE1 4.31Å; F555-F565 HydrophobicContact CB-CE2 4.43Å; F555-F565 HydrophobicContact CB-CZ 4Å; F555-F565 HydrophobicContact CD1-CD2 4.33Å; F555-F565 HydrophobicContact CD1-CE2 4.32Å; T557-F565 HydrophobicContact CG2-CB 3.81Å; T557-F565 HydrophobicContact CG2-CD1 3.78Å; T557-F565 HydrophobicContact CG2-CG 4Å; H562-F565 PolarHBondContact O-N 2.89Å; H562-F565 VanDerWaalsContact O-N 3.1Å; F565-G567 WeakPolarHBondContact CE2-O 3.5Å; F565-Y568 HydrophobicContact CE2-CE1 4.46Å; F565-Y568 HydrophobicContact CZ-CD1 4.27Å; F565-Y568 HydrophobicContact CZ-CD2 4.31Å; F565-Y568 AromaticContact CZ-CE1 3.84Å; F565-Y568 HydrophobicContact CZ-CE1 3.84Å; F565-Y568 AromaticContact CZ-CE2 3.89Å; F565-Y568 HydrophobicContact CZ-CE2 3.89Å; F565-Y568 HydrophobicContact CZ-CG 4.49Å; F565-Y568 AromaticContact CZ-CZ 3.64Å; F565-T622 HydrophobicContact CD2-CG2 4.41Å; F565-T622 HydrophobicContact CE2-CG2 3.86Å; F565-M624 HydrophobicContact CB-CE 4.03Å; F565-M624 HydrophobicContact CB-SD 3.86Å; F565-M624 HydrophobicContact CD2-SD 3.62Å; F565-M624 HydrophobicContact CG-SD 4.19Å
566	L	86.7	Confident	84.6	Confident	82 Å²	82	61.3 Å²	61.3	43%	0.429	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-34.7	-177	-60.2	-177.4	0	0	0	112.3	S600 L623 V625	L566-S600 PolarHBondContact O-N 3.04Å; L566-L623 HydrophobicContact CB-CB 4.42Å; L566-L623 HydrophobicContact CB-CD2 4.16Å; L566-L623 HydrophobicContact CB-CG 4.22Å; L566-L623 HydrophobicContact CD1-CD2 4.04Å; L566-L623 HydrophobicContact CD1-CG 4.14Å; L566-L623 PolarHBondContact N-O 2.98Å; L566-V625 HydrophobicContact CD1-CG2 3.98Å; L566-V625 HydrophobicContact CD2-CG2 3.78Å; L566-V625 HydrophobicContact CG-CG2 3.89Å
567	G	90.8	Very high	84.7	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	156.4	-161.2	-176.2	0	0	0	0	0	112.5	F565 Y598 L623	F565-G567 WeakPolarHBondContact CE2-O 3.5Å; G567-Y598 CarbonylContact C-O 3.52Å; G567-Y598 VanDerWaalsContact CA-O 3.24Å; G567-Y598 WeakPolarHBondContact CA-O 3.3Å; G567-L623 PolarHBondContact O-N 3.31Å
568	Y	92.3	Very high	85.2	Confident	1 Å²	1	67 Å²	67	0%	0.004	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	155.4	-178.3	-49.9	-90.9	0	0	0	111.8	I536 W552 D553 F555 F565 F597 Y598 E602 R603 I620 T621	I536-Y568 HydrophobicContact CD1-CD1 4.14Å; I536-Y568 HydrophobicContact CD1-CE1 4.2Å; W552-Y568 AromaticContact CD1-CE1 3.85Å; W552-Y568 AromaticContact CD1-CE2 3.98Å; W552-Y568 AromaticContact CD1-CZ 3.72Å; W552-Y568 HydrophobicContact CZ2-CD2 4.28Å; W552-Y568 HydrophobicContact CZ2-CG 4.49Å; W552-Y568 AromaticContact NE1-CD1 3.89Å; W552-Y568 AromaticContact NE1-CD2 3.37Å; W552-Y568 AromaticContact NE1-CE1 3.82Å; W552-Y568 AromaticContact NE1-CE2 3.29Å; W552-Y568 VanDerWaalsContact NE1-CE2 3.29Å; W552-Y568 AromaticContact NE1-CG 3.68Å; W552-Y568 AromaticContact NE1-CZ 3.52Å; D553-Y568 PolarHBondContact O-OH 2.93Å; F555-Y568 HydrophobicContact CB-CE1 4.01Å; F555-Y568 PolarHBondContact N-OH 3.18Å; F565-Y568 HydrophobicContact CE2-CE1 4.46Å; F565-Y568 HydrophobicContact CZ-CD1 4.27Å; F565-Y568 HydrophobicContact CZ-CD2 4.31Å; F565-Y568 AromaticContact CZ-CE1 3.84Å; F565-Y568 HydrophobicContact CZ-CE1 3.84Å; F565-Y568 AromaticContact CZ-CE2 3.89Å; F565-Y568 HydrophobicContact CZ-CE2 3.89Å; F565-Y568 HydrophobicContact CZ-CG 4.49Å; F565-Y568 AromaticContact CZ-CZ 3.64Å; Y568-F597 WeakPolarHBondContact O-CA 3.02Å; Y568-F597 WeakPolarHBondContact O-CD2 3.45Å; Y568-Y598 PolarHBondContact N-O 2.87Å; Y568-Y598 PolarHBondContact O-N 2.73Å; Y568-E602 WeakPolarHBondContact CE2-O 3.25Å; Y568-R603 PolarHBondContact OH-NH1 3.36Å; Y568-I620 HydrophobicContact CD1-CD1 4.1Å; Y568-I620 HydrophobicContact CD1-CG1 4.45Å; Y568-I620 HydrophobicContact CG-CD1 4.03Å; Y568-T621 CarbonylContact C-O 3.5Å; Y568-T621 WeakPolarHBondContact CA-O 3.46Å
569	Q	90.6	Very high	85.3	Confident	38 Å²	38	66.9 Å²	66.9	18%	0.178	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	108.4	169.9	-66.5	176.7	-57.6	0	0	107.9	Y571 M595 L596 F597 I620 T621 L623	Q569-Y571 HydrophobicContact CB-CD2 4.37Å; Q569-Y571 HydrophobicContact CB-CE2 3.67Å; Q569-Y571 WeakPolarHBondContact O-CD2 3.25Å; Q569-M595 HydrophobicContact CB-CG 4.17Å; Q569-M595 HydrophobicContact CB-SD 4.04Å; Q569-M595 HydrophobicContact CG-SD 3.96Å; Q569-L596 CarbonylContact C-O 3.58Å; Q569-L596 WeakPolarHBondContact CA-O 3.07Å; Q569-F597 HydrophobicContact CG-CD2 4.12Å; Q569-I620 WeakPolarHBondContact O-CA 3.49Å; Q569-I620 WeakPolarHBondContact O-CG1 3.44Å; Q569-T621 PolarHBondContact N-O 3.26Å; Q569-T621 PolarHBondContact O-N 3.03Å; Q569-L623 HydrophobicContact CG-CB 4.33Å
570	L	92	Very high	85.5	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	126.4	174.5	176.8	67.6	0	0	0	108.9	L550 M595 L596 Y598 A605 L607 I620	L550-L570 HydrophobicContact CD1-CD1 4.07Å; L550-L570 HydrophobicContact CD1-CD2 4.09Å; L570-M595 CarbonylContact O-C 3.57Å; L570-M595 WeakPolarHBondContact O-CA 3.34Å; L570-L596 PolarHBondContact N-O 3.03Å; L570-L596 PolarHBondContact O-N 3.37Å; L570-Y598 HydrophobicContact CB-CD2 4.17Å; L570-Y598 HydrophobicContact CB-CE2 3.93Å; L570-Y598 HydrophobicContact CD2-CE2 4.04Å; L570-A605 HydrophobicContact CD2-CB 3.46Å; L570-A605 VanDerWaalsContact CD2-CB 3.46Å; L570-L607 HydrophobicContact CD2-CD1 4.49Å; L570-L607 HydrophobicContact CD2-CD2 4.21Å; L570-I620 HydrophobicContact CB-CD1 4.48Å; L570-I620 HydrophobicContact CB-CG1 4.36Å; L570-I620 HydrophobicContact CD1-CB 4.31Å
571	Y	90.6	Very high	85.5	Confident	32 Å²	32	61.9 Å²	61.9	13%	0.125	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	134.9	178.3	-71	-92.7	0	0	0	110.3	Q569 R586 W593 K594 M595 F618 Y619 T621	Q569-Y571 HydrophobicContact CB-CD2 4.37Å; Q569-Y571 HydrophobicContact CB-CE2 3.67Å; Q569-Y571 WeakPolarHBondContact O-CD2 3.25Å; Y571-R586 VanDerWaalsContact CD1-NH2 3.32Å; Y571-W593 HydrophobicContact CD1-CB 3.88Å; Y571-K594 CarbonylContact C-O 3.55Å; Y571-K594 VanDerWaalsContact CA-O 3.23Å; Y571-K594 WeakPolarHBondContact CA-O 3.46Å; Y571-M595 HydrophobicContact CD1-CB 3.84Å; Y571-M595 HydrophobicContact CD1-CG 3.96Å; Y571-M595 HydrophobicContact CD2-CG 4.43Å; Y571-M595 HydrophobicContact CE1-CB 3.64Å; Y571-M595 HydrophobicContact CE1-CG 3.49Å; Y571-M595 VanDerWaalsContact CE1-CG 3.49Å; Y571-M595 HydrophobicContact CE2-CG 4.02Å; Y571-M595 HydrophobicContact CG-CG 4.41Å; Y571-F618 CarbonylContact O-C 3.58Å; Y571-F618 WeakPolarHBondContact O-CA 3.07Å; Y571-Y619 VanDerWaalsContact CB-CZ 3.48Å; Y571-Y619 HydrophobicContact CD1-CE1 4.48Å; Y571-Y619 WeakPolarHBondContact CD1-OH 3.27Å; Y571-Y619 HydrophobicContact CD2-CD2 4.26Å; Y571-Y619 HydrophobicContact CD2-CE1 4.21Å; Y571-Y619 AromaticContact CD2-CE2 3.43Å; Y571-Y619 HydrophobicContact CD2-CE2 3.43Å; Y571-Y619 VanDerWaalsContact CD2-CE2 3.43Å; Y571-Y619 AromaticContact CD2-CZ 3.39Å; Y571-Y619 VanDerWaalsContact CD2-OH 3.26Å; Y571-Y619 WeakPolarHBondContact CD2-OH 3.38Å; Y571-Y619 HydrophobicContact CE2-CE2 4.08Å; Y571-Y619 AromaticContact CG-CE1 3.8Å; Y571-Y619 HydrophobicContact CG-CE1 3.8Å; Y571-Y619 AromaticContact CG-CE2 3.91Å; Y571-Y619 HydrophobicContact CG-CE2 3.91Å; Y571-Y619 AromaticContact CG-CZ 3.38Å; Y571-Y619 PolarHBondContact N-O 3.22Å; Y571-Y619 PolarHBondContact O-N 2.82Å; Y571-T621 WeakPolarHBondContact CE2-OG1 3.17Å
572	Y	91.2	Very high	85.2	Confident	22 Å²	22	61.5 Å²	61.5	9%	0.086	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	149.9	178.6	75.3	-78.3	0	0	0	114.6	K594 L596 L607 L610 Y616 A617 F618	Y572-K594 HydrophobicContact CD1-CB 3.87Å; Y572-K594 HydrophobicContact CE1-CB 3.59Å; Y572-K594 HydrophobicContact CE1-CD 4.05Å; Y572-K594 HydrophobicContact CE2-CB 4.41Å; Y572-K594 HydrophobicContact CE2-CD 3.72Å; Y572-K594 HydrophobicContact CG-CB 4.4Å; Y572-K594 VanDerWaalsContact CZ-CD 3.43Å; Y572-K594 PolarHBondContact N-O 2.88Å; Y572-K594 WeakPolarHBondContact O-CB 3.35Å; Y572-K594 PolarHBondContact O-N 2.96Å; Y572-K594 VanDerWaalsContact OH-CD 3.3Å; Y572-K594 WeakPolarHBondContact OH-CD 3.36Å; Y572-L596 HydrophobicContact CE1-CD1 3.87Å; Y572-L596 HydrophobicContact CE1-CG 4.11Å; Y572-L607 HydrophobicContact CE1-CD2 4.29Å; Y572-L610 HydrophobicContact CD2-CD2 4.42Å; Y572-L610 HydrophobicContact CE2-CD2 3.87Å; Y572-Y616 HydrophobicContact CD2-CD1 4.18Å; Y572-Y616 HydrophobicContact CD2-CE1 4.39Å; Y572-A617 WeakPolarHBondContact CA-O 3.41Å; Y572-F618 HydrophobicContact CD2-CE1 4.09Å; Y572-F618 HydrophobicContact CG-CD1 4.27Å; Y572-F618 AromaticContact CG-CE1 3.89Å; Y572-F618 HydrophobicContact CG-CE1 3.89Å
573	R	88.7	Confident	84.4	Confident	40 Å²	40	57.7 Å²	57.7	15%	0.151	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	152.4	173	73.2	-178	-154.9	-170.4	4.3	112.3	V575 S592 W593 Y616 A617	R573-V575 HydrophobicContact CG-CG1 3.93Å; R573-S592 WeakPolarHBondContact CB-O 3.27Å; R573-S592 WeakPolarHBondContact CD-O 3.21Å; R573-S592 PolarHBondContact NH1-OG 2.93Å; R573-W593 HydrophobicContact CB-CE3 4.31Å; R573-W593 HydrophobicContact CG-CD2 4.14Å; R573-W593 HydrophobicContact CG-CE3 3.89Å; R573-W593 HydrophobicContact CG-CZ3 4.12Å; R573-Y616 CarbonylContact O-C 3.56Å; R573-Y616 WeakPolarHBondContact O-CA 3.48Å; R573-A617 PolarHBondContact N-O 2.89Å; R573-A617 PolarHBondContact O-N 3.08Å
574	P	89.8	Confident	83.3	Confident	74 Å²	74	53.8 Å²	53.8	48%	0.481	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	146.6	168.2	30.3	-34.9	0	0	0	110.5	T614 L615 Y616	P574-T614 HydrophobicContact CB-CG2 4.11Å; P574-L615 CarbonylContact C-O 3.6Å; P574-L615 WeakPolarHBondContact CA-O 3.28Å; P574-Y616 HydrophobicContact CB-CD1 4.22Å; P574-Y616 HydrophobicContact CB-CE1 4.03Å; P574-Y616 HydrophobicContact CG-CE1 4.45Å
575	V	87.7	Confident	82	Confident	20 Å²	20	55 Å²	55	12%	0.121	28%	0.278	C	S	.	.			trans	-142.9	151.3	-178.3	-59.9	0	0	0	0	111.5	R573 V580 L615 A617 Y639	R573-V575 HydrophobicContact CG-CG1 3.93Å; V575-V580 HydrophobicContact CB-CG2 4.35Å; V575-V580 HydrophobicContact CG1-CG2 3.78Å; V575-L615 HydrophobicContact CG2-CD2 3.95Å; V575-L615 HydrophobicContact CG2-CG 3.83Å; V575-L615 PolarHBondContact N-O 3.49Å; V575-L615 WeakPolarHBondContact O-CB 3.45Å; V575-A617 HydrophobicContact CG1-CB 3.65Å; V575-A617 HydrophobicContact CG2-CB 4.14Å; V575-Y639 HydrophobicContact CG2-CD1 4.01Å; V575-Y639 HydrophobicContact CG2-CE1 4.19Å
576	E	85	Confident	80.9	Confident	182 Å²	182	56 Å²	56	85%	0.85	28%	0.282	S	S	*	.	S	Bend	trans	-88.3	-28.4	174.3	-63.3	-179.6	169.3	0	0	112.5
577	M	83.7	Confident	79.6	Confident	113 Å²	113	52.7 Å²	52.7	56%	0.557	27%	0.265	S	S	*	.	S	Bend	trans	-144.4	155.8	-173.7	-68.2	-177.6	-74.8	0	0	111.6	N579	M577-N579 PolarHBondContact O-N 2.93Å; M577-N579 VanDerWaalsContact O-N 3.15Å
578	E	87.5	Confident	77.7	Confident	129 Å²	129	54.5 Å²	54.5	60%	0.603	28%	0.28	S	S	*	.	S	Bend	trans	-87.1	35.6	-174.3	-59.6	-174	172.9	0	0	113.8	L615 Y639	E578-L615 HydrophobicContact CG-CD2 4.32Å; E578-Y639 VanDerWaalsContact C-CZ 3.5Å; E578-Y639 VanDerWaalsContact CA-CZ 3.48Å; E578-Y639 HydrophobicContact CB-CD1 4.34Å; E578-Y639 HydrophobicContact CB-CD2 3.78Å; E578-Y639 HydrophobicContact CB-CE1 4.23Å; E578-Y639 HydrophobicContact CB-CE2 3.66Å; E578-Y639 HydrophobicContact CB-CG 4.12Å; E578-Y639 HydrophobicContact CG-CD1 4.06Å; E578-Y639 HydrophobicContact CG-CD2 3.84Å; E578-Y639 HydrophobicContact CG-CE1 4.42Å; E578-Y639 HydrophobicContact CG-CE2 4.23Å; E578-Y639 HydrophobicContact CG-CG 3.75Å; E578-Y639 PolarHBondContact O-OH 2.67Å; E578-Y639 VanDerWaalsContact O-OH 3.11Å
579	N	80.2	Confident	75.7	Confident	114 Å²	114	57.5 Å²	57.5	61%	0.61	30%	0.3	S	S	*	.			trans	-117.1	25.7	-172.2	64.8	-7.4	0	0	0	113.9	M577	M577-N579 PolarHBondContact O-N 2.93Å; M577-N579 VanDerWaalsContact O-N 3.15Å
580	V	74.5	Confident	73.9	Confident	21 Å²	21	58.5 Å²	58.5	13%	0.127	30%	0.304	C	S	.	.			trans	-83.5	130.3	-166.8	174.8	0	0	0	0	114.2	V575 W593 Y639	V575-V580 HydrophobicContact CB-CG2 4.35Å; V575-V580 HydrophobicContact CG1-CG2 3.78Å; V580-W593 HydrophobicContact CG1-CH2 3.92Å; V580-W593 HydrophobicContact CG1-CZ2 3.45Å; V580-W593 VanDerWaalsContact CG1-CZ2 3.45Å; V580-Y639 PolarHBondContact N-OH 2.64Å; V580-Y639 VanDerWaalsContact N-OH 3.12Å
581	S	73.4	Confident	72.5	Confident	31 Å²	31	61.2 Å²	61.2	22%	0.217	32%	0.319	C	S	.	.			trans	-85.6	138.2	168.5	170.5	0	0	0	0	112.5	V583 E584	S581-V583 PolarHBondContact O-N 3.15Å; S581-V583 PolarHBondContact OG-N 3.39Å; S581-E584 WeakPolarHBondContact CB-OE1 3.25Å; S581-E584 WeakPolarHBondContact CB-OE2 3.5Å; S581-E584 PolarHBondContact OG-N 2.72Å; S581-E584 PolarHBondContact OG-OE1 2.98Å
582	I	74.3	Confident	71.4	Confident	42 Å²	42	61.4 Å²	61.4	22%	0.215	33%	0.325	C	S	.	.	S	Bend	trans	-70.9	-13	177.2	-61	174.9	0	0	0	112	R586 Y619 I634 V637	I582-R586 PolarHBondContact O-NH1 3.4Å; I582-Y619 HydrophobicContact CD1-CD1 4.31Å; I582-Y619 HydrophobicContact CD1-CD2 4.35Å; I582-Y619 HydrophobicContact CD1-CG 4.16Å; I582-Y619 HydrophobicContact CG1-CD1 4.13Å; I582-Y619 HydrophobicContact CG1-CE1 4.29Å; I582-Y619 HydrophobicContact CG1-CG 4.48Å; I582-Y619 HydrophobicContact CG2-CD1 4.45Å; I582-Y619 HydrophobicContact CG2-CE1 3.82Å; I582-Y619 HydrophobicContact CG2-CE2 4.2Å; I582-I634 HydrophobicContact CD1-CD1 4.25Å; I582-V637 HydrophobicContact CD1-CG2 3.95Å; I582-V637 HydrophobicContact CG1-CG2 3.82Å
583	V	62.7	Low	70.8	Confident	44 Å²	44	60.6 Å²	60.6	27%	0.267	32%	0.322	S	S	.	.	S	Bend	trans	-109.6	-20.1	-173.2	-168.2	0	0	0	0	113.2	K463 S581	K463-V583 HydrophobicContact CD-CG1 4.39Å; K463-V583 HydrophobicContact CD-CG2 4.08Å; S581-V583 PolarHBondContact O-N 3.15Å; S581-V583 PolarHBondContact OG-N 3.39Å
584	E	58.2	Low	70.5	Confident	91 Å²	91	64.2 Å²	64.2	43%	0.425	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	144	-177	-81.9	150.4	-133.2	0	0	113.2	S581 R586	S581-E584 WeakPolarHBondContact CB-OE1 3.25Å; S581-E584 WeakPolarHBondContact CB-OE2 3.5Å; S581-E584 PolarHBondContact OG-N 2.72Å; S581-E584 PolarHBondContact OG-OE1 2.98Å; E584-R586 PolarHBondContact O-N 3.02Å
585	N	56.2	Low	70.4	Confident	59 Å²	59	64.8 Å²	64.8	32%	0.316	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	39.7	-179.1	-56.1	-43.6	0	0	0	113.6	N402	N402-N585 VanDerWaalsContact ND2-CG 3.28Å; N402-N585 PolarHBondContact ND2-OD1 2.79Å
586	R	63.1	Low	70.4	Confident	41 Å²	41	66.7 Å²	66.7	16%	0.155	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-111.2	125.3	166.8	-83.2	-176	149.6	151.8	-9.9	110.7	Y571 I582 E584 D591 Y619	Y571-R586 VanDerWaalsContact CD1-NH2 3.32Å; I582-R586 PolarHBondContact O-NH1 3.4Å; E584-R586 PolarHBondContact O-N 3.02Å; R586-D591 WeakPolarHBondContact CG-OD1 3.32Å; R586-D591 IonicContact CZ-OD1 2.65Å; R586-D591 IonicContact CZ-OD2 3.72Å; R586-D591 IonicContact NE-OD1 3.25Å; R586-D591 PolarHBondContact NE-OD1 2.9Å; R586-D591 IonicContact NE-OD2 2.68Å; R586-D591 PolarHBondContact NE-OD2 2.77Å; R586-D591 IonicContact NH2-OD1 2.64Å; R586-D591 IonicContact NH2-OD2 3.83Å; R586-D591 PolarHBondContact NH2-OD2 2.98Å; R586-Y619 PolarHBondContact NH1-OH 3.44Å; R586-Y619 PolarHBondContact NH2-OH 3.11Å
587	D	59.3	Low	70.7	Confident	13 Å²	13	62.6 Å²	62.6	7%	0.07	33%	0.325	C	S	.	.			trans	-116.4	177.8	156.2	67.3	64.4	0	0	0	109.3	F403 S428 C589 H590	F403-D587 HydrophobicContact CD1-CB 4.31Å; S428-D587 WeakPolarHBondContact O-CA 3.28Å; S428-D587 WeakPolarHBondContact O-CB 3.29Å; D587-C589 PolarHBondContact O-N 2.74Å; D587-C589 WeakPolarHBondContact OD1-CA 3.4Å; D587-C589 WeakPolarHBondContact OD1-CB 2.79Å; D587-C589 PolarHBondContact OD1-N 3.32Å; D587-H590 PolarHBondContact N-O 2.7Å; D587-H590 PolarHBondContact OD1-N 2.95Å
588	A	51.6	Low	71.1	Confident	38 Å²	38	58.5 Å²	58.5	31%	0.314	30%	0.303	S	S	.	.	S	Bend	trans	-72.8	-8.6	-175.3	0	0	0	0	0	114.5	P427 S428 V430 H460	P427-A588 WeakPolarHBondContact O-CB 3.38Å; S428-A588 PolarHBondContact O-N 2.82Å; V430-A588 HydrophobicContact CG2-CB 4.4Å; H460-A588 HydrophobicContact CB-CB 3.78Å
589	C	50	Low	71.1	Confident	64 Å²	64	58.1 Å²	58.1	43%	0.432	30%	0.301	S	S	.	.	S	Bend	trans	-121.7	-30.2	-168.2	-58.6	0	0	0	0	112.3	S383 D587	S383-C589 VanDerWaalsContact OG-CB 3.31Å; S383-C589 WeakPolarHBondContact OG-CB 3.31Å; S383-C589 PolarHBondContact OG-SG 2.66Å; S383-C589 VanDerWaalsContact OG-SG 3.42Å; D587-C589 PolarHBondContact O-N 2.74Å; D587-C589 WeakPolarHBondContact OD1-CA 3.4Å; D587-C589 WeakPolarHBondContact OD1-CB 2.79Å; D587-C589 PolarHBondContact OD1-N 3.32Å
590	H	52.3	Low	71.3	Confident	58 Å²	58	54.6 Å²	54.6	27%	0.269	29%	0.286	S	S	.	.			trans	-126.1	111.1	174.4	174.7	-87.9	0	0	0	110.4	V400 D587	V400-H590 HydrophobicContact CG1-CB 4.36Å; V400-H590 VanDerWaalsContact CG1-CD2 3.48Å; V400-H590 WeakPolarHBondContact CG1-CD2 3.44Å; D587-H590 PolarHBondContact N-O 2.7Å; D587-H590 PolarHBondContact OD1-N 2.95Å
591	D	62.5	Low	71.8	Confident	58 Å²	58	61.3 Å²	61.3	31%	0.31	32%	0.316	S	S	.	.	B	Isolated β-bridge	trans	-101	126.8	170	-162.9	-12.6	0	0	0	109.9	R586 W593	R586-D591 WeakPolarHBondContact CG-OD1 3.32Å; R586-D591 IonicContact CZ-OD1 2.65Å; R586-D591 IonicContact CZ-OD2 3.72Å; R586-D591 IonicContact NE-OD1 3.25Å; R586-D591 PolarHBondContact NE-OD1 2.9Å; R586-D591 IonicContact NE-OD2 2.68Å; R586-D591 PolarHBondContact NE-OD2 2.77Å; R586-D591 IonicContact NH2-OD1 2.64Å; R586-D591 IonicContact NH2-OD2 3.83Å; R586-D591 PolarHBondContact NH2-OD2 2.98Å; D591-W593 PolarHBondContact O-N 2.86Å; D591-W593 VanDerWaalsContact OD1-CD1 3.31Å; D591-W593 PolarHBondContact OD1-N 2.83Å
592	S	67	Low	72.4	Confident	36 Å²	36	63.6 Å²	63.6	25%	0.252	32%	0.323	S	S	.	.	S	Bend	trans	-69.2	-10.9	172.9	58.4	0	0	0	0	113.2	R573	R573-S592 WeakPolarHBondContact CB-O 3.27Å; R573-S592 WeakPolarHBondContact CD-O 3.21Å; R573-S592 PolarHBondContact NH1-OG 2.93Å
593	W	78.4	Confident	73	Confident	5 Å²	5	66.3 Å²	66.3	2%	0.019	33%	0.33	C	S	.	.	S	Bend	trans	-99.1	125.1	173.2	-59.6	89	0	0	0	111.4	Y571 R573 V580 D591 A617 Y619 V637	Y571-W593 HydrophobicContact CD1-CB 3.88Å; R573-W593 HydrophobicContact CB-CE3 4.31Å; R573-W593 HydrophobicContact CG-CD2 4.14Å; R573-W593 HydrophobicContact CG-CE3 3.89Å; R573-W593 HydrophobicContact CG-CZ3 4.12Å; V580-W593 HydrophobicContact CG1-CH2 3.92Å; V580-W593 HydrophobicContact CG1-CZ2 3.45Å; V580-W593 VanDerWaalsContact CG1-CZ2 3.45Å; D591-W593 PolarHBondContact O-N 2.86Å; D591-W593 VanDerWaalsContact OD1-CD1 3.31Å; D591-W593 PolarHBondContact OD1-N 2.83Å; W593-A617 HydrophobicContact CH2-CB 3.95Å; W593-A617 HydrophobicContact CZ3-CB 3.91Å; W593-Y619 HydrophobicContact CD2-CD1 4.25Å; W593-Y619 AromaticContact CD2-CE1 3.82Å; W593-Y619 HydrophobicContact CD2-CE1 3.82Å; W593-Y619 AromaticContact CE2-CE1 3.89Å; W593-Y619 AromaticContact CE3-CD1 3.98Å; W593-Y619 HydrophobicContact CE3-CD1 3.98Å; W593-Y619 AromaticContact CE3-CE1 3.97Å; W593-Y619 HydrophobicContact CE3-CE1 3.97Å; W593-Y619 HydrophobicContact CG-CE1 4.29Å; W593-Y619 AromaticContact CH2-CD1 3.79Å; W593-Y619 HydrophobicContact CH2-CD1 3.79Å; W593-Y619 HydrophobicContact CH2-CE1 4.25Å; W593-Y619 HydrophobicContact CZ2-CD1 4.04Å; W593-Y619 HydrophobicContact CZ2-CE1 4.09Å; W593-Y619 AromaticContact CZ3-CD1 3.76Å; W593-Y619 HydrophobicContact CZ3-CD1 3.76Å; W593-Y619 HydrophobicContact CZ3-CE1 4.2Å; W593-V637 HydrophobicContact CH2-CG1 4.16Å; W593-V637 HydrophobicContact CH2-CG2 4.44Å
594	K	83.4	Confident	74.2	Confident	115 Å²	115	65.2 Å²	65.2	50%	0.5	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	140.5	164.2	-67.3	-177.1	172.4	-170.5	0	109.2	Y571 Y572	Y571-K594 CarbonylContact C-O 3.55Å; Y571-K594 VanDerWaalsContact CA-O 3.23Å; Y571-K594 WeakPolarHBondContact CA-O 3.46Å; Y572-K594 HydrophobicContact CD1-CB 3.87Å; Y572-K594 HydrophobicContact CE1-CB 3.59Å; Y572-K594 HydrophobicContact CE1-CD 4.05Å; Y572-K594 HydrophobicContact CE2-CB 4.41Å; Y572-K594 HydrophobicContact CE2-CD 3.72Å; Y572-K594 HydrophobicContact CG-CB 4.4Å; Y572-K594 VanDerWaalsContact CZ-CD 3.43Å; Y572-K594 PolarHBondContact N-O 2.88Å; Y572-K594 WeakPolarHBondContact O-CB 3.35Å; Y572-K594 PolarHBondContact O-N 2.96Å; Y572-K594 VanDerWaalsContact OH-CD 3.3Å; Y572-K594 WeakPolarHBondContact OH-CD 3.36Å
595	M	86.9	Confident	75.7	Confident	86 Å²	86	61 Å²	61	42%	0.424	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	138	180	-171.6	-80.9	-61.5	0	0	111.2	Q569 L570 Y571 F597	Q569-M595 HydrophobicContact CB-CG 4.17Å; Q569-M595 HydrophobicContact CB-SD 4.04Å; Q569-M595 HydrophobicContact CG-SD 3.96Å; L570-M595 CarbonylContact O-C 3.57Å; L570-M595 WeakPolarHBondContact O-CA 3.34Å; Y571-M595 HydrophobicContact CD1-CB 3.84Å; Y571-M595 HydrophobicContact CD1-CG 3.96Å; Y571-M595 HydrophobicContact CD2-CG 4.43Å; Y571-M595 HydrophobicContact CE1-CB 3.64Å; Y571-M595 HydrophobicContact CE1-CG 3.49Å; Y571-M595 VanDerWaalsContact CE1-CG 3.49Å; Y571-M595 HydrophobicContact CE2-CG 4.02Å; Y571-M595 HydrophobicContact CG-CG 4.41Å; M595-F597 HydrophobicContact SD-CB 4.45Å
596	L	88.9	Confident	77.4	Confident	60 Å²	60	64.7 Å²	64.7	31%	0.314	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	133.3	171.6	-65.6	174.1	0	0	0	109.6	Q569 L570 Y572 Y598 L607	Q569-L596 CarbonylContact C-O 3.58Å; Q569-L596 WeakPolarHBondContact CA-O 3.07Å; L570-L596 PolarHBondContact N-O 3.03Å; L570-L596 PolarHBondContact O-N 3.37Å; Y572-L596 HydrophobicContact CE1-CD1 3.87Å; Y572-L596 HydrophobicContact CE1-CG 4.11Å; L596-Y598 HydrophobicContact CB-CE2 3.76Å; L596-L607 HydrophobicContact CD1-CD2 3.5Å; L596-L607 VanDerWaalsContact CD1-CD2 3.5Å
597	F	91	Very high	78.7	Confident	96 Å²	96	62.9 Å²	62.9	42%	0.421	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	136.3	176.1	176.5	-101.7	0	0	0	111	Y568 Q569 M595 Q599 L623	Y568-F597 WeakPolarHBondContact O-CA 3.02Å; Y568-F597 WeakPolarHBondContact O-CD2 3.45Å; Q569-F597 HydrophobicContact CG-CD2 4.12Å; M595-F597 HydrophobicContact SD-CB 4.45Å; F597-Q599 HydrophobicContact CE1-CG 4.32Å; F597-L623 HydrophobicContact CD2-CD2 4.04Å; F597-L623 HydrophobicContact CE2-CB 4.14Å; F597-L623 HydrophobicContact CE2-CD2 3.61Å; F597-L623 HydrophobicContact CZ-CD2 4.4Å
598	Y	90.9	Very high	80.1	Confident	27 Å²	27	65.3 Å²	65.3	11%	0.106	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	140.6	175.7	-68.5	-82.8	0	0	0	109.4	W552 G567 Y568 L570 L596 E602 A605	W552-Y598 HydrophobicContact CH2-CD1 4.41Å; W552-Y598 AromaticContact CH2-CD2 3.75Å; W552-Y598 HydrophobicContact CH2-CD2 3.75Å; W552-Y598 HydrophobicContact CH2-CE2 4.07Å; W552-Y598 AromaticContact CH2-CG 3.95Å; W552-Y598 HydrophobicContact CH2-CG 3.95Å; W552-Y598 HydrophobicContact CZ2-CD2 4.11Å; W552-Y598 AromaticContact CZ2-CG 3.98Å; W552-Y598 HydrophobicContact CZ2-CG 3.98Å; G567-Y598 CarbonylContact C-O 3.52Å; G567-Y598 VanDerWaalsContact CA-O 3.24Å; G567-Y598 WeakPolarHBondContact CA-O 3.3Å; Y568-Y598 PolarHBondContact N-O 2.87Å; Y568-Y598 PolarHBondContact O-N 2.73Å; L570-Y598 HydrophobicContact CB-CD2 4.17Å; L570-Y598 HydrophobicContact CB-CE2 3.93Å; L570-Y598 HydrophobicContact CD2-CE2 4.04Å; L596-Y598 HydrophobicContact CB-CE2 3.76Å; Y598-E602 WeakPolarHBondContact CA-OE2 3.34Å; Y598-E602 HydrophobicContact CD1-CB 4.44Å; Y598-A605 HydrophobicContact CE1-CB 4.22Å; Y598-A605 HydrophobicContact CE2-CB 3.87Å; Y598-A605 VanDerWaalsContact OH-CB 3.26Å; Y598-A605 WeakPolarHBondContact OH-CB 3Å
599	Q	88.8	Confident	81.7	Confident	121 Å²	121	70.1 Å²	70.1	57%	0.565	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.7	159.5	-179.7	-57	-171.3	14.8	0	0	111.8	F597 Q601 E602	F597-Q599 HydrophobicContact CE1-CG 4.32Å; Q599-Q601 PolarHBondContact O-N 2.92Å; Q599-E602 HydrophobicContact CB-CG 4.45Å; Q599-E602 PolarHBondContact N-OE2 2.72Å; Q599-E602 PolarHBondContact O-N 2.83Å
600	S	84.6	Confident	83.6	Confident	41 Å²	41	67.4 Å²	67.4	29%	0.287	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-17.1	-179.7	56.1	0	0	0	0	115.2	L566 R603	L566-S600 PolarHBondContact O-N 3.04Å; S600-R603 PolarHBondContact O-NH1 3.44Å; S600-R603 PolarHBondContact O-NH2 2.75Å; S600-R603 VanDerWaalsContact O-NH2 3.16Å
601	Q	84.2	Confident	85.4	Confident	161 Å²	161	71.4 Å²	71.4	75%	0.752	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-23.1	174.5	-61.4	-173.8	4.5	0	0	113.7	Q599 R603	Q599-Q601 PolarHBondContact O-N 2.92Å; Q601-R603 PolarHBondContact O-NH1 2.74Å
602	E	86.5	Confident	86.7	Confident	80 Å²	80	70 Å²	70	37%	0.374	34%	0.344	S	S	.	.			trans	-78.5	146.3	-173.8	-63.9	179.9	97.7	0	0	112	W552 Y568 Y598 Q599	W552-E602 PolarHBondContact NE1-O 3.33Å; Y568-E602 WeakPolarHBondContact CE2-O 3.25Å; Y598-E602 WeakPolarHBondContact CA-OE2 3.34Å; Y598-E602 HydrophobicContact CD1-CB 4.44Å; Q599-E602 HydrophobicContact CB-CG 4.45Å; Q599-E602 PolarHBondContact N-OE2 2.72Å; Q599-E602 PolarHBondContact O-N 2.83Å
603	R	85.7	Confident	87.9	Confident	98 Å²	98	72.6 Å²	72.6	37%	0.37	35%	0.349	S	S	.	.			trans	-129.1	20.3	-170.5	-62.5	-67.7	171.8	-94	-4	113.2	R551 W552 Y568 S600 Q601	R551-R603 VanDerWaalsContact CA-O 3.28Å; R551-R603 WeakPolarHBondContact CA-O 3.33Å; W552-R603 PolarHBondContact N-O 3Å; W552-R603 WeakPolarHBondContact O-CD 3.47Å; Y568-R603 PolarHBondContact OH-NH1 3.36Å; S600-R603 PolarHBondContact O-NH1 3.44Å; S600-R603 PolarHBondContact O-NH2 2.75Å; S600-R603 VanDerWaalsContact O-NH2 3.16Å; Q601-R603 PolarHBondContact O-NH1 2.74Å
604	G	88.7	Confident	88.5	Confident	22 Å²	22	74 Å²	74	23%	0.227	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.7	167.8	-177.6	0	0	0	0	0	113.3	L550 W552	L550-G604 CarbonylContact O-C 3.59Å; L550-G604 WeakPolarHBondContact O-CA 3.38Å; W552-G604 WeakPolarHBondContact CH2-O 2.93Å; W552-G604 VanDerWaalsContact CZ3-C 3.45Å
605	A	90.3	Very high	89	Confident	2 Å²	2	69.3 Å²	69.3	2%	0.017	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	130.3	179.6	0	0	0	0	0	110.1	V549 L550 W552 L570 Y598 L607	V549-A605 WeakPolarHBondContact CA-O 3.48Å; L550-A605 HydrophobicContact CB-CB 4.41Å; L550-A605 PolarHBondContact N-O 3.45Å; L550-A605 PolarHBondContact O-N 2.89Å; W552-A605 HydrophobicContact CH2-CB 3.88Å; W552-A605 HydrophobicContact CZ3-CB 3.77Å; L570-A605 HydrophobicContact CD2-CB 3.46Å; L570-A605 VanDerWaalsContact CD2-CB 3.46Å; Y598-A605 HydrophobicContact CE1-CB 4.22Å; Y598-A605 HydrophobicContact CE2-CB 3.87Å; Y598-A605 VanDerWaalsContact OH-CB 3.26Å; Y598-A605 WeakPolarHBondContact OH-CB 3Å; A605-L607 HydrophobicContact CB-CG 4.34Å
606	F	91.4	Very high	89.4	Confident	136 Å²	136	65.9 Å²	65.9	60%	0.596	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	109.8	164.5	-174.4	-97.7	0	0	0	108	T547 V549 T608	T547-F606 HydrophobicContact CG2-CZ 4.19Å; V549-F606 HydrophobicContact CG2-CD2 3.7Å; V549-F606 HydrophobicContact CG2-CE2 4.08Å; F606-T608 HydrophobicContact CD1-CG2 3.87Å; F606-T608 HydrophobicContact CE1-CG2 3.37Å; F606-T608 HydrophobicContact CZ-CG2 4.26Å
607	L	90.8	Very high	89.5	Confident	4 Å²	4	63 Å²	63	2%	0.021	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	129.5	-177.6	-60.2	162	0	0	0	109.3	T547 V548 L550 L570 Y572 L596 A605 L610 F618	T547-L607 WeakPolarHBondContact CA-O 3.09Å; V548-L607 HydrophobicContact CB-CD1 4.23Å; V548-L607 HydrophobicContact CG1-CD1 4.29Å; V548-L607 PolarHBondContact N-O 3.32Å; V548-L607 VanDerWaalsContact N-O 3.08Å; V548-L607 WeakPolarHBondContact O-CB 3.49Å; V548-L607 PolarHBondContact O-N 3.46Å; L550-L607 HydrophobicContact CD1-CD1 4.04Å; L550-L607 HydrophobicContact CG-CD1 4.33Å; L570-L607 HydrophobicContact CD2-CD1 4.49Å; L570-L607 HydrophobicContact CD2-CD2 4.21Å; Y572-L607 HydrophobicContact CE1-CD2 4.29Å; L596-L607 HydrophobicContact CD1-CD2 3.5Å; L596-L607 VanDerWaalsContact CD1-CD2 3.5Å; A605-L607 HydrophobicContact CB-CG 4.34Å; L607-L610 HydrophobicContact CB-CD1 4.25Å; L607-F618 HydrophobicContact CD1-CD1 4.17Å; L607-F618 HydrophobicContact CD1-CE1 3.4Å; L607-F618 HydrophobicContact CD1-CZ 4.02Å
608	T	88.6	Confident	89.6	Confident	63 Å²	63	58.5 Å²	58.5	39%	0.387	29%	0.286	S	S	.	.			trans	-115.2	177.8	174.9	58.5	0	0	0	0	111.2	D546 T547 F606 L610	D546-T608 CarbonylContact O-C 3.52Å; D546-T608 VanDerWaalsContact O-C 3.3Å; T547-T608 HydrophobicContact CG2-CG2 4.11Å; F606-T608 HydrophobicContact CD1-CG2 3.87Å; F606-T608 HydrophobicContact CE1-CG2 3.37Å; F606-T608 HydrophobicContact CZ-CG2 4.26Å; T608-L610 PolarHBondContact O-N 3.37Å; T608-L610 VanDerWaalsContact O-N 3.11Å
609	D	85.4	Confident	89.6	Confident	139 Å²	139	57.5 Å²	57.5	74%	0.743	28%	0.282	S	S	*	.	S	Bend	trans	59.1	27.7	170.2	-51.9	-81	0	0	0	113.9	D546	D546-D609 PolarHBondContact O-N 2.74Å; D546-D609 VanDerWaalsContact O-N 3.1Å
610	L	90.3	Very high	89.7	Confident	8 Å²	8	51.8 Å²	51.8	4%	0.042	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-77.9	154.6	170.6	-53.3	178.9	0	0	0	109.9	D546 V548 Y572 L607 T608 Y616 T642	D546-L610 WeakPolarHBondContact CA-O 3.49Å; D546-L610 WeakPolarHBondContact O-CB 3.16Å; D546-L610 PolarHBondContact O-N 3.13Å; V548-L610 HydrophobicContact CB-CD1 3.79Å; V548-L610 HydrophobicContact CG2-CD1 3.55Å; Y572-L610 HydrophobicContact CD2-CD2 4.42Å; Y572-L610 HydrophobicContact CE2-CD2 3.87Å; L607-L610 HydrophobicContact CB-CD1 4.25Å; T608-L610 PolarHBondContact O-N 3.37Å; T608-L610 VanDerWaalsContact O-N 3.11Å; L610-Y616 HydrophobicContact CB-CE2 4.04Å; L610-Y616 HydrophobicContact CD2-CD1 4.48Å; L610-Y616 HydrophobicContact CD2-CE1 3.92Å; L610-Y616 HydrophobicContact CD2-CE2 4.41Å; L610-T642 HydrophobicContact CB-CG2 3.98Å; L610-T642 HydrophobicContact CD1-CG2 4.12Å
611	K	89.7	Confident	89.8	Confident	141 Å²	141	51 Å²	51	61%	0.613	25%	0.248	S	C	*	.	P	Polyproline II helix	trans	-76.4	138.4	174.8	-69.6	-177.9	176.5	-176.6	0	110	T614 Y616 T642	K611-T614 HydrophobicContact CB-CG2 4.27Å; K611-T614 VanDerWaalsContact CB-OG1 3.26Å; K611-T614 WeakPolarHBondContact CB-OG1 3.34Å; K611-T614 WeakPolarHBondContact O-CB 3.4Å; K611-Y616 PolarHBondContact N-OH 2.85Å; K611-T642 PolarHBondContact O-OG1 3.02Å
612	P	89.8	Confident	89.9	Confident	30 Å²	30	44 Å²	44	20%	0.195	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	152.8	168.8	-25.5	34.8	0	0	0	114	S545 T614 N674	S545-P612 WeakPolarHBondContact O-CA 3.47Å; S545-P612 WeakPolarHBondContact O-CG 3.4Å; P612-T614 PolarHBondContact O-N 2.03Å; P612-T614 PolarHBondContact O-OG1 3.03Å; P612-N674 HydrophobicContact CB-CB 3.99Å; P612-N674 HydrophobicContact CG-CB 4.32Å
613	Y	90.7	Very high	89.9	Confident	89 Å²	89	42.8 Å²	42.8	35%	0.349	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	19.8	176.6	-162	-110	0	0	0	115.7	R641 T642 A643 F644	Y613-R641 PolarHBondContact O-NH1 3.49Å; Y613-T642 WeakPolarHBondContact CA-O 3.34Å; Y613-T642 PolarHBondContact N-O 2.65Å; Y613-T642 PolarHBondContact N-OG1 2.69Å; Y613-T642 VanDerWaalsContact N-OG1 3.12Å; Y613-A643 PolarHBondContact N-O 3.43Å; Y613-F644 HydrophobicContact CD2-CD2 4.02Å; Y613-F644 HydrophobicContact CD2-CE1 4.32Å; Y613-F644 AromaticContact CD2-CE2 3.76Å; Y613-F644 HydrophobicContact CD2-CE2 3.76Å; Y613-F644 HydrophobicContact CD2-CG 4.4Å; Y613-F644 AromaticContact CD2-CZ 3.92Å; Y613-F644 HydrophobicContact CD2-CZ 3.92Å; Y613-F644 HydrophobicContact CE2-CD2 4.31Å; Y613-F644 HydrophobicContact CE2-CE1 4.26Å; Y613-F644 AromaticContact CE2-CE2 3.58Å; Y613-F644 HydrophobicContact CE2-CE2 3.58Å; Y613-F644 AromaticContact CE2-CZ 3.54Å; Y613-F644 HydrophobicContact CE2-CZ 3.54Å
614	T	92	Very high	89.7	Confident	35 Å²	35	39 Å²	39	22%	0.215	20%	0.199	C	C	.	.			trans	-107.1	137.2	-168.9	-62.4	0	0	0	0	111.1	P574 K611 P612 Y616 R641 T642	P574-T614 HydrophobicContact CB-CG2 4.11Å; K611-T614 HydrophobicContact CB-CG2 4.27Å; K611-T614 VanDerWaalsContact CB-OG1 3.26Å; K611-T614 WeakPolarHBondContact CB-OG1 3.34Å; K611-T614 WeakPolarHBondContact O-CB 3.4Å; P612-T614 PolarHBondContact O-N 2.03Å; P612-T614 PolarHBondContact O-OG1 3.03Å; T614-Y616 HydrophobicContact CG2-CD2 4.09Å; T614-Y616 HydrophobicContact CG2-CE2 3.61Å; T614-Y616 WeakPolarHBondContact O-CD2 2.94Å; T614-R641 WeakPolarHBondContact O-CA 3.36Å; T614-T642 PolarHBondContact N-OG1 3.22Å; T614-T642 PolarHBondContact O-N 2.69Å; T614-T642 PolarHBondContact O-OG1 3.14Å
615	L	94.3	Very high	89.3	Confident	16 Å²	16	40.7 Å²	40.7	8%	0.084	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	132.8	176	-177.5	68.5	0	0	0	110.4	P574 V575 E578 R641	P574-L615 CarbonylContact C-O 3.6Å; P574-L615 WeakPolarHBondContact CA-O 3.28Å; V575-L615 HydrophobicContact CG2-CD2 3.95Å; V575-L615 HydrophobicContact CG2-CG 3.83Å; V575-L615 PolarHBondContact N-O 3.49Å; V575-L615 WeakPolarHBondContact O-CB 3.45Å; E578-L615 HydrophobicContact CG-CD2 4.32Å; L615-R641 HydrophobicContact CD1-CB 4.18Å
616	Y	93.8	Very high	88.4	Confident	15 Å²	15	45 Å²	45	6%	0.059	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	148.3	179.1	-75.9	-96.1	0	0	0	110.9	Y572 R573 P574 L610 K611 T614 F618 Y639 V640 T642	Y572-Y616 HydrophobicContact CD2-CD1 4.18Å; Y572-Y616 HydrophobicContact CD2-CE1 4.39Å; R573-Y616 CarbonylContact O-C 3.56Å; R573-Y616 WeakPolarHBondContact O-CA 3.48Å; P574-Y616 HydrophobicContact CB-CD1 4.22Å; P574-Y616 HydrophobicContact CB-CE1 4.03Å; P574-Y616 HydrophobicContact CG-CE1 4.45Å; L610-Y616 HydrophobicContact CB-CE2 4.04Å; L610-Y616 HydrophobicContact CD2-CD1 4.48Å; L610-Y616 HydrophobicContact CD2-CE1 3.92Å; L610-Y616 HydrophobicContact CD2-CE2 4.41Å; K611-Y616 PolarHBondContact N-OH 2.85Å; T614-Y616 HydrophobicContact CG2-CD2 4.09Å; T614-Y616 HydrophobicContact CG2-CE2 3.61Å; T614-Y616 WeakPolarHBondContact O-CD2 2.94Å; Y616-F618 VanDerWaalsContact CB-CE2 3.44Å; Y616-F618 HydrophobicContact CG-CZ 4.29Å; Y616-Y639 CarbonylContact O-C 3.6Å; Y616-Y639 VanDerWaalsContact O-CA 3.29Å; Y616-Y639 WeakPolarHBondContact O-CA 3.33Å; Y616-V640 PolarHBondContact N-O 3.3Å; Y616-V640 PolarHBondContact O-N 3.06Å; Y616-T642 HydrophobicContact CD2-CG2 4.47Å; Y616-T642 HydrophobicContact CE2-CG2 4.35Å
617	A	92.5	Very high	87.3	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	143.7	170.2	0	0	0	0	0	110.3	Y572 R573 V575 W593 V637 V638 Y639	Y572-A617 WeakPolarHBondContact CA-O 3.41Å; R573-A617 PolarHBondContact N-O 2.89Å; R573-A617 PolarHBondContact O-N 3.08Å; V575-A617 HydrophobicContact CG1-CB 3.65Å; V575-A617 HydrophobicContact CG2-CB 4.14Å; W593-A617 HydrophobicContact CH2-CB 3.95Å; W593-A617 HydrophobicContact CZ3-CB 3.91Å; A617-V637 HydrophobicContact CB-CG1 3.89Å; A617-V638 CarbonylContact C-O 3.54Å; A617-V638 WeakPolarHBondContact CA-O 3.28Å; A617-Y639 HydrophobicContact CB-CD1 3.65Å; A617-Y639 HydrophobicContact CB-CE1 3.53Å
618	F	92.8	Very high	86.1	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	140.9	-176.6	-62.2	-85.2	0	0	0	111.3	L550 Y571 Y572 L607 Y616 V637 V638 V640	L550-F618 HydrophobicContact CD1-CB 4.24Å; L550-F618 HydrophobicContact CD1-CD1 3.64Å; L550-F618 HydrophobicContact CD1-CE1 4.18Å; L550-F618 HydrophobicContact CD1-CG 3.91Å; Y571-F618 CarbonylContact O-C 3.58Å; Y571-F618 WeakPolarHBondContact O-CA 3.07Å; Y572-F618 HydrophobicContact CD2-CE1 4.09Å; Y572-F618 HydrophobicContact CG-CD1 4.27Å; Y572-F618 AromaticContact CG-CE1 3.89Å; Y572-F618 HydrophobicContact CG-CE1 3.89Å; L607-F618 HydrophobicContact CD1-CD1 4.17Å; L607-F618 HydrophobicContact CD1-CE1 3.4Å; L607-F618 HydrophobicContact CD1-CZ 4.02Å; Y616-F618 VanDerWaalsContact CB-CE2 3.44Å; Y616-F618 HydrophobicContact CG-CZ 4.29Å; F618-V637 CarbonylContact O-C 3.52Å; F618-V637 VanDerWaalsContact O-CA 3.28Å; F618-V637 WeakPolarHBondContact O-CA 3.2Å; F618-V638 PolarHBondContact N-O 3.45Å; F618-V638 PolarHBondContact O-N 3.03Å; F618-V640 HydrophobicContact CD2-CB 4.48Å; F618-V640 HydrophobicContact CD2-CG2 4.07Å; F618-V640 HydrophobicContact CE2-CB 3.98Å; F618-V640 HydrophobicContact CE2-CG2 4Å
619	Y	90.8	Very high	85.1	Confident	7 Å²	7	45.3 Å²	45.3	3%	0.027	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	158	163.5	82.2	-95.6	0	0	0	110.4	Y571 I582 R586 W593 T621 I634 S635	Y571-Y619 VanDerWaalsContact CB-CZ 3.48Å; Y571-Y619 HydrophobicContact CD1-CE1 4.48Å; Y571-Y619 WeakPolarHBondContact CD1-OH 3.27Å; Y571-Y619 HydrophobicContact CD2-CD2 4.26Å; Y571-Y619 HydrophobicContact CD2-CE1 4.21Å; Y571-Y619 AromaticContact CD2-CE2 3.43Å; Y571-Y619 HydrophobicContact CD2-CE2 3.43Å; Y571-Y619 VanDerWaalsContact CD2-CE2 3.43Å; Y571-Y619 AromaticContact CD2-CZ 3.39Å; Y571-Y619 VanDerWaalsContact CD2-OH 3.26Å; Y571-Y619 WeakPolarHBondContact CD2-OH 3.38Å; Y571-Y619 HydrophobicContact CE2-CE2 4.08Å; Y571-Y619 AromaticContact CG-CE1 3.8Å; Y571-Y619 HydrophobicContact CG-CE1 3.8Å; Y571-Y619 AromaticContact CG-CE2 3.91Å; Y571-Y619 HydrophobicContact CG-CE2 3.91Å; Y571-Y619 AromaticContact CG-CZ 3.38Å; Y571-Y619 PolarHBondContact N-O 3.22Å; Y571-Y619 PolarHBondContact O-N 2.82Å; I582-Y619 HydrophobicContact CD1-CD1 4.31Å; I582-Y619 HydrophobicContact CD1-CD2 4.35Å; I582-Y619 HydrophobicContact CD1-CG 4.16Å; I582-Y619 HydrophobicContact CG1-CD1 4.13Å; I582-Y619 HydrophobicContact CG1-CE1 4.29Å; I582-Y619 HydrophobicContact CG1-CG 4.48Å; I582-Y619 HydrophobicContact CG2-CD1 4.45Å; I582-Y619 HydrophobicContact CG2-CE1 3.82Å; I582-Y619 HydrophobicContact CG2-CE2 4.2Å; R586-Y619 PolarHBondContact NH1-OH 3.44Å; R586-Y619 PolarHBondContact NH2-OH 3.11Å; W593-Y619 HydrophobicContact CD2-CD1 4.25Å; W593-Y619 AromaticContact CD2-CE1 3.82Å; W593-Y619 HydrophobicContact CD2-CE1 3.82Å; W593-Y619 AromaticContact CE2-CE1 3.89Å; W593-Y619 AromaticContact CE3-CD1 3.98Å; W593-Y619 HydrophobicContact CE3-CD1 3.98Å; W593-Y619 AromaticContact CE3-CE1 3.97Å; W593-Y619 HydrophobicContact CE3-CE1 3.97Å; W593-Y619 HydrophobicContact CG-CE1 4.29Å; W593-Y619 AromaticContact CH2-CD1 3.79Å; W593-Y619 HydrophobicContact CH2-CD1 3.79Å; W593-Y619 HydrophobicContact CH2-CE1 4.25Å; W593-Y619 HydrophobicContact CZ2-CD1 4.04Å; W593-Y619 HydrophobicContact CZ2-CE1 4.09Å; W593-Y619 AromaticContact CZ3-CD1 3.76Å; W593-Y619 HydrophobicContact CZ3-CD1 3.76Å; W593-Y619 HydrophobicContact CZ3-CE1 4.2Å; Y619-T621 HydrophobicContact CD2-CG2 4.27Å; Y619-T621 HydrophobicContact CE2-CG2 3.83Å; Y619-I634 HydrophobicContact CD2-CD1 4.47Å; Y619-I634 HydrophobicContact CD2-CG1 4.37Å; Y619-I634 HydrophobicContact CE2-CD1 4.44Å; Y619-S635 WeakPolarHBondContact CA-OG 3.48Å
620	I	90.1	Very high	84.3	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	146.9	-178.2	-159.5	170.2	0	0	0	111.8	I536 I538 W552 Y568 Q569 L570 I634 S635	I536-I620 HydrophobicContact CB-CG2 3.89Å; I536-I620 HydrophobicContact CD1-CG2 4.07Å; I536-I620 HydrophobicContact CG2-CG2 3.57Å; I538-I620 HydrophobicContact CD1-CB 3.96Å; I538-I620 HydrophobicContact CD1-CG2 3.77Å; I538-I620 HydrophobicContact CG1-CG2 3.9Å; W552-I620 HydrophobicContact CD2-CD1 3.47Å; W552-I620 VanDerWaalsContact CD2-CD1 3.47Å; W552-I620 VanDerWaalsContact CE2-CD1 3.46Å; W552-I620 HydrophobicContact CE3-CD1 3.65Å; W552-I620 HydrophobicContact CG-CD1 4.07Å; W552-I620 HydrophobicContact CH2-CD1 3.84Å; W552-I620 HydrophobicContact CZ2-CD1 3.67Å; W552-I620 HydrophobicContact CZ3-CD1 3.82Å; Y568-I620 HydrophobicContact CD1-CD1 4.1Å; Y568-I620 HydrophobicContact CD1-CG1 4.45Å; Y568-I620 HydrophobicContact CG-CD1 4.03Å; Q569-I620 WeakPolarHBondContact O-CA 3.49Å; Q569-I620 WeakPolarHBondContact O-CG1 3.44Å; L570-I620 HydrophobicContact CB-CD1 4.48Å; L570-I620 HydrophobicContact CB-CG1 4.36Å; L570-I620 HydrophobicContact CD1-CB 4.31Å; I620-I634 WeakPolarHBondContact O-CA 3.45Å; I620-S635 PolarHBondContact N-OG 2.03Å; I620-S635 PolarHBondContact O-N 2.9Å
621	T	87.1	Confident	83.5	Confident	24 Å²	24	40.3 Å²	40.3	15%	0.147	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	153.2	174.2	48	0	0	0	0	112.1	Y568 Q569 Y571 Y619 G633 I634	Y568-T621 CarbonylContact C-O 3.5Å; Y568-T621 WeakPolarHBondContact CA-O 3.46Å; Q569-T621 PolarHBondContact N-O 3.26Å; Q569-T621 PolarHBondContact O-N 3.03Å; Y571-T621 WeakPolarHBondContact CE2-OG1 3.17Å; Y619-T621 HydrophobicContact CD2-CG2 4.27Å; Y619-T621 HydrophobicContact CE2-CG2 3.83Å; T621-G633 WeakPolarHBondContact CA-O 3.46Å; T621-I634 HydrophobicContact CG2-CB 3.86Å; T621-I634 HydrophobicContact CG2-CD1 3.63Å; T621-I634 HydrophobicContact CG2-CG1 3.53Å
622	T	87.1	Confident	82.8	Confident	15 Å²	15	34.6 Å²	34.6	9%	0.092	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	136.9	169.9	59.8	0	0	0	0	112.2	I536 F555 F565 G632 G633	I536-T622 HydrophobicContact CD1-CG2 3.98Å; F555-T622 HydrophobicContact CB-CG2 4.28Å; F555-T622 HydrophobicContact CD1-CG2 3.7Å; F555-T622 HydrophobicContact CD2-CG2 3.76Å; F555-T622 HydrophobicContact CE1-CG2 3.88Å; F555-T622 HydrophobicContact CE2-CG2 3.96Å; F555-T622 HydrophobicContact CG-CG2 3.63Å; F555-T622 HydrophobicContact CZ-CG2 4.01Å; F565-T622 HydrophobicContact CD2-CG2 4.41Å; F565-T622 HydrophobicContact CE2-CG2 3.86Å; T622-G632 WeakPolarHBondContact OG1-CA 3.08Å; T622-G633 PolarHBondContact N-O 3.05Å; T622-G633 PolarHBondContact OG1-N 3.12Å
623	L	86.7	Confident	82.3	Confident	54 Å²	54	33.4 Å²	33.4	28%	0.283	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	120.9	164.1	-175.6	65	0	0	0	110	L566 G567 Q569 F597	L566-L623 HydrophobicContact CB-CB 4.42Å; L566-L623 HydrophobicContact CB-CD2 4.16Å; L566-L623 HydrophobicContact CB-CG 4.22Å; L566-L623 HydrophobicContact CD1-CD2 4.04Å; L566-L623 HydrophobicContact CD1-CG 4.14Å; L566-L623 PolarHBondContact N-O 2.98Å; G567-L623 PolarHBondContact O-N 3.31Å; Q569-L623 HydrophobicContact CG-CB 4.33Å; F597-L623 HydrophobicContact CD2-CD2 4.04Å; F597-L623 HydrophobicContact CE2-CB 4.14Å; F597-L623 HydrophobicContact CE2-CD2 3.61Å; F597-L623 HydrophobicContact CZ-CD2 4.4Å
624	M	81.7	Confident	82	Confident	18 Å²	18	32.8 Å²	32.8	9%	0.089	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	143.2	-175.5	-57.4	-62.1	-64.1	0	0	111.9	V522 M560 M564 F565 A630	V522-M624 HydrophobicContact CG1-CB 4.16Å; V522-M624 HydrophobicContact CG1-CG 4.4Å; V522-M624 HydrophobicContact CG2-CB 3.99Å; M560-M624 HydrophobicContact SD-CE 3.45Å; M560-M624 WeakPolarHBondContact SD-CE 3.32Å; M564-M624 HydrophobicContact CB-CE 4.23Å; M564-M624 CarbonylContact O-C 3.42Å; M564-M624 VanDerWaalsContact O-CA 3.26Å; M564-M624 WeakPolarHBondContact O-CA 3.41Å; F565-M624 HydrophobicContact CB-CE 4.03Å; F565-M624 HydrophobicContact CB-SD 3.86Å; F565-M624 HydrophobicContact CD2-SD 3.62Å; F565-M624 HydrophobicContact CG-SD 4.19Å; M624-A630 HydrophobicContact CE-CB 4.21Å
625	V	80.4	Confident	81.7	Confident	59 Å²	59	31.6 Å²	31.6	36%	0.358	19%	0.194	S	C	.	.			trans	-71.9	133	165.4	-177.3	0	0	0	0	109	M564 L566 S627	M564-V625 HydrophobicContact CB-CB 4.26Å; M564-V625 PolarHBondContact O-N 3.23Å; M564-V625 HydrophobicContact SD-CB 3.96Å; M564-V625 HydrophobicContact SD-CG1 4.06Å; L566-V625 HydrophobicContact CD1-CG2 3.98Å; L566-V625 HydrophobicContact CD2-CG2 3.78Å; L566-V625 HydrophobicContact CG-CG2 3.89Å; V625-S627 PolarHBondContact O-N 3.06Å; V625-S627 VanDerWaalsContact O-N 3.07Å
626	N	70.1	Confident	81.4	Confident	92 Å²	92	36.7 Å²	36.7	49%	0.492	22%	0.215	S	C	.	.			trans	-66.7	107.8	176.1	-176.8	11.9	0	0	0	110.6	N519	N519-N626 PolarHBondContact O-ND2 3Å
627	S	68.7	Low	81.1	Confident	38 Å²	38	37.5 Å²	37.5	27%	0.266	22%	0.222	S	C	.	.			trans	-151.3	143.6	-177.8	-173.9	0	0	0	0	110.1	M564 V625 G629 A630	M564-S627 VanDerWaalsContact SD-CB 3.52Å; V625-S627 PolarHBondContact O-N 3.06Å; V625-S627 VanDerWaalsContact O-N 3.07Å; S627-G629 PolarHBondContact O-N 3.27Å; S627-G629 VanDerWaalsContact O-N 3.1Å; S627-A630 WeakPolarHBondContact O-CB 3.41Å; S627-A630 PolarHBondContact O-N 3.46Å
628	P	66.6	Low	81	Confident	136 Å²	136	39.4 Å²	39.4	88%	0.883	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	116.8	178.2	-25.6	35.2	0	0	0	112.3
629	G	66.4	Low	81.1	Confident	36 Å²	36	42 Å²	42	37%	0.371	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.7	-5.7	-178.4	0	0	0	0	0	115.4	S627	S627-G629 PolarHBondContact O-N 3.27Å; S627-G629 VanDerWaalsContact O-N 3.1Å
630	A	69.8	Low	81.2	Confident	8 Å²	8	42.5 Å²	42.5	7%	0.066	25%	0.247	C	C	.	.			trans	-62.2	135.6	167.4	0	0	0	0	0	110.3	M564 M624 S627	M564-A630 HydrophobicContact CB-CB 4.42Å; M624-A630 HydrophobicContact CE-CB 4.21Å; S627-A630 WeakPolarHBondContact O-CB 3.41Å; S627-A630 PolarHBondContact O-N 3.46Å
631	R	72.3	Confident	81.4	Confident	33 Å²	33	48.3 Å²	48.3	13%	0.125	27%	0.269	C	S	.	.			trans	-130.5	134	176.4	-64.8	175.3	175.4	138.3	-0.6	108.3	T525 L534 M560	T525-R631 PolarHBondContact OG1-NE 3.03Å; T525-R631 PolarHBondContact OG1-NH2 3.5Å; L534-R631 HydrophobicContact CD2-CB 4.08Å; M560-R631 HydrophobicContact CE-CB 3.91Å
632	G	76.1	Confident	81.7	Confident	22 Å²	22	47.3 Å²	47.3	23%	0.227	26%	0.263	C	S	.	.			trans	-100.4	155.9	175.7	0	0	0	0	0	112.3	T622	T622-G632 WeakPolarHBondContact OG1-CA 3.08Å
633	G	78.9	Confident	81.9	Confident	5 Å²	5	48.6 Å²	48.6	5%	0.052	28%	0.275	C	S	.	.			trans	-114	160.3	173.5	0	0	0	0	0	113.3	L534 T621 T622	L534-G633 CarbonylContact O-C 3.57Å; L534-G633 WeakPolarHBondContact O-CA 3.39Å; T621-G633 WeakPolarHBondContact CA-O 3.46Å; T622-G633 PolarHBondContact N-O 3.05Å; T622-G633 PolarHBondContact OG1-N 3.12Å
634	I	83.6	Confident	82	Confident	76 Å²	76	49 Å²	49	39%	0.39	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-149.5	143.5	-179.8	-174	164.1	0	0	0	110.7	L534 E535 I536 I582 Y619 I620 T621	L534-I634 PolarHBondContact O-N 3.45Å; L534-I634 VanDerWaalsContact O-N 3.15Å; E535-I634 WeakPolarHBondContact CA-O 3.24Å; I536-I634 PolarHBondContact N-O 3.38Å; I582-I634 HydrophobicContact CD1-CD1 4.25Å; Y619-I634 HydrophobicContact CD2-CD1 4.47Å; Y619-I634 HydrophobicContact CD2-CG1 4.37Å; Y619-I634 HydrophobicContact CE2-CD1 4.44Å; I620-I634 WeakPolarHBondContact O-CA 3.45Å; T621-I634 HydrophobicContact CG2-CB 3.86Å; T621-I634 HydrophobicContact CG2-CD1 3.63Å; T621-I634 HydrophobicContact CG2-CG1 3.53Å
635	S	86.6	Confident	82.3	Confident	9 Å²	9	48.4 Å²	48.4	6%	0.063	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-88.7	165.9	175	71.2	0	0	0	0	114.1	I536 Y619 I620	I536-S635 VanDerWaalsContact O-CA 3.27Å; I536-S635 WeakPolarHBondContact O-CA 3.49Å; I536-S635 WeakPolarHBondContact O-CB 3.46Å; Y619-S635 WeakPolarHBondContact CA-OG 3.48Å; I620-S635 PolarHBondContact N-OG 2.03Å; I620-S635 PolarHBondContact O-N 2.9Å
636	K	86.6	Confident	82.7	Confident	123 Å²	123	47.9 Å²	47.9	54%	0.535	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-57.4	164.2	151.1	-78.4	156.3	-166.6	108.2	0	111.2	E535	E535-K636 VanDerWaalsContact OE1-CD 3.28Å; E535-K636 WeakPolarHBondContact OE1-CD 3.43Å; E535-K636 WeakPolarHBondContact OE1-CE 3.42Å; E535-K636 WeakPolarHBondContact OE1-CG 3.36Å; E535-K636 IonicContact OE1-NZ 3.44Å; E535-K636 PolarHBondContact OE1-NZ 2.89Å; E535-K636 IonicContact OE2-NZ 2.73Å; E535-K636 PolarHBondContact OE2-NZ 2.95Å
637	V	87.5	Confident	83.7	Confident	32 Å²	32	43.7 Å²	43.7	19%	0.194	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-82.6	128.6	168	-176.5	0	0	0	0	109	I582 W593 A617 F618 Y639	I582-V637 HydrophobicContact CD1-CG2 3.95Å; I582-V637 HydrophobicContact CG1-CG2 3.82Å; W593-V637 HydrophobicContact CH2-CG1 4.16Å; W593-V637 HydrophobicContact CH2-CG2 4.44Å; A617-V637 HydrophobicContact CB-CG1 3.89Å; F618-V637 CarbonylContact O-C 3.52Å; F618-V637 VanDerWaalsContact O-CA 3.28Å; F618-V637 WeakPolarHBondContact O-CA 3.2Å; V637-Y639 HydrophobicContact CG1-CD1 4.47Å; V637-Y639 HydrophobicContact CG1-CE1 3.85Å; V637-Y639 HydrophobicContact CG1-CE2 4.12Å
638	V	91.6	Very high	84.5	Confident	40 Å²	40	43.2 Å²	43.2	24%	0.242	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	144	175.5	177.3	0	0	0	0	109.3	I538 A617 F618 V640	I538-V638 HydrophobicContact CB-CG2 4.19Å; A617-V638 CarbonylContact C-O 3.54Å; A617-V638 WeakPolarHBondContact CA-O 3.28Å; F618-V638 PolarHBondContact N-O 3.45Å; F618-V638 PolarHBondContact O-N 3.03Å; V638-V640 HydrophobicContact CG1-CG2 4.4Å
639	Y	94.4	Very high	85.4	Confident	56 Å²	56	39 Å²	39	22%	0.22	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	136.6	-178.2	-58.3	-80.8	0	0	0	111.4	V575 E578 V580 Y616 A617 V637	V575-Y639 HydrophobicContact CG2-CD1 4.01Å; V575-Y639 HydrophobicContact CG2-CE1 4.19Å; E578-Y639 VanDerWaalsContact C-CZ 3.5Å; E578-Y639 VanDerWaalsContact CA-CZ 3.48Å; E578-Y639 HydrophobicContact CB-CD1 4.34Å; E578-Y639 HydrophobicContact CB-CD2 3.78Å; E578-Y639 HydrophobicContact CB-CE1 4.23Å; E578-Y639 HydrophobicContact CB-CE2 3.66Å; E578-Y639 HydrophobicContact CB-CG 4.12Å; E578-Y639 HydrophobicContact CG-CD1 4.06Å; E578-Y639 HydrophobicContact CG-CD2 3.84Å; E578-Y639 HydrophobicContact CG-CE1 4.42Å; E578-Y639 HydrophobicContact CG-CE2 4.23Å; E578-Y639 HydrophobicContact CG-CG 3.75Å; E578-Y639 PolarHBondContact O-OH 2.67Å; E578-Y639 VanDerWaalsContact O-OH 3.11Å; V580-Y639 PolarHBondContact N-OH 2.64Å; V580-Y639 VanDerWaalsContact N-OH 3.12Å; Y616-Y639 CarbonylContact O-C 3.6Å; Y616-Y639 VanDerWaalsContact O-CA 3.29Å; Y616-Y639 WeakPolarHBondContact O-CA 3.33Å; A617-Y639 HydrophobicContact CB-CD1 3.65Å; A617-Y639 HydrophobicContact CB-CE1 3.53Å; V637-Y639 HydrophobicContact CG1-CD1 4.47Å; V637-Y639 HydrophobicContact CG1-CE1 3.85Å; V637-Y639 HydrophobicContact CG1-CE2 4.12Å
640	V	93.6	Very high	86.5	Confident	16 Å²	16	37.6 Å²	37.6	10%	0.097	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	136.5	-177.6	-172.1	0	0	0	0	110	C540 V543 V548 Y616 F618 V638	C540-V640 HydrophobicContact CB-CG2 4.42Å; V543-V640 HydrophobicContact CG1-CG1 4.23Å; V543-V640 HydrophobicContact CG2-CG1 3.59Å; V548-V640 HydrophobicContact CG1-CG1 4.44Å; V548-V640 HydrophobicContact CG2-CG1 4.13Å; Y616-V640 PolarHBondContact N-O 3.3Å; Y616-V640 PolarHBondContact O-N 3.06Å; F618-V640 HydrophobicContact CD2-CB 4.48Å; F618-V640 HydrophobicContact CD2-CG2 4.07Å; F618-V640 HydrophobicContact CE2-CB 3.98Å; F618-V640 HydrophobicContact CE2-CG2 4Å; V638-V640 HydrophobicContact CG1-CG2 4.4Å
641	R	93.8	Very high	87.4	Confident	122 Å²	122	38.5 Å²	38.5	46%	0.46	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	126.8	173.1	-178.1	-178.7	-64.9	-89.1	0.9	110.8	V543 Y613 T614 L615	V543-R641 WeakPolarHBondContact CG1-O 3.44Å; Y613-R641 PolarHBondContact O-NH1 3.49Å; T614-R641 WeakPolarHBondContact O-CA 3.36Å; L615-R641 HydrophobicContact CD1-CB 4.18Å
642	T	93.2	Very high	88	Confident	4 Å²	4	37.2 Å²	37.2	3%	0.025	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-67.5	157.7	176.2	50	0	0	0	0	113	V548 L610 K611 Y613 T614 Y616	V548-T642 HydrophobicContact CG2-CG2 4.22Å; L610-T642 HydrophobicContact CB-CG2 3.98Å; L610-T642 HydrophobicContact CD1-CG2 4.12Å; K611-T642 PolarHBondContact O-OG1 3.02Å; Y613-T642 WeakPolarHBondContact CA-O 3.34Å; Y613-T642 PolarHBondContact N-O 2.65Å; Y613-T642 PolarHBondContact N-OG1 2.69Å; Y613-T642 VanDerWaalsContact N-OG1 3.12Å; T614-T642 PolarHBondContact N-OG1 3.22Å; T614-T642 PolarHBondContact O-N 2.69Å; T614-T642 PolarHBondContact O-OG1 3.14Å; Y616-T642 HydrophobicContact CD2-CG2 4.47Å; Y616-T642 HydrophobicContact CE2-CG2 4.35Å
643	A	91.2	Very high	88.5	Confident	41 Å²	41	41.3 Å²	41.3	34%	0.339	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-72.3	171	-179.7	0	0	0	0	0	113.4	G544 Y613	G544-A643 PolarHBondContact O-N 2.81Å; Y613-A643 PolarHBondContact N-O 3.43Å
644	F	89.7	Confident	88.9	Confident	64 Å²	64	44 Å²	44	28%	0.281	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-62.2	145.4	173	-74.3	-109.4	0	0	0	111.1	S545 Y613 G675 I881 N884	S545-F644 WeakPolarHBondContact CB-O 3.24Å; Y613-F644 HydrophobicContact CD2-CD2 4.02Å; Y613-F644 HydrophobicContact CD2-CE1 4.32Å; Y613-F644 AromaticContact CD2-CE2 3.76Å; Y613-F644 HydrophobicContact CD2-CE2 3.76Å; Y613-F644 HydrophobicContact CD2-CG 4.4Å; Y613-F644 AromaticContact CD2-CZ 3.92Å; Y613-F644 HydrophobicContact CD2-CZ 3.92Å; Y613-F644 HydrophobicContact CE2-CD2 4.31Å; Y613-F644 HydrophobicContact CE2-CE1 4.26Å; Y613-F644 AromaticContact CE2-CE2 3.58Å; Y613-F644 HydrophobicContact CE2-CE2 3.58Å; Y613-F644 AromaticContact CE2-CZ 3.54Å; Y613-F644 HydrophobicContact CE2-CZ 3.54Å; F644-G675 VanDerWaalsContact CD1-CA 3.45Å; F644-I881 HydrophobicContact CB-CD1 4.46Å; F644-I881 HydrophobicContact CB-CG2 4.41Å; F644-I881 HydrophobicContact CD1-CD1 3.58Å; F644-I881 HydrophobicContact CE1-CD1 3.95Å; F644-I881 HydrophobicContact CG-CD1 4.05Å; F644-N884 PolarHBondContact O-ND2 2.77Å
645	G	88	Confident	89.2	Confident	4 Å²	4	41.3 Å²	41.3	4%	0.041	21%	0.207	C	C	.	.			trans	-127.5	169.7	174.4	0	0	0	0	0	112.1	N674 Q877	G645-N674 PolarHBondContact N-O 2.82Å; G645-N674 WeakPolarHBondContact O-CB 3.41Å; G645-Q877 PolarHBondContact O-NE2 3.43Å
646	H	88.1	Confident	89.3	Confident	48 Å²	48	44.3 Å²	44.3	22%	0.222	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-61	137.4	178.7	-73.4	69.8	0	0	0	111.7	N674 E883 N884 C886 K888	H646-N674 WeakPolarHBondContact O-CB 3.36Å; H646-N674 PolarHBondContact O-ND2 2.81Å; H646-E883 PolarHBondContact CE1-O 3.21Å; H646-E883 PolarHBondContact NE2-O 3.25Å; H646-N884 PolarHBondContact CE1-OD1 2.79Å; H646-N884 PolarHBondContact ND1-OD1 2.9Å; H646-C886 PolarHBondContact CD2-O 2.9Å; H646-K888 HydrophobicContact CB-CG 4.04Å; H646-K888 VanDerWaalsContact CD2-CE 3.49Å; H646-K888 WeakPolarHBondContact CD2-CE 3.48Å; H646-K888 WeakPolarHBondContact CD2-CG 3.28Å; H646-K888 WeakPolarHBondContact CE1-CE 3.37Å; H646-K888 VanDerWaalsContact ND1-CE 3.27Å; H646-K888 WeakPolarHBondContact ND1-CE 3.4Å; H646-K888 WeakPolarHBondContact NE2-CE 3.29Å
647	P	90.4	Very high	89.3	Confident	5 Å²	5	38.9 Å²	38.9	3%	0.032	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-59.4	152.3	169.8	-22.3	32.1	0	0	0	113.2	P670 Q877 S887	P647-P670 HydrophobicContact CB-CB 4.42Å; P647-P670 HydrophobicContact CB-CG 4.25Å; P647-Q877 HydrophobicContact CG-CG 3.62Å; P647-S887 VanDerWaalsContact O-CA 3.28Å; P647-S887 WeakPolarHBondContact O-CA 3.41Å; P647-S887 WeakPolarHBondContact O-CB 3.47Å
648	S	85.4	Confident	89.2	Confident	27 Å²	27	41.7 Å²	41.7	19%	0.189	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-68	162.5	161.2	75.1	0	0	0	0	111.1	P670 V671 L672	S648-P670 WeakPolarHBondContact O-CB 3.49Å; S648-P670 WeakPolarHBondContact O-CG 3.39Å; S648-P670 WeakPolarHBondContact OG-CA 3.44Å; S648-P670 WeakPolarHBondContact OG-CB 3.5Å; S648-V671 PolarHBondContact OG-N 3.49Å; S648-L672 PolarHBondContact N-O 2.89Å; S648-L672 PolarHBondContact OG-N 2.86Å
649	P	86.6	Confident	89.2	Confident	47 Å²	47	41.5 Å²	41.5	31%	0.305	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-59	163.3	165.8	-22	34.8	0	0	0	112.2	R889 V891	P649-R889 HydrophobicContact CG-CB 4.09Å; P649-V891 HydrophobicContact CB-CG2 3.74Å
650	V	90.1	Very high	88.9	Confident	8 Å²	8	40.2 Å²	40.2	5%	0.048	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-73.5	163.1	173.1	-61.9	0	0	0	0	112	V652 W667 E668 Y680 I873 A875 V891	V650-V652 HydrophobicContact CG2-CG2 4.05Å; V650-W667 HydrophobicContact CB-CB 4.42Å; V650-W667 HydrophobicContact CB-CG 4.35Å; V650-W667 HydrophobicContact CG2-CB 4.32Å; V650-W667 HydrophobicContact CG2-CG 4.28Å; V650-E668 WeakPolarHBondContact CB-O 3.3Å; V650-Y680 HydrophobicContact CG1-CD1 3.59Å; V650-Y680 HydrophobicContact CG1-CE1 3.47Å; V650-Y680 VanDerWaalsContact CG1-CE1 3.47Å; V650-I873 HydrophobicContact CG2-CB 4.13Å; V650-I873 HydrophobicContact CG2-CG2 3.86Å; V650-A875 HydrophobicContact CG1-CB 3.97Å; V650-V891 HydrophobicContact CG2-CB 4.37Å; V650-V891 HydrophobicContact CG2-CG2 3.64Å; V650-V891 VanDerWaalsContact O-CG2 3.31Å; V650-V891 WeakPolarHBondContact O-CG2 3.38Å
651	V	87	Confident	88.8	Confident	26 Å²	26	42 Å²	42	16%	0.158	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	114.1	171.6	-176.6	0	0	0	0	108.8	W667 E668 V671 A715	V651-W667 CarbonylContact O-C 3.57Å; V651-W667 WeakPolarHBondContact O-CA 3.49Å; V651-W667 WeakPolarHBondContact O-CB 3.15Å; V651-E668 HydrophobicContact CB-CB 4.41Å; V651-E668 PolarHBondContact N-O 2.99Å; V651-E668 PolarHBondContact O-N 3.1Å; V651-V671 HydrophobicContact CG2-CG2 3.97Å; V651-A715 HydrophobicContact CG1-CB 4.31Å
652	V	86.6	Confident	88.8	Confident	6 Å²	6	37.5 Å²	37.5	4%	0.036	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	109.5	-173.9	-170.3	0	0	0	0	110.9	V650 V655 I665 R666 W667 M713 A715 I873 V891 I893	V650-V652 HydrophobicContact CG2-CG2 4.05Å; V652-V655 HydrophobicContact CG1-CG2 4.28Å; V652-I665 HydrophobicContact CG1-CG2 3.94Å; V652-R666 CarbonylContact C-O 3.35Å; V652-R666 VanDerWaalsContact CG1-O 3.3Å; V652-R666 WeakPolarHBondContact CG1-O 3.39Å; V652-W667 HydrophobicContact CB-CB 4.35Å; V652-W667 HydrophobicContact CG1-CB 4.43Å; V652-W667 HydrophobicContact CG2-CB 4.12Å; V652-M713 HydrophobicContact CB-CE 3.94Å; V652-M713 HydrophobicContact CG1-CE 3.45Å; V652-M713 VanDerWaalsContact CG1-CE 3.45Å; V652-A715 HydrophobicContact CB-CB 4.04Å; V652-A715 VanDerWaalsContact N-CB 3.32Å; V652-A715 WeakPolarHBondContact O-CB 3.48Å; V652-I873 HydrophobicContact CG2-CD1 4.4Å; V652-V891 HydrophobicContact CG2-CB 4.29Å; V652-V891 HydrophobicContact CG2-CG1 3.8Å; V652-V891 HydrophobicContact CG2-CG2 4.49Å; V652-I893 HydrophobicContact CG1-CD1 4.31Å; V652-I893 HydrophobicContact CG2-CD1 4.32Å
653	R	86.2	Confident	88.7	Confident	109 Å²	109	37.3 Å²	37.3	41%	0.411	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	-31	-171.9	-75	-67.8	-174.6	-141.4	-13.2	114.8	R666 E668 D716	R653-R666 PolarHBondContact N-O 2.86Å; R653-E668 HydrophobicContact CG-CG 4.12Å; R653-E668 IonicContact CZ-OE1 3.76Å; R653-E668 IonicContact CZ-OE2 2.79Å; R653-E668 IonicContact NE-OE1 2.69Å; R653-E668 PolarHBondContact NE-OE1 2.69Å; R653-E668 IonicContact NE-OE2 2.74Å; R653-E668 PolarHBondContact NE-OE2 3.37Å; R653-E668 VanDerWaalsContact NH2-CD 3.34Å; R653-E668 IonicContact NH2-OE1 3.09Å; R653-E668 PolarHBondContact NH2-OE1 2.76Å; R653-E668 IonicContact NH2-OE2 3.16Å; R653-E668 PolarHBondContact NH2-OE2 2.88Å; R653-D716 IonicContact CZ-OD1 2.76Å; R653-D716 IonicContact NH1-OD1 3.25Å; R653-D716 PolarHBondContact NH1-OD1 3.3Å; R653-D716 IonicContact NH1-OD2 3.76Å; R653-D716 PolarHBondContact NH1-OD2 3.28Å
654	N	86.8	Confident	88.8	Confident	60 Å²	60	36.4 Å²	36.4	32%	0.321	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	144.1	-176	-169.2	6.6	0	0	0	112.3	E656 R666	N654-E656 VanDerWaalsContact ND2-CD 3.35Å; N654-E656 PolarHBondContact ND2-OE1 3.32Å; N654-R666 PolarHBondContact N-O 3.11Å; N654-R666 PolarHBondContact ND2-NH1 3.36Å; N654-R666 PolarHBondContact O-N 2.99Å
655	V	89.1	Confident	89	Confident	21 Å²	21	33.3 Å²	33.3	13%	0.127	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	125.3	164.1	175.2	0	0	0	0	111.4	V652 I663 T664 I665 M713 I893 K895	V652-V655 HydrophobicContact CG1-CG2 4.28Å; V655-I663 HydrophobicContact CG1-CG2 3.53Å; V655-T664 CarbonylContact C-O 3.56Å; V655-T664 WeakPolarHBondContact CA-O 3.49Å; V655-I665 HydrophobicContact CG1-CG1 4.38Å; V655-I665 HydrophobicContact CG2-CB 4.06Å; V655-I665 HydrophobicContact CG2-CG1 3.89Å; V655-I665 HydrophobicContact CG2-CG2 3.75Å; V655-M713 HydrophobicContact CB-CE 4.21Å; V655-M713 HydrophobicContact CB-SD 3.4Å; V655-M713 WeakPolarHBondContact CB-SD 3.11Å; V655-M713 HydrophobicContact CG1-SD 4.18Å; V655-M713 HydrophobicContact CG2-CE 3.37Å; V655-M713 HydrophobicContact CG2-SD 3.24Å; V655-M713 WeakPolarHBondContact CG2-SD 3.49Å; V655-I893 HydrophobicContact CG2-CG2 4.36Å; V655-K895 HydrophobicContact CG1-CB 4.2Å; V655-K895 HydrophobicContact CG1-CD 4.45Å; V655-K895 HydrophobicContact CG1-CG 3.92Å
656	E	89.4	Confident	89.3	Confident	72 Å²	72	37.9 Å²	37.9	34%	0.336	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	141.8	-177.1	-68.3	153.6	169	0	0	109	N654 P658 I663 T664 R666	N654-E656 VanDerWaalsContact ND2-CD 3.35Å; N654-E656 PolarHBondContact ND2-OE1 3.32Å; E656-P658 WeakPolarHBondContact O-CD 3.49Å; E656-I663 CarbonylContact O-C 3.59Å; E656-I663 WeakPolarHBondContact O-CA 3.43Å; E656-T664 PolarHBondContact N-O 3.28Å; E656-T664 PolarHBondContact O-N 3.23Å; E656-R666 IonicContact OE1-NH1 2.99Å; E656-R666 PolarHBondContact OE1-NH1 3.25Å; E656-R666 IonicContact OE2-CZ 3.17Å; E656-R666 VanDerWaalsContact OE2-CZ 3.25Å; E656-R666 IonicContact OE2-NH1 2.73Å; E656-R666 PolarHBondContact OE2-NH1 3.46Å; E656-R666 IonicContact OE2-NH2 3.82Å; E656-R666 PolarHBondContact OE2-NH2 3.48Å
657	S	87.5	Confident	89.5	Confident	9 Å²	9	35.9 Å²	35.9	6%	0.063	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	88.9	164.4	-170.6	0	0	0	0	109.3	S659 T662 S896 T897	S657-S659 PolarHBondContact O-N 2.99Å; S657-S659 PolarHBondContact OG-O 2.98Å; S657-T662 WeakPolarHBondContact CA-O 3.5Å; S657-T662 PolarHBondContact OG-O 3.08Å; S657-S896 WeakPolarHBondContact CB-O 3.34Å; S657-T897 WeakPolarHBondContact OG-CA 3.38Å
658	P	85.6	Confident	89.6	Confident	90 Å²	90	39.4 Å²	39.4	58%	0.584	22%	0.215	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	3.8	-171.5	30.4	-35.1	0	0	0	114.3	E656	E656-P658 WeakPolarHBondContact O-CD 3.49Å
659	S	89.6	Confident	89.8	Confident	36 Å²	36	41.8 Å²	41.8	25%	0.252	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	173.7	176.5	78.3	0	0	0	0	111.4	S657 S661 T662	S657-S659 PolarHBondContact O-N 2.99Å; S657-S659 PolarHBondContact OG-O 2.98Å; S659-S661 PolarHBondContact O-N 3.39Å; S659-S661 VanDerWaalsContact O-N 3.11Å; S659-S661 PolarHBondContact OG-N 3Å; S659-S661 PolarHBondContact OG-OG 3.09Å; S659-T662 PolarHBondContact N-OG1 3.1Å; S659-T662 PolarHBondContact OG-N 2.75Å; S659-T662 PolarHBondContact OG-OG1 3.15Å
660	A	89.2	Confident	89.8	Confident	30 Å²	30	40 Å²	40	25%	0.248	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-1.7	170.9	0	0	0	0	0	114.4	R864 H865 T897 L898 V900	A660-R864 CarbonylContact O-C 3.32Å; A660-H865 HydrophobicContact CB-CB 4.02Å; A660-H865 WeakPolarHBondContact O-CA 3.32Å; A660-H865 PolarHBondContact O-N 3.41Å; A660-T897 WeakPolarHBondContact O-CB 3.21Å; A660-L898 WeakPolarHBondContact CB-O 3.39Å; A660-V900 HydrophobicContact CB-CG2 4.39Å
661	S	91.8	Very high	89.5	Confident	52 Å²	52	44.6 Å²	44.6	36%	0.364	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-139.9	13.6	-173.6	63.4	0	0	0	0	116.1	S659 N862 L863	S659-S661 PolarHBondContact O-N 3.39Å; S659-S661 VanDerWaalsContact O-N 3.11Å; S659-S661 PolarHBondContact OG-N 3Å; S659-S661 PolarHBondContact OG-OG 3.09Å; S661-N862 PolarHBondContact O-N 3.32Å; S661-N862 VanDerWaalsContact O-N 3.16Å; S661-L863 WeakPolarHBondContact CA-O 3.22Å; S661-L863 VanDerWaalsContact CB-O 3.26Å; S661-L863 WeakPolarHBondContact CB-O 3.38Å; S661-L863 PolarHBondContact O-N 2.74Å
662	T	93.3	Very high	89.4	Confident	28 Å²	28	47.4 Å²	47.4	17%	0.172	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	146.3	-174.3	57.4	0	0	0	0	113.8	S657 S659 L860	S657-T662 WeakPolarHBondContact CA-O 3.5Å; S657-T662 PolarHBondContact OG-O 3.08Å; S659-T662 PolarHBondContact N-OG1 3.1Å; S659-T662 PolarHBondContact OG-N 2.75Å; S659-T662 PolarHBondContact OG-OG1 3.15Å; T662-L860 VanDerWaalsContact CA-O 3.31Å; T662-L860 WeakPolarHBondContact CA-O 3.45Å
663	I	92	Very high	89.3	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	132.2	173.1	-66.1	170.2	0	0	0	110	V655 E656 I665 L860 L863 Y869 K895	V655-I663 HydrophobicContact CG1-CG2 3.53Å; E656-I663 CarbonylContact O-C 3.59Å; E656-I663 WeakPolarHBondContact O-CA 3.43Å; I663-I665 HydrophobicContact CG2-CG1 4.25Å; I663-L860 HydrophobicContact CB-CB 4.42Å; I663-L860 PolarHBondContact N-O 3.28Å; I663-L860 PolarHBondContact O-N 2.79Å; I663-L863 HydrophobicContact CB-CD1 4.05Å; I663-L863 HydrophobicContact CD1-CD1 3.64Å; I663-L863 HydrophobicContact CG1-CD1 3.62Å; I663-Y869 HydrophobicContact CD1-CD2 4.34Å; I663-K895 HydrophobicContact CD1-CB 4.16Å; I663-K895 HydrophobicContact CD1-CG 4.02Å; I663-K895 HydrophobicContact CG1-CG 4.27Å; I663-K895 HydrophobicContact CG2-CG 4.32Å
664	T	92.9	Very high	89.4	Confident	22 Å²	22	46.4 Å²	46.4	14%	0.135	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	140	178.5	-63.5	0	0	0	0	110.9	V655 E656 T859	V655-T664 CarbonylContact C-O 3.56Å; V655-T664 WeakPolarHBondContact CA-O 3.49Å; E656-T664 PolarHBondContact N-O 3.28Å; E656-T664 PolarHBondContact O-N 3.23Å; T664-T859 PolarHBondContact OG1-OG1 2.83Å
665	I	93	Very high	89.4	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	138.3	-171.2	-47.7	-176.3	0	0	0	111.1	V652 V655 I663 W667 N857 F858 L860 I871 I873 I893	V652-I665 HydrophobicContact CG1-CG2 3.94Å; V655-I665 HydrophobicContact CG1-CG1 4.38Å; V655-I665 HydrophobicContact CG2-CB 4.06Å; V655-I665 HydrophobicContact CG2-CG1 3.89Å; V655-I665 HydrophobicContact CG2-CG2 3.75Å; I663-I665 HydrophobicContact CG2-CG1 4.25Å; I665-W667 HydrophobicContact CB-CZ3 4.48Å; I665-W667 HydrophobicContact CG2-CE3 3.96Å; I665-W667 HydrophobicContact CG2-CZ3 4.16Å; I665-N857 VanDerWaalsContact O-CA 3.29Å; I665-N857 WeakPolarHBondContact O-CA 3.33Å; I665-F858 PolarHBondContact N-O 3.29Å; I665-F858 PolarHBondContact O-N 2.91Å; I665-L860 HydrophobicContact CD1-CD1 3.7Å; I665-L860 HydrophobicContact CG1-CD1 4.15Å; I665-I871 HydrophobicContact CD1-CB 4.06Å; I665-I871 HydrophobicContact CD1-CD1 4.26Å; I665-I871 HydrophobicContact CD1-CG1 4Å; I665-I871 HydrophobicContact CD1-CG2 3.72Å; I665-I873 HydrophobicContact CG2-CD1 4.05Å; I665-I893 HydrophobicContact CD1-CD1 4.22Å; I665-I893 HydrophobicContact CG2-CD1 4.01Å
666	R	94	Very high	89.4	Confident	100 Å²	100	49.3 Å²	49.3	38%	0.377	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	137.2	176.4	-53.6	-178	-173.2	101.4	6.5	111.7	V652 R653 N654 E656 T856 N857	V652-R666 CarbonylContact C-O 3.35Å; V652-R666 VanDerWaalsContact CG1-O 3.3Å; V652-R666 WeakPolarHBondContact CG1-O 3.39Å; R653-R666 PolarHBondContact N-O 2.86Å; N654-R666 PolarHBondContact N-O 3.11Å; N654-R666 PolarHBondContact ND2-NH1 3.36Å; N654-R666 PolarHBondContact O-N 2.99Å; E656-R666 IonicContact OE1-NH1 2.99Å; E656-R666 PolarHBondContact OE1-NH1 3.25Å; E656-R666 IonicContact OE2-CZ 3.17Å; E656-R666 VanDerWaalsContact OE2-CZ 3.25Å; E656-R666 IonicContact OE2-NH1 2.73Å; E656-R666 PolarHBondContact OE2-NH1 3.46Å; E656-R666 IonicContact OE2-NH2 3.82Å; E656-R666 PolarHBondContact OE2-NH2 3.48Å; R666-T856 CarbonylContact C-O 3.21Å; R666-T856 WeakPolarHBondContact CA-O 3.23Å; R666-N857 HydrophobicContact CG-CB 4.18Å
667	W	93.2	Very high	89.4	Confident	6 Å²	6	48.1 Å²	48.1	2%	0.023	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	179.7	-177.4	65	92.3	0	0	0	114.2	V650 V651 V652 I665 Y680 V682 V853 T856 F858 I873	V650-W667 HydrophobicContact CB-CB 4.42Å; V650-W667 HydrophobicContact CB-CG 4.35Å; V650-W667 HydrophobicContact CG2-CB 4.32Å; V650-W667 HydrophobicContact CG2-CG 4.28Å; V651-W667 CarbonylContact O-C 3.57Å; V651-W667 WeakPolarHBondContact O-CA 3.49Å; V651-W667 WeakPolarHBondContact O-CB 3.15Å; V652-W667 HydrophobicContact CB-CB 4.35Å; V652-W667 HydrophobicContact CG1-CB 4.43Å; V652-W667 HydrophobicContact CG2-CB 4.12Å; I665-W667 HydrophobicContact CB-CZ3 4.48Å; I665-W667 HydrophobicContact CG2-CE3 3.96Å; I665-W667 HydrophobicContact CG2-CZ3 4.16Å; W667-Y680 HydrophobicContact CZ2-CD2 4.14Å; W667-Y680 HydrophobicContact CZ2-CG 4.12Å; W667-Y680 AromaticContact NE1-CD1 3.57Å; W667-Y680 AromaticContact NE1-CD2 3.57Å; W667-Y680 AromaticContact NE1-CE1 3.75Å; W667-Y680 AromaticContact NE1-CE2 3.76Å; W667-Y680 AromaticContact NE1-CG 3.49Å; W667-Y680 AromaticContact NE1-CZ 3.85Å; W667-V682 HydrophobicContact CH2-CG2 3.79Å; W667-V682 HydrophobicContact CZ2-CG2 4.32Å; W667-V682 HydrophobicContact CZ3-CG2 4.46Å; W667-V853 HydrophobicContact CH2-CB 4.41Å; W667-V853 HydrophobicContact CH2-CG1 4.16Å; W667-V853 HydrophobicContact CZ2-CB 4.34Å; W667-V853 HydrophobicContact CZ2-CG1 4.2Å; W667-T856 PolarHBondContact N-O 2.87Å; W667-T856 WeakPolarHBondContact O-CB 3.29Å; W667-T856 PolarHBondContact O-OG1 2.96Å; W667-F858 HydrophobicContact CH2-CB 3.94Å; W667-F858 HydrophobicContact CZ3-CB 3.94Å; W667-I873 HydrophobicContact CD2-CD1 4.14Å; W667-I873 HydrophobicContact CE3-CD1 3.74Å; W667-I873 HydrophobicContact CZ3-CD1 3.97Å
668	E	91.9	Very high	89.5	Confident	79 Å²	79	51.3 Å²	51.3	37%	0.369	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	159.6	176.2	-79	177	-165.3	0	0	111.8	V650 V651 R653	V650-E668 WeakPolarHBondContact CB-O 3.3Å; V651-E668 HydrophobicContact CB-CB 4.41Å; V651-E668 PolarHBondContact N-O 2.99Å; V651-E668 PolarHBondContact O-N 3.1Å; R653-E668 HydrophobicContact CG-CG 4.12Å; R653-E668 IonicContact CZ-OE1 3.76Å; R653-E668 IonicContact CZ-OE2 2.79Å; R653-E668 IonicContact NE-OE1 2.69Å; R653-E668 PolarHBondContact NE-OE1 2.69Å; R653-E668 IonicContact NE-OE2 2.74Å; R653-E668 PolarHBondContact NE-OE2 3.37Å; R653-E668 VanDerWaalsContact NH2-CD 3.34Å; R653-E668 IonicContact NH2-OE1 3.09Å; R653-E668 PolarHBondContact NH2-OE1 2.76Å; R653-E668 IonicContact NH2-OE2 3.16Å; R653-E668 PolarHBondContact NH2-OE2 2.88Å
669	P	89.9	Confident	89.9	Confident	76 Å²	76	48.5 Å²	48.5	49%	0.494	28%	0.275	S	S	.	.			trans	-60.5	161.8	177.5	-23.2	34.6	0	0	0	114.8	V671	P669-V671 PolarHBondContact O-N 3.17Å
670	P	86.7	Confident	90.1	Very high	11 Å²	11	47.5 Å²	47.5	7%	0.071	27%	0.266	C	S	.	.			trans	-55.6	130.7	174.7	-29.9	39.3	0	0	0	114.2	P647 S648 L672 V677 A875	P647-P670 HydrophobicContact CB-CB 4.42Å; P647-P670 HydrophobicContact CB-CG 4.25Å; S648-P670 WeakPolarHBondContact O-CB 3.49Å; S648-P670 WeakPolarHBondContact O-CG 3.39Å; S648-P670 WeakPolarHBondContact OG-CA 3.44Å; S648-P670 WeakPolarHBondContact OG-CB 3.5Å; P670-L672 VanDerWaalsContact C-N 3.28Å; P670-L672 PolarHBondContact O-N 2.82Å; P670-V677 HydrophobicContact CG-CG2 4.15Å; P670-A875 HydrophobicContact CG-CB 3.45Å; P670-A875 VanDerWaalsContact CG-CB 3.45Å
671	V	84	Confident	90.3	Very high	103 Å²	103	48.3 Å²	48.3	62%	0.624	27%	0.265	S	S	*	.	S	Bend	trans	-64.3	-32.9	175.2	-179.6	0	0	0	0	111.9	S648 V651 P669	S648-V671 PolarHBondContact OG-N 3.49Å; V651-V671 HydrophobicContact CG2-CG2 3.97Å; P669-V671 PolarHBondContact O-N 3.17Å
672	L	84.8	Confident	90.3	Very high	86 Å²	86	45.9 Å²	45.9	45%	0.45	25%	0.248	S	C	.	.			trans	-120.6	90.5	171.3	-64.5	175.8	0	0	0	108.3	S648 P670 N674	S648-L672 PolarHBondContact N-O 2.89Å; S648-L672 PolarHBondContact OG-N 2.86Å; P670-L672 VanDerWaalsContact C-N 3.28Å; P670-L672 PolarHBondContact O-N 2.82Å; L672-N674 VanDerWaalsContact C-N 3.28Å; L672-N674 PolarHBondContact O-N 2.75Å
673	P	85	Confident	90.3	Very high	54 Å²	54	45.1 Å²	45.1	35%	0.351	24%	0.243	S	C	.	.			trans	-71.9	-24.4	-178	29.3	-35.5	0	0	0	112.5	G675 V677 Q877	P673-G675 PolarHBondContact O-N 3.07Å; P673-V677 HydrophobicContact CB-CG2 3.8Å; P673-Q877 PolarHBondContact O-NE2 2.94Å
674	N	88.2	Confident	90.3	Very high	39 Å²	39	47.4 Å²	47.4	21%	0.209	25%	0.252	C	S	.	.	S	Bend	trans	53.1	24.5	176.3	-62.9	-27.4	0	0	0	114.6	P612 G645 H646 L672	P612-N674 HydrophobicContact CB-CB 3.99Å; P612-N674 HydrophobicContact CG-CB 4.32Å; G645-N674 PolarHBondContact N-O 2.82Å; G645-N674 WeakPolarHBondContact O-CB 3.41Å; H646-N674 WeakPolarHBondContact O-CB 3.36Å; H646-N674 PolarHBondContact O-ND2 2.81Å; L672-N674 VanDerWaalsContact C-N 3.28Å; L672-N674 PolarHBondContact O-N 2.75Å
675	G	87.3	Confident	90.2	Very high	13 Å²	13	47.7 Å²	47.7	13%	0.134	25%	0.254	C	S	.	.	S	Bend	trans	154.4	-157.6	-166	0	0	0	0	0	109.6	F644 P673	F644-G675 VanDerWaalsContact CD1-CA 3.45Å; P673-G675 PolarHBondContact O-N 3.07Å
676	E	88.8	Confident	89.9	Confident	130 Å²	130	50.1 Å²	50.1	61%	0.607	27%	0.266	S	S	*	.			trans	-107.8	122.7	180	-63.5	-178.4	167.7	0	0	110.6	Q877	E676-Q877 VanDerWaalsContact O-CA 3.25Å; E676-Q877 WeakPolarHBondContact O-CA 3.45Å; E676-Q877 VanDerWaalsContact O-CB 3.24Å; E676-Q877 WeakPolarHBondContact O-CB 3.18Å; E676-Q877 WeakPolarHBondContact O-CG 3.34Å
677	V	88.5	Confident	89.2	Confident	47 Å²	47	48.5 Å²	48.5	29%	0.285	26%	0.262	S	S	.	.			trans	-90.6	132.4	-178.2	-179.8	0	0	0	0	109.9	P670 P673 Y680 A875	P670-V677 HydrophobicContact CG-CG2 4.15Å; P673-V677 HydrophobicContact CB-CG2 3.8Å; V677-Y680 HydrophobicContact CG1-CE1 4.48Å; V677-A875 HydrophobicContact CG1-CB 4.37Å
678	T	90.9	Very high	87.8	Confident	75 Å²	75	51.6 Å²	51.6	46%	0.46	30%	0.296	S	S	.	.			trans	-114.1	-35	-172.8	69.9	0	0	0	0	113.9	C876 Q877 N878	T678-C876 PolarHBondContact N-O 2.89Å; T678-C876 PolarHBondContact OG1-O 2.88Å; T678-Q877 PolarHBondContact OG1-O 2.84Å; T678-N878 HydrophobicContact CG2-CB 4.42Å
679	H	93.3	Very high	86.3	Confident	31 Å²	31	53.9 Å²	53.9	14%	0.144	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	172.4	-178.2	67.5	-71.9	0	0	0	112.6	C876 F885	H679-C876 VanDerWaalsContact CE1-CB 3.49Å; H679-C876 WeakPolarHBondContact CE1-CB 3.13Å; H679-C876 PolarHBondContact N-O 2.82Å; H679-C876 PolarHBondContact O-N 3.05Å; H679-F885 AromaticContact CE1-CZ 3.73Å
680	Y	93.9	Very high	84.7	Confident	16 Å²	16	55.6 Å²	55.6	6%	0.063	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	154.3	173.3	-51.5	-79.1	0	0	0	110.7	V650 W667 V677 N852 V853 G855 T856 W874 A875	V650-Y680 HydrophobicContact CG1-CD1 3.59Å; V650-Y680 HydrophobicContact CG1-CE1 3.47Å; V650-Y680 VanDerWaalsContact CG1-CE1 3.47Å; W667-Y680 HydrophobicContact CZ2-CD2 4.14Å; W667-Y680 HydrophobicContact CZ2-CG 4.12Å; W667-Y680 AromaticContact NE1-CD1 3.57Å; W667-Y680 AromaticContact NE1-CD2 3.57Å; W667-Y680 AromaticContact NE1-CE1 3.75Å; W667-Y680 AromaticContact NE1-CE2 3.76Å; W667-Y680 AromaticContact NE1-CG 3.49Å; W667-Y680 AromaticContact NE1-CZ 3.85Å; V677-Y680 HydrophobicContact CG1-CE1 4.48Å; Y680-N852 WeakPolarHBondContact O-CA 3.4Å; Y680-V853 WeakPolarHBondContact CD2-O 3.42Å; Y680-V853 PolarHBondContact N-O 3.31Å; Y680-V853 PolarHBondContact O-N 2.8Å; Y680-G855 VanDerWaalsContact CD2-O 3.25Å; Y680-G855 WeakPolarHBondContact CD2-O 3.28Å; Y680-T856 HydrophobicContact CE2-CG2 3.83Å; Y680-W874 WeakPolarHBondContact CA-O 3.39Å; Y680-W874 WeakPolarHBondContact CB-O 3.46Å; Y680-A875 HydrophobicContact CD1-CB 3.79Å; Y680-A875 HydrophobicContact CE1-CB 3.81Å
681	M	92.7	Very high	83.2	Confident	46 Å²	46	59.7 Å²	59.7	23%	0.227	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	134.6	168.1	-57.5	-172.2	-60.7	0	0	108.8	I873 W874	M681-I873 CarbonylContact O-C 3.56Å; M681-I873 VanDerWaalsContact O-CA 3.28Å; M681-I873 WeakPolarHBondContact O-CA 3.27Å; M681-W874 HydrophobicContact CB-CB 4.44Å; M681-W874 HydrophobicContact CB-CE3 4.07Å; M681-W874 HydrophobicContact CE-CB 3.99Å; M681-W874 HydrophobicContact CE-CD2 4.19Å; M681-W874 HydrophobicContact CE-CE3 4.37Å; M681-W874 HydrophobicContact CE-CG 4.06Å; M681-W874 PolarHBondContact N-O 3.42Å; M681-W874 PolarHBondContact O-N 3.33Å
682	V	93.1	Very high	81.9	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.006	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	133.9	177.4	-177.6	0	0	0	0	109	W667 V850 V851 V853 F858 I871 K872 I873	W667-V682 HydrophobicContact CH2-CG2 3.79Å; W667-V682 HydrophobicContact CZ2-CG2 4.32Å; W667-V682 HydrophobicContact CZ3-CG2 4.46Å; V682-V850 CarbonylContact O-C 3.3Å; V682-V850 WeakPolarHBondContact O-CA 3.43Å; V682-V851 PolarHBondContact N-O 3.24Å; V682-V851 PolarHBondContact O-N 2.82Å; V682-V853 HydrophobicContact CG2-CG2 3.84Å; V682-F858 HydrophobicContact CG1-CD1 4.05Å; V682-F858 HydrophobicContact CG1-CE1 4.49Å; V682-I871 HydrophobicContact CG1-CG2 3.76Å; V682-K872 CarbonylContact C-O 3.59Å; V682-K872 WeakPolarHBondContact CA-O 3.34Å; V682-I873 HydrophobicContact CG1-CG1 4.49Å; V682-I873 HydrophobicContact CG2-CG1 4.29Å; V682-I873 HydrophobicContact CG2-CG2 4.35Å
683	S	92.3	Very high	80.6	Confident	12 Å²	12	57.3 Å²	57.3	8%	0.084	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	140	179.8	174	0	0	0	0	110.9	V849 I871 K872	S683-V849 CarbonylContact C-O 3.58Å; S683-V849 WeakPolarHBondContact CA-O 3.47Å; S683-I871 CarbonylContact O-C 3.57Å; S683-I871 VanDerWaalsContact O-CA 3.27Å; S683-I871 WeakPolarHBondContact O-CA 3.33Å; S683-I871 WeakPolarHBondContact O-CG2 3.4Å; S683-K872 PolarHBondContact N-O 2.95Å; S683-K872 PolarHBondContact O-N 3.04Å
684	Y	92.1	Very high	79.6	Confident	48 Å²	48	62.2 Å²	62.2	19%	0.188	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	149.7	178.9	65.7	-88.2	0	0	0	115.3	P848 V849 L860 E870	Y684-P848 CarbonylContact O-C 3.57Å; Y684-P848 VanDerWaalsContact O-CA 3.25Å; Y684-P848 WeakPolarHBondContact O-CA 3.5Å; Y684-V849 HydrophobicContact CD1-CB 4.14Å; Y684-V849 HydrophobicContact CD2-CB 4.45Å; Y684-V849 HydrophobicContact CE1-CB 3.71Å; Y684-V849 HydrophobicContact CE1-CG1 3.71Å; Y684-V849 HydrophobicContact CE2-CB 4.06Å; Y684-V849 HydrophobicContact CE2-CG2 4.15Å; Y684-V849 HydrophobicContact CG-CB 4.49Å; Y684-V849 PolarHBondContact N-O 2.85Å; Y684-V849 PolarHBondContact O-N 2.81Å; Y684-L860 HydrophobicContact CD1-CD2 3.78Å; Y684-L860 HydrophobicContact CD1-CG 4.1Å; Y684-L860 HydrophobicContact CD2-CD2 3.69Å; Y684-L860 HydrophobicContact CE1-CD2 4.29Å; Y684-L860 HydrophobicContact CE1-CG 4.22Å; Y684-L860 HydrophobicContact CE2-CD2 4.21Å; Y684-L860 HydrophobicContact CG-CD2 3.45Å; Y684-L860 VanDerWaalsContact CG-CD2 3.45Å; Y684-L860 HydrophobicContact CG-CG 4.25Å; Y684-E870 CarbonylContact C-O 3.58Å; Y684-E870 WeakPolarHBondContact CA-O 3.5Å
685	V	90.7	Very high	78.7	Confident	29 Å²	29	65.5 Å²	65.5	18%	0.176	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	155.3	-178.4	68.6	0	0	0	0	111.2	A846 P848 Y869 E870	V685-A846 HydrophobicContact CG2-CB 3.71Å; V685-P848 HydrophobicContact CB-CB 4.18Å; V685-Y869 WeakPolarHBondContact O-CA 3.31Å; V685-E870 HydrophobicContact CG1-CB 3.97Å; V685-E870 HydrophobicContact CG1-CG 4.37Å; V685-E870 PolarHBondContact N-O 2.77Å; V685-E870 PolarHBondContact O-N 2.79Å
686	E	87.5	Confident	78.6	Confident	51 Å²	51	67.9 Å²	67.9	24%	0.238	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	136.4	173.9	-160.8	-169.6	111.5	0	0	111.2	R864 T867 Y869	E686-R864 IonicContact OE1-CZ 2.74Å; E686-R864 IonicContact OE1-NE 3.79Å; E686-R864 IonicContact OE1-NH2 2.9Å; E686-R864 PolarHBondContact OE1-NH2 2.99Å; E686-R864 IonicContact OE2-CZ 3.64Å; E686-R864 VanDerWaalsContact OE2-CZ 3.29Å; E686-R864 IonicContact OE2-NE 2.86Å; E686-R864 PolarHBondContact OE2-NE 2.97Å; E686-R864 IonicContact OE2-NH2 3.96Å; E686-R864 PolarHBondContact OE2-NH2 2.91Å; E686-T867 VanDerWaalsContact CD-CG2 3.46Å; E686-T867 HydrophobicContact CG-CG2 3.47Å; E686-T867 VanDerWaalsContact CG-CG2 3.47Å; E686-Y869 HydrophobicContact CB-CD1 4.04Å; E686-Y869 HydrophobicContact CB-CE1 3.66Å; E686-Y869 HydrophobicContact CG-CD1 4.28Å; E686-Y869 HydrophobicContact CG-CE1 3.78Å; E686-Y869 HydrophobicContact CG-CE2 4.47Å; E686-Y869 PolarHBondContact OE2-OH 3.36Å
687	E	78	Confident	78.4	Confident	66 Å²	66	63.1 Å²	63.1	31%	0.308	35%	0.352	S	S	.	.			trans	-86.6	128.1	-179.4	-164.9	166.5	-124.3	0	0	111.8	R689 M868 R892 L894	E687-R689 PolarHBondContact O-N 2.69Å; E687-M868 HydrophobicContact CB-CB 4.34Å; E687-M868 HydrophobicContact CB-CG 4.31Å; E687-M868 PolarHBondContact N-O 3.4Å; E687-R892 IonicContact OE1-CZ 3.16Å; E687-R892 IonicContact OE1-NH1 2.66Å; E687-R892 IonicContact OE1-NH2 3.88Å; E687-R892 PolarHBondContact OE1-NH2 2.85Å; E687-L894 WeakPolarHBondContact OE2-CD2 3.25Å
688	G	64.1	Low	78.4	Confident	70 Å²	70	62.6 Å²	62.6	72%	0.722	35%	0.35	S	S	*	.			trans	-70.8	115.6	-176.5	0	0	0	0	0	112.9
689	R	60.6	Low	78.2	Confident	127 Å²	127	65.1 Å²	65.1	48%	0.479	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-55.8	131.7	180	-60.2	180	-173.5	157.6	4.5	111.6	E687 T867 G935	E687-R689 PolarHBondContact O-N 2.69Å; R689-T867 PolarHBondContact NH2-OG1 2.88Å; R689-G935 VanDerWaalsContact CZ-O 3.26Å; R689-G935 PolarHBondContact NH1-O 2.84Å
690	P	56	Low	77.7	Confident	112 Å²	112	68.7 Å²	68.7	73%	0.727	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-68.4	154.3	172.6	29.6	-34.7	0	0	0	111.1	A692	P690-A692 PolarHBondContact O-N 2.88Å
691	P	55.4	Low	76.9	Confident	97 Å²	97	70.6 Å²	70.6	63%	0.63	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-62	134.4	175.3	-20.6	33.2	0	0	0	111.6	T693	P691-T693 PolarHBondContact O-N 3.36Å; P691-T693 VanDerWaalsContact O-N 3.15Å
692	A	56.2	Low	76	Confident	41 Å²	41	69.2 Å²	69.2	34%	0.339	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-73	1.2	176.7	0	0	0	0	0	113.9	P690 Y697	P690-A692 PolarHBondContact O-N 2.88Å; A692-Y697 HydrophobicContact CB-CE2 4.33Å
693	T	57.5	Low	75.2	Confident	98 Å²	98	74.2 Å²	74.2	60%	0.601	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-78.4	-19.5	-166.2	51.6	0	0	0	0	115.6	P691	P691-T693 PolarHBondContact O-N 3.36Å; P691-T693 VanDerWaalsContact O-N 3.15Å
694	D	63.8	Low	74.4	Confident	158 Å²	158	76.3 Å²	76.3	85%	0.845	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-93	-0.2	-169.4	-71.3	17.9	0	0	0	113.3
695	R	70.8	Confident	72.9	Confident	108 Å²	108	78.7 Å²	78.7	41%	0.408	44%	0.442	S	S	.	.	S	Bend	trans	-130.2	129.9	-177	-167.1	-176.3	-164.3	-155.3	6.2	111.7	Y697 E700	R695-Y697 HydrophobicContact CB-CD2 4.36Å; R695-Y697 HydrophobicContact CB-CE2 4.01Å; R695-Y697 VanDerWaalsContact O-CD2 3.27Å; R695-Y697 WeakPolarHBondContact O-CD2 3.35Å; R695-Y697 PolarHBondContact O-N 3.2Å; R695-E700 IonicContact CZ-OE2 2.91Å; R695-E700 IonicContact NE-OE2 2.69Å; R695-E700 PolarHBondContact NE-OE2 3.27Å; R695-E700 PolarHBondContact NH1-O 2.76Å; R695-E700 IonicContact NH2-OE2 2.73Å; R695-E700 PolarHBondContact NH2-OE2 2.96Å
696	N	83.8	Confident	70.9	Confident	62 Å²	62	82 Å²	82	33%	0.332	46%	0.463	S	S	.	.			trans	-79.1	98.2	169.5	-175.2	-0.8	0	0	0	110.3	C698 D699 E700 T960	N696-C698 PolarHBondContact O-N 3.34Å; N696-C698 VanDerWaalsContact OD1-CB 3.32Å; N696-C698 WeakPolarHBondContact OD1-CB 3.35Å; N696-C698 PolarHBondContact OD1-N 3.19Å; N696-D699 HydrophobicContact CB-CB 4.31Å; N696-D699 PolarHBondContact ND2-OD1 3.22Å; N696-D699 PolarHBondContact ND2-OD2 3.18Å; N696-D699 PolarHBondContact O-N 2.86Å; N696-E700 PolarHBondContact O-N 3.41Å; N696-T960 WeakPolarHBondContact OD1-CG2 3.31Å
697	Y	86	Confident	68.7	Low	31 Å²	31	83.2 Å²	83.2	12%	0.122	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-2.7	178.4	-69.7	-87	0	0	0	114.8	A692 R695 P701 P702 V938 L989	A692-Y697 HydrophobicContact CB-CE2 4.33Å; R695-Y697 HydrophobicContact CB-CD2 4.36Å; R695-Y697 HydrophobicContact CB-CE2 4.01Å; R695-Y697 VanDerWaalsContact O-CD2 3.27Å; R695-Y697 WeakPolarHBondContact O-CD2 3.35Å; R695-Y697 PolarHBondContact O-N 3.2Å; Y697-P701 VanDerWaalsContact O-CA 3.23Å; Y697-P701 WeakPolarHBondContact O-CA 3.4Å; Y697-P702 HydrophobicContact CD1-CG 3.92Å; Y697-P702 HydrophobicContact CE1-CG 4.21Å; Y697-V938 HydrophobicContact CD1-CB 4Å; Y697-V938 HydrophobicContact CD1-CG1 4.22Å; Y697-V938 HydrophobicContact CD1-CG2 4.04Å; Y697-V938 HydrophobicContact CD2-CB 3.64Å; Y697-V938 HydrophobicContact CD2-CG1 3.96Å; Y697-V938 HydrophobicContact CD2-CG2 4.49Å; Y697-V938 HydrophobicContact CE1-CB 4.32Å; Y697-V938 HydrophobicContact CE1-CG1 4.02Å; Y697-V938 HydrophobicContact CE2-CB 3.99Å; Y697-V938 HydrophobicContact CE2-CG1 3.76Å; Y697-V938 HydrophobicContact CG-CB 3.62Å; Y697-V938 HydrophobicContact CG-CG1 4.17Å; Y697-V938 HydrophobicContact CG-CG2 3.98Å; Y697-L989 HydrophobicContact CE1-CD2 4.2Å
698	C	87.9	Confident	67	Low	36 Å²	36	82 Å²	82	24%	0.243	48%	0.476	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-35.7	167.9	-66.4	0	0	0	0	112.7	N696 C958 I959	N696-C698 PolarHBondContact O-N 3.34Å; N696-C698 VanDerWaalsContact OD1-CB 3.32Å; N696-C698 WeakPolarHBondContact OD1-CB 3.35Å; N696-C698 PolarHBondContact OD1-N 3.19Å; C698-C958 WeakPolarHBondContact CA-SG 3.45Å; C698-C958 HydrophobicContact CB-CB 3.6Å; C698-C958 WeakPolarHBondContact CB-SG 3.31Å; C698-C958 WeakPolarHBondContact SG-CB 3.37Å; C698-C958 CovalentContact SG-SG 2.04Å; C698-C958 PolarHBondContact SG-SG 3.47Å; C698-I959 PolarHBondContact SG-N 3.39Å
699	D	86.4	Confident	65.8	Low	128 Å²	128	83 Å²	83	68%	0.684	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-38.6	171.2	-62.9	-27.2	0	0	0	110.6	N696	N696-D699 HydrophobicContact CB-CB 4.31Å; N696-D699 PolarHBondContact ND2-OD1 3.22Å; N696-D699 PolarHBondContact ND2-OD2 3.18Å; N696-D699 PolarHBondContact O-N 2.86Å
700	E	82.5	Confident	64.4	Low	105 Å²	105	86.8 Å²	86.8	49%	0.491	48%	0.479	S	S	.	.	S	Bend	trans	-128.5	75.4	-177.2	-62.1	-171.6	-176.1	0	0	112.5	R695 N696	R695-E700 IonicContact CZ-OE2 2.91Å; R695-E700 IonicContact NE-OE2 2.69Å; R695-E700 PolarHBondContact NE-OE2 3.27Å; R695-E700 PolarHBondContact NH1-O 2.76Å; R695-E700 IonicContact NH2-OE2 2.73Å; R695-E700 PolarHBondContact NH2-OE2 2.96Å; N696-E700 PolarHBondContact O-N 3.41Å
701	P	78.5	Confident	63	Low	57 Å²	57	86.1 Å²	86.1	37%	0.37	47%	0.469	S	S	.	.			trans	-62.4	155.9	178.4	25.5	-34.8	0	0	0	112.9	Y697	Y697-P701 VanDerWaalsContact O-CA 3.23Å; Y697-P701 WeakPolarHBondContact O-CA 3.4Å
702	P	73.1	Confident	61.6	Low	16 Å²	16	86.4 Å²	86.4	10%	0.104	47%	0.47	C	S	.	.			trans	-60.6	143.6	176.3	-20.1	32.3	0	0	0	112.5	Y697 Y704 V938	Y697-P702 HydrophobicContact CD1-CG 3.92Å; Y697-P702 HydrophobicContact CE1-CG 4.21Å; P702-Y704 HydrophobicContact CB-CD1 4.29Å; P702-Y704 HydrophobicContact CB-CE1 3.76Å; P702-Y704 HydrophobicContact CB-CE2 4.31Å; P702-Y704 HydrophobicContact CG-CE1 4.15Å; P702-Y704 WeakPolarHBondContact O-CD2 3.42Å; P702-Y704 WeakPolarHBondContact O-CE2 3.15Å; P702-Y704 PolarHBondContact O-N 3.24Å; P702-Y704 VanDerWaalsContact O-N 3.1Å; P702-V938 HydrophobicContact CG-CG2 3.96Å
703	D	75.6	Confident	60.4	Low	106 Å²	106	86.7 Å²	86.7	57%	0.567	47%	0.465	S	S	*	.			trans	-84.5	83.5	176.8	-172.3	-0.1	0	0	0	111.4	S705 V706	D703-S705 PolarHBondContact O-N 3.48Å; D703-S705 VanDerWaalsContact OD1-CB 3.25Å; D703-S705 WeakPolarHBondContact OD1-CB 3.33Å; D703-S705 PolarHBondContact OD1-N 2.94Å; D703-S705 PolarHBondContact OD1-OG 3.43Å; D703-S705 PolarHBondContact OD2-OG 3.47Å; D703-V706 HydrophobicContact CB-CG2 4.36Å; D703-V706 PolarHBondContact O-N 3.29Å; D703-V706 VanDerWaalsContact O-N 3.16Å
704	Y	75.1	Confident	58.8	Low	56 Å²	56	87.5 Å²	87.5	22%	0.22	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-4.4	175.5	-49.7	-67.6	0	0	0	114.5	P702 V706 L987 S988 A990 Q991 R992	P702-Y704 HydrophobicContact CB-CD1 4.29Å; P702-Y704 HydrophobicContact CB-CE1 3.76Å; P702-Y704 HydrophobicContact CB-CE2 4.31Å; P702-Y704 HydrophobicContact CG-CE1 4.15Å; P702-Y704 WeakPolarHBondContact O-CD2 3.42Å; P702-Y704 WeakPolarHBondContact O-CE2 3.15Å; P702-Y704 PolarHBondContact O-N 3.24Å; P702-Y704 VanDerWaalsContact O-N 3.1Å; Y704-V706 VanDerWaalsContact C-N 3.28Å; Y704-L987 WeakPolarHBondContact OH-CB 3.23Å; Y704-S988 WeakPolarHBondContact CE1-O 3.43Å; Y704-S988 PolarHBondContact OH-O 2.91Å; Y704-S988 VanDerWaalsContact OH-O 3.14Å; Y704-A990 WeakPolarHBondContact CD1-O 3.47Å; Y704-Q991 WeakPolarHBondContact CE1-O 3.18Å; Y704-R992 HydrophobicContact CD2-CG 3.95Å; Y704-R992 HydrophobicContact CE2-CG 3.4Å
705	S	61.6	Low	57	Low	98 Å²	98	81 Å²	81	69%	0.685	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-15.4	172.7	78.2	0	0	0	0	112.9	D703 S707	D703-S705 PolarHBondContact O-N 3.48Å; D703-S705 VanDerWaalsContact OD1-CB 3.25Å; D703-S705 WeakPolarHBondContact OD1-CB 3.33Å; D703-S705 PolarHBondContact OD1-N 2.94Å; D703-S705 PolarHBondContact OD1-OG 3.43Å; D703-S705 PolarHBondContact OD2-OG 3.47Å; S705-S707 PolarHBondContact O-N 3.48Å; S705-S707 VanDerWaalsContact O-N 3.15Å
706	V	49.1	Very low	54.9	Low	99 Å²	99	80.4 Å²	80.4	60%	0.6	44%	0.443	S	S	*	.	S	Bend	trans	-86	80.2	176.2	-170.8	0	0	0	0	110.4	D703 Y704 S708	D703-V706 HydrophobicContact CB-CG2 4.36Å; D703-V706 PolarHBondContact O-N 3.29Å; D703-V706 VanDerWaalsContact O-N 3.16Å; Y704-V706 VanDerWaalsContact C-N 3.28Å; V706-S708 PolarHBondContact O-N 2.98Å
707	S	41	Very low	52.3	Low	77 Å²	77	83.6 Å²	83.6	54%	0.538	47%	0.465	S	S	.	.			trans	-51.2	125	169.4	59.7	0	0	0	0	111	S705 D709 R710	S705-S707 PolarHBondContact O-N 3.48Å; S705-S707 VanDerWaalsContact O-N 3.15Å; S707-D709 PolarHBondContact O-N 3.5Å; S707-R710 PolarHBondContact O-N 3.27Å
708	S	43.1	Very low	49.5	Very low	41 Å²	41	90.4 Å²	90.4	29%	0.287	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	1.4	-165.9	70.3	0	0	0	0	117.1	V706 R710	V706-S708 PolarHBondContact O-N 2.98Å; S708-R710 VanDerWaalsContact C-N 3.33Å; S708-R710 PolarHBondContact O-N 3.37Å
709	D	38.5	Very low	46.7	Very low	89 Å²	89	92.3 Å²	92.3	48%	0.476	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	10	175.1	-75	-56.6	0	0	0	115.3	S707 K895	S707-D709 PolarHBondContact O-N 3.5Å; D709-K895 IonicContact OD1-NZ 3.25Å; D709-K895 PolarHBondContact OD1-NZ 2.86Å
710	R	30.6	Very low	44.1	Very low	207 Å²	207	90.8 Å²	90.8	78%	0.781	51%	0.507	S	S	*	.			trans	-108.9	36.6	173.5	-67.2	-166	175.9	-175.2	1.2	115.2	S707 S708	S707-R710 PolarHBondContact O-N 3.27Å; S708-R710 VanDerWaalsContact C-N 3.33Å; S708-R710 PolarHBondContact O-N 3.37Å
711	L	26.9	Very low	41.5	Very low	99 Å²	99	87.1 Å²	87.1	52%	0.518	50%	0.497	S	S	.	.			trans	-110.4	70.3	155	-75.1	174.3	0	0	0	112.6	M868	L711-M868 HydrophobicContact CD1-CE 3.92Å
712	P	26.2	Very low	39.2	Very low	103 Å²	103	87.6 Å²	87.6	67%	0.669	51%	0.506	S	S	*	.			trans	-81.3	101.5	138.6	32.6	-25.1	0	0	0	107.1
713	M	29.6	Very low	37	Very low	46 Å²	46	92 Å²	92	23%	0.227	54%	0.538	C	S	.	.				68	132.5	79.7	-68.8	176	53.5	0	0	115.1	V652 V655 A715 I893	V652-M713 HydrophobicContact CB-CE 3.94Å; V652-M713 HydrophobicContact CG1-CE 3.45Å; V652-M713 VanDerWaalsContact CG1-CE 3.45Å; V655-M713 HydrophobicContact CB-CE 4.21Å; V655-M713 HydrophobicContact CB-SD 3.4Å; V655-M713 WeakPolarHBondContact CB-SD 3.11Å; V655-M713 HydrophobicContact CG1-SD 4.18Å; V655-M713 HydrophobicContact CG2-CE 3.37Å; V655-M713 HydrophobicContact CG2-SD 3.24Å; V655-M713 WeakPolarHBondContact CG2-SD 3.49Å; M713-A715 PolarHBondContact O-N 2.83Å; M713-I893 HydrophobicContact CE-CB 4.2Å; M713-I893 HydrophobicContact CE-CD1 3.87Å; M713-I893 HydrophobicContact CE-CG1 3.69Å; M713-I893 HydrophobicContact CE-CG2 3.7Å; M713-I893 HydrophobicContact CG-CG2 4.25Å; M713-I893 HydrophobicContact SD-CG2 3.63Å
714	T	25.8	Very low	34.7	Very low	116 Å²	116	93.3 Å²	93.3	71%	0.712	55%	0.549	S	S	*	.	S	Bend	trans	-77.1	83	-178.9	50.8	0	0	0	0	112
715	A	25.1	Very low	32.4	Very low	22 Å²	22	94.3 Å²	94.3	18%	0.182	57%	0.569	C	S	.	*			trans	-161.9	70.5	172.4	0	0	0	0	0	113.8	V651 V652 M713	V651-A715 HydrophobicContact CG1-CB 4.31Å; V652-A715 HydrophobicContact CB-CB 4.04Å; V652-A715 VanDerWaalsContact N-CB 3.32Å; V652-A715 WeakPolarHBondContact O-CB 3.48Å; M713-A715 PolarHBondContact O-N 2.83Å
716	D	26.3	Very low	30.7	Very low	94 Å²	94	95.2 Å²	95.2	50%	0.503	57%	0.57	S	S	.	*			trans	-170.9	53.5	142.4	-102.4	-31.7	0	0	0	111.3	R653 H718	R653-D716 IonicContact CZ-OD1 2.76Å; R653-D716 IonicContact NH1-OD1 3.25Å; R653-D716 PolarHBondContact NH1-OD1 3.3Å; R653-D716 IonicContact NH1-OD2 3.76Å; R653-D716 PolarHBondContact NH1-OD2 3.28Å; D716-H718 PolarHBondContact O-N 3.45Å; D716-H718 IonicContact OD1-CD2 3.79Å
717	T	28.6	Very low	29.6	Very low	129 Å²	129	97.2 Å²	97.2	79%	0.791	58%	0.577	S	S	*	*			trans	-75	72.2	170.5	47.7	0	0	0	0	110.9	S719	T717-S719 PolarHBondContact O-N 3.41Å
718	H	28.6	Very low	28.7	Very low	174 Å²	174	101.9 Å²	101.9	81%	0.806	59%	0.59	S	S	*	*			trans	-69.9	61.5	161.6	-93.5	-81.9	0	0	0	110.3	D716	D716-H718 PolarHBondContact O-N 3.45Å; D716-H718 IonicContact OD1-CD2 3.79Å
719	S	29.6	Very low	28	Very low	76 Å²	76	106.6 Å²	106.6	53%	0.531	61%	0.61	S	S	.	*			trans	-150.1	112.5	-178.8	60.1	0	0	0	0	112.3	T717	T717-S719 PolarHBondContact O-N 3.41Å
720	T	32	Very low	27.5	Very low	97 Å²	97	109 Å²	109	60%	0.595	63%	0.628	S	S	*	*			trans	49.7	104.9	150.5	58	0	0	0	0	117.8	F393 A722	F393-T720 HydrophobicContact CD1-CG2 4.47Å; T720-A722 PolarHBondContact O-N 3.25Å
721	G	26.9	Very low	27.4	Very low	27 Å²	27	111.2 Å²	111.2	28%	0.278	64%	0.637	S	S	.	*			trans	-67.4	112.3	150.7	0	0	0	0	0	110.4	H394	H394-G721 CarbonylContact C-O 3.56Å; H394-G721 VanDerWaalsContact C-O 3.28Å; H394-G721 WeakPolarHBondContact CB-O 3.44Å
722	A	29.4	Very low	27.5	Very low	67 Å²	67	109.6 Å²	109.6	55%	0.554	64%	0.644	S	S	*	*			trans	-158.3	157.9	150.2	0	0	0	0	0	108.4	H394 T720	H394-A722 HydrophobicContact CB-CB 3.8Å; T720-A722 PolarHBondContact O-N 3.25Å
723	S	27.2	Very low	27.6	Very low	110 Å²	110	111.2 Å²	111.2	77%	0.769	66%	0.658	S	S	*	*			trans	-28.7	146.2	162	-138.7	0	0	0	0	114
724	V	28.2	Very low	27.7	Very low	132 Å²	132	112.8 Å²	112.8	80%	0.8	69%	0.685	S	S	*	*				-150.7	162.4	52.6	168.2	0	0	0	0	112.5
725	A	27.3	Very low	27.7	Very low	77 Å²	77	119.1 Å²	119.1	64%	0.636	70%	0.696	S	S	*	*			trans	-46.7	153.3	172.5	0	0	0	0	0	117.2
726	T	24.2	Very low	28.1	Very low	117 Å²	117	123 Å²	123	72%	0.718	72%	0.719	S	S	*	*			trans	-2.1	122.2	130.8	-48.2	0	0	0	0	116.5
727	L	26	Very low	28.2	Very low	142 Å²	142	125 Å²	125	74%	0.743	74%	0.735	S	S	*	*			trans	-158.9	114.5	148.8	-115.2	159.9	0	0	0	112	I729	L727-I729 HydrophobicContact CD2-CG1 4.43Å
728	H	23.4	Very low	28.2	Very low	175 Å²	175	124 Å²	124	81%	0.81	74%	0.74	S	S	*	*			trans	-74.7	126.2	167	-69.1	-101.2	0	0	0	109.9
729	I	27.2	Very low	28.1	Very low	140 Å²	140	119 Å²	119	72%	0.718	74%	0.735	S	S	*	*			trans	-145.8	124.6	152.2	-42.3	176.8	0	0	0	110	L727	L727-I729 HydrophobicContact CD2-CG1 4.43Å
730	T	28	Very low	28.3	Very low	138 Å²	138	122.7 Å²	122.7	85%	0.847	75%	0.749	S	S	*	*				152.6	104.6	128	44.6	0	0	0	0	111.8
731	R	29.3	Very low	28.2	Very low	255 Å²	255	126.5 Å²	126.5	96%	0.962	76%	0.76	S	S	*	*			trans	-147.5	87.4	158.5	-154.3	174.7	-167.2	177.1	4.4	112.5
732	G	28	Very low	28.4	Very low	65 Å²	65	133.3 Å²	133.3	67%	0.67	79%	0.789	S	S	*	*			trans	73.1	118	138.2	0	0	0	0	0	121.1
733	S	29.6	Very low	28.4	Very low	137 Å²	137	134.1 Å²	134.1	96%	0.958	80%	0.796	S	S	*	*			trans	79.8	144.3	139.6	78.5	0	0	0	0	120.8
734	G	30.4	Very low	28.4	Very low	78 Å²	78	134.4 Å²	134.4	80%	0.804	80%	0.798	S	S	*	*			trans	155.7	113	179.2	0	0	0	0	0	109.7
735	R	26.7	Very low	28.6	Very low	250 Å²	250	133.9 Å²	133.9	94%	0.943	80%	0.797	S	S	*	*			trans	-113.5	-178.6	-174.5	-119.3	-157.3	162.2	167.8	-5.9	110.9
736	P	32.5	Very low	28.7	Very low	102 Å²	102	138.6 Å²	138.6	66%	0.662	81%	0.811	S	S	*	*			trans	-99.7	175.7	-145.9	42.8	-38.5	0	0	0	114.1
737	T	28.6	Very low	29	Very low	138 Å²	138	136.7 Å²	136.7	85%	0.847	82%	0.815	S	S	*	*				-175.9	145.6	129.1	31	0	0	0	0	112
738	A	29.4	Very low	29.2	Very low	108 Å²	108	134.9 Å²	134.9	89%	0.893	81%	0.814	S	S	*	*			trans	36.6	142.1	151.8	0	0	0	0	0	121.6
739	G	27.2	Very low	29.8	Very low	68 Å²	68	129.7 Å²	129.7	70%	0.701	80%	0.797	S	S	*	*			cis	166.4	-175.3	0.6	0	0	0	0	0	112.5
740	N	32.5	Very low	30.2	Very low	154 Å²	154	130.2 Å²	130.2	82%	0.824	80%	0.801	S	S	*	*			trans	72.6	90.2	173.1	-62.1	-12.2	0	0	0	119.3
741	H	29.9	Very low	30.5	Very low	176 Å²	176	131.4 Å²	131.4	82%	0.815	80%	0.797	S	S	*	*				33.8	119.9	128.6	-58.7	-76.1	0	0	0	121
742	L	30.7	Very low	30.8	Very low	171 Å²	171	127.4 Å²	127.4	90%	0.895	79%	0.794	S	S	*	*				-168.7	128.2	105.9	-102.9	155.5	0	0	0	113.8
743	A	29.5	Very low	31.4	Very low	84 Å²	84	134 Å²	134	69%	0.694	80%	0.804	S	S	*	*			trans	61.3	104.5	158.5	0	0	0	0	0	122.4
744	S	28.8	Very low	31.9	Very low	116 Å²	116	131.4 Å²	131.4	81%	0.811	79%	0.785	S	S	*	*			trans	76.4	144.5	136	-56.3	0	0	0	0	121.6
745	P	32.5	Very low	32.5	Very low	121 Å²	121	133.4 Å²	133.4	79%	0.786	79%	0.786	S	S	*	*			cis	-135	146.1	-48.2	34.2	-17.5	0	0	0	114
746	D	28.3	Very low	33	Very low	175 Å²	175	131.4 Å²	131.4	94%	0.936	78%	0.784	S	S	*	*			trans	-69.9	157.6	179.4	-59.4	-80.5	0	0	0	115.1
747	G	30.7	Very low	33.2	Very low	77 Å²	77	132.1 Å²	132.1	79%	0.794	79%	0.79	S	S	*	*			trans	-178.5	53.2	178.1	0	0	0	0	0	116.8	C749	G747-C749 PolarHBondContact O-N 3.27Å
748	S	31.1	Very low	33.4	Very low	105 Å²	105	131.6 Å²	131.6	73%	0.734	79%	0.789	S	S	*	*			trans	-66.9	125.2	176.4	53.2	0	0	0	0	112.9
749	C	35.8	Very low	33.8	Very low	65 Å²	65	131 Å²	131	44%	0.439	78%	0.784	S	S	.	*			trans	-103.8	80.6	173.1	-172.3	0	0	0	0	112.6	G747 Q751 C754	G747-C749 PolarHBondContact O-N 3.27Å; C749-Q751 PolarHBondContact O-N 3.46Å; C749-C754 HydrophobicContact CB-CB 3.73Å; C749-C754 WeakPolarHBondContact CB-SG 3.38Å; C749-C754 WeakPolarHBondContact SG-CB 3.38Å; C749-C754 CovalentContact SG-SG 2.03Å; C749-C754 PolarHBondContact SG-SG 2.99Å
750	D	34.1	Very low	34.1	Very low	152 Å²	152	135.6 Å²	135.6	81%	0.813	79%	0.792	S	S	*	*			trans	-80.1	46.3	172.4	-70	-48.2	0	0	0	112.6
751	Q	34.2	Very low	33.9	Very low	162 Å²	162	132.2 Å²	132.2	76%	0.757	79%	0.794	S	S	*	*	S	Bend	trans	-141.6	139.6	172.2	-65.9	-168.5	9.6	0	0	111.4	C749 K753	C749-Q751 PolarHBondContact O-N 3.46Å; Q751-K753 PolarHBondContact O-N 2.89Å
752	L	35.6	Very low	34	Very low	172 Å²	172	129.2 Å²	129.2	90%	0.901	79%	0.793	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	136.1	168.6	-82.9	68	0	0	0	109.4
753	K	40.4	Very low	33.9	Very low	203 Å²	203	129.9 Å²	129.9	88%	0.883	80%	0.796	S	S	*	*	T	Hydrogen-bonded Turn	trans	91.1	25.4	179.8	-50.5	179.3	177.7	-173.6	0	118.1	Q751	Q751-K753 PolarHBondContact O-N 2.89Å
754	C	41.2	Very low	33.8	Very low	83 Å²	83	129 Å²	129	56%	0.561	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-88.5	118	152.9	-78.9	0	0	0	0	110.9	C749	C749-C754 HydrophobicContact CB-CB 3.73Å; C749-C754 WeakPolarHBondContact CB-SG 3.38Å; C749-C754 WeakPolarHBondContact SG-CB 3.38Å; C749-C754 CovalentContact SG-SG 2.03Å; C749-C754 PolarHBondContact SG-SG 2.99Å
755	C	42.9	Very low	33.8	Very low	120 Å²	120	128.8 Å²	128.8	81%	0.811	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-86.2	144.4	163.2	-63	0	0	0	0	109.4	C757	C755-C757 PolarHBondContact O-N 3.33Å
756	K	37.4	Very low	33.7	Very low	207 Å²	207	127.3 Å²	127.3	90%	0.9	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-69.3	125.2	163	-74.3	-174	176.4	-177.4	0	108.4
757	C	35.3	Very low	33.7	Very low	117 Å²	117	121.8 Å²	121.8	79%	0.791	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-64.1	142.9	160.5	-61.1	0	0	0	0	108.8	C755 A759	C755-C757 PolarHBondContact O-N 3.33Å; C757-A759 PolarHBondContact O-N 2.9Å
758	P	34.4	Very low	33.8	Very low	127 Å²	127	124.8 Å²	124.8	83%	0.825	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-63.8	128.8	165.6	28.5	-32.4	0	0	0	108.6
759	A	36.8	Very low	33.7	Very low	97 Å²	97	123.7 Å²	123.7	80%	0.802	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-71.5	156.7	165.2	0	0	0	0	0	109.5	C757	C757-A759 PolarHBondContact O-N 2.9Å
760	D	33.7	Very low	33.5	Very low	163 Å²	163	127 Å²	127	87%	0.872	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-56.8	148.3	-167.6	-79.6	-65.8	0	0	0	115.3	S762	D760-S762 PolarHBondContact O-N 3.26Å
761	G	28.5	Very low	33.7	Very low	84 Å²	84	126.3 Å²	126.3	87%	0.866	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-66.9	117.9	-172.3	0	0	0	0	0	113.9
762	S	31.1	Very low	33.9	Very low	112 Å²	112	124 Å²	124	78%	0.783	77%	0.773	S	S	*	*			trans	-141.9	146.1	157.4	50.1	0	0	0	0	109.1	D760	D760-S762 PolarHBondContact O-N 3.26Å
763	L	29.2	Very low	34	Very low	185 Å²	185	121.3 Å²	121.3	97%	0.969	77%	0.766	S	S	*	*			trans	-85.4	132.4	-173.2	-74.6	71.5	0	0	0	110.7
764	G	27.1	Very low	34.4	Very low	67 Å²	67	114.3 Å²	114.3	69%	0.691	74%	0.738	S	S	*	*			trans	139	114.1	157.5	0	0	0	0	0	117.3
765	V	29.8	Very low	34.4	Very low	111 Å²	111	115 Å²	115	67%	0.673	73%	0.733	S	S	*	*			trans	45.3	95.7	141.9	-169.2	0	0	0	0	118.2	S827	V765-S827 VanDerWaalsContact CG1-O 3.23Å; V765-S827 WeakPolarHBondContact CG1-O 3.28Å
766	A	29.4	Very low	34	Very low	89 Å²	89	113.8 Å²	113.8	74%	0.736	72%	0.715	S	S	*	*			trans	-159.8	65.7	163.5	0	0	0	0	0	115.3	S827	A766-S827 CarbonylContact C-O 3.5Å; A766-S827 VanDerWaalsContact CA-O 3.3Å; A766-S827 WeakPolarHBondContact CA-O 3.25Å; A766-S827 PolarHBondContact N-O 2.78Å
767	N	27.9	Very low	34	Very low	59 Å²	59	104.8 Å²	104.8	32%	0.316	68%	0.679	S	S	.	*			trans	50.1	103.4	144.2	-138.3	30.9	0	0	0	120.1	S827 F828	N767-S827 PolarHBondContact N-O 2.88Å; N767-S827 WeakPolarHBondContact OD1-CA 3.26Å; N767-F828 VanDerWaalsContact CB-O 3.31Å; N767-F828 WeakPolarHBondContact CB-O 3.33Å; N767-F828 VanDerWaalsContact CG-CA 3.43Å; N767-F828 VanDerWaalsContact ND2-C 3.31Å
768	N	33.4	Very low	34.4	Very low	140 Å²	140	103.4 Å²	103.4	75%	0.749	66%	0.664	S	S	*	*				173.8	97.2	124.4	-91.2	-38.1	0	0	0	113.9	T770	N768-T770 PolarHBondContact O-N 3.44Å
769	G	28.7	Very low	34.7	Very low	83 Å²	83	99.2 Å²	99.2	86%	0.856	64%	0.639	S	S	*	*			trans	71.3	-20	139.3	0	0	0	0	0	122	V771	G769-V771 PolarHBondContact O-N 3.01Å
770	T	33.1	Very low	35.1	Very low	133 Å²	133	97.5 Å²	97.5	82%	0.816	63%	0.626	S	S	*	*			trans	-87.8	104.2	-177.3	53.7	0	0	0	0	112.1	N768	N768-T770 PolarHBondContact O-N 3.44Å
771	V	37.6	Very low	35.9	Very low	138 Å²	138	93.8 Å²	93.8	84%	0.836	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-79	129.1	177.5	-178.7	0	0	0	0	110.3	G769	G769-V771 PolarHBondContact O-N 3.01Å
772	L	37.5	Very low	37.2	Very low	114 Å²	114	95.6 Å²	95.6	60%	0.597	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-65.5	141.3	171.2	-83.1	159.3	0	0	0	110.5	D774	L772-D774 PolarHBondContact O-N 3.29Å
773	P	39.3	Very low	38	Very low	116 Å²	116	94.9 Å²	94.9	75%	0.753	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-57.4	121.9	179.6	-24.3	34.2	0	0	0	111.3	H775	P773-H775 PolarHBondContact O-N 3.13Å; P773-H775 VanDerWaalsContact O-N 3.1Å
774	D	47.1	Very low	39.2	Very low	55 Å²	55	89.4 Å²	89.4	29%	0.294	54%	0.541	S	S	.	.			trans	-66.8	114.7	177.9	173.2	20.5	0	0	0	109.6	K384 L772 E776 A777	K384-D774 IonicContact NZ-OD2 2.76Å; K384-D774 PolarHBondContact NZ-OD2 3.48Å; L772-D774 PolarHBondContact O-N 3.29Å; D774-E776 PolarHBondContact O-N 3.49Å; D774-E776 VanDerWaalsContact O-N 3.1Å; D774-A777 WeakPolarHBondContact O-CB 3.21Å; D774-A777 PolarHBondContact O-N 3.07Å
775	H	41.3	Very low	40.9	Very low	99 Å²	99	91 Å²	91	46%	0.458	53%	0.526	S	S	.	.	H	α-helix	trans	-66.2	-20.3	-161.6	-148.5	-44.5	0	0	0	112.6	P773 T820 Q821	P773-H775 PolarHBondContact O-N 3.13Å; P773-H775 VanDerWaalsContact O-N 3.1Å; H775-T820 CarbonylContact C-O 3.59Å; H775-T820 VanDerWaalsContact CB-O 3.26Å; H775-T820 WeakPolarHBondContact CB-O 3.25Å; H775-T820 PolarHBondContact ND1-O 3.25Å; H775-T820 VanDerWaalsContact O-O 3.07Å; H775-Q821 VanDerWaalsContact CB-O 3.27Å; H775-Q821 WeakPolarHBondContact CB-O 3.43Å
776	E	35.7	Very low	42.2	Very low	93 Å²	93	87.7 Å²	87.7	44%	0.435	51%	0.511	S	S	.	.	H	α-helix	trans	-74.6	-25.5	170.6	-65.5	-160.5	149.2	0	0	113.9	D774 A779 A780 T820	D774-E776 PolarHBondContact O-N 3.49Å; D774-E776 VanDerWaalsContact O-N 3.1Å; E776-A779 PolarHBondContact O-N 3.42Å; E776-A780 PolarHBondContact O-N 3.19Å; E776-T820 PolarHBondContact N-O 2.84Å
777	A	37.2	Very low	43.3	Very low	18 Å²	18	85 Å²	85	15%	0.149	49%	0.485	C	S	.	.	H	α-helix	trans	-61.1	-49.5	177.3	0	0	0	0	0	111	K384 D774 A779 A780 E781	K384-A777 HydrophobicContact CD-CB 3.48Å; K384-A777 VanDerWaalsContact CD-CB 3.48Å; D774-A777 WeakPolarHBondContact O-CB 3.21Å; D774-A777 PolarHBondContact O-N 3.07Å; A777-A779 PolarHBondContact O-N 3.21Å; A777-A780 WeakPolarHBondContact O-CA 3.23Å; A777-A780 WeakPolarHBondContact O-CB 3.19Å; A777-A780 PolarHBondContact O-N 3.34Å; A777-E781 PolarHBondContact O-N 2.83Å
778	L	44.5	Very low	45.1	Very low	89 Å²	89	82.2 Å²	82.2	47%	0.466	47%	0.47	S	S	.	.	H	α-helix	trans	-57.1	-36.2	179.7	-160.4	77.6	0	0	0	112.1	Q782	L778-Q782 WeakPolarHBondContact O-CB 3.31Å; L778-Q782 WeakPolarHBondContact O-CG 3.41Å; L778-Q782 PolarHBondContact O-N 2.84Å
779	A	40.8	Very low	46.9	Very low	38 Å²	38	77.7 Å²	77.7	31%	0.314	45%	0.445	S	S	.	.	H	α-helix	trans	-71	-29.5	177.2	0	0	0	0	0	113	E776 A777 K783	E776-A779 PolarHBondContact O-N 3.42Å; A777-A779 PolarHBondContact O-N 3.21Å; A779-K783 WeakPolarHBondContact O-CB 3.41Å; A779-K783 PolarHBondContact O-N 3.44Å
780	A	43.2	Very low	48.4	Very low	62 Å²	62	78.3 Å²	78.3	51%	0.512	43%	0.428	S	S	.	.	H	α-helix	trans	-75.2	-45.5	173.5	0	0	0	0	0	111.6	E776 A777 K783 E784	E776-A780 PolarHBondContact O-N 3.19Å; A777-A780 WeakPolarHBondContact O-CA 3.23Å; A777-A780 WeakPolarHBondContact O-CB 3.19Å; A777-A780 PolarHBondContact O-N 3.34Å; A780-K783 WeakPolarHBondContact O-CB 3.49Å; A780-K783 PolarHBondContact O-N 3.11Å; A780-K783 VanDerWaalsContact O-N 3.15Å; A780-E784 PolarHBondContact O-N 3.16Å
781	E	51	Low	49.9	Very low	85 Å²	85	73.2 Å²	73.2	40%	0.397	40%	0.395	S	S	.	.	H	α-helix	trans	-58	-49.6	176.2	-67.8	169.5	168.1	0	0	111.5	A777 K783 E784 R785	A777-E781 PolarHBondContact O-N 2.83Å; E781-K783 VanDerWaalsContact C-N 3.26Å; E781-K783 PolarHBondContact O-N 3Å; E781-E784 PolarHBondContact O-N 2.85Å; E781-R785 WeakPolarHBondContact O-CB 3.47Å; E781-R785 PolarHBondContact O-N 2.74Å
782	Q	55.2	Low	51.5	Low	121 Å²	121	66.6 Å²	66.6	57%	0.565	36%	0.356	S	S	*	.	H	α-helix	trans	-58.1	-37.9	175.4	-75.1	174.5	6.3	0	0	112.6	L778 A786	L778-Q782 WeakPolarHBondContact O-CB 3.31Å; L778-Q782 WeakPolarHBondContact O-CG 3.41Å; L778-Q782 PolarHBondContact O-N 2.84Å; Q782-A786 WeakPolarHBondContact O-CB 3.41Å; Q782-A786 PolarHBondContact O-N 2.97Å
783	K	49.8	Very low	52.9	Low	97 Å²	97	64.7 Å²	64.7	42%	0.422	34%	0.343	S	S	.	.	H	α-helix	trans	-70.1	-43.3	178.8	-175.2	-171.1	175.4	-135.1	0	111.8	A779 A780 E781 A786 V787	A779-K783 WeakPolarHBondContact O-CB 3.41Å; A779-K783 PolarHBondContact O-N 3.44Å; A780-K783 WeakPolarHBondContact O-CB 3.49Å; A780-K783 PolarHBondContact O-N 3.11Å; A780-K783 VanDerWaalsContact O-N 3.15Å; E781-K783 VanDerWaalsContact C-N 3.26Å; E781-K783 PolarHBondContact O-N 3Å; K783-A786 PolarHBondContact O-N 3.01Å; K783-V787 WeakPolarHBondContact O-CG2 3.42Å; K783-V787 PolarHBondContact O-N 2.94Å
784	E	54.2	Low	54.1	Low	70 Å²	70	65 Å²	65	33%	0.327	34%	0.339	S	S	.	.	H	α-helix	trans	-65.9	-43.5	177.7	-159.6	-129.2	75.9	0	0	111.3	R149 A780 E781 A786 V787 F788	R149-E784 IonicContact CZ-OE1 3.25Å; R149-E784 VanDerWaalsContact CZ-OE1 3.23Å; R149-E784 IonicContact NH1-OE1 3.48Å; R149-E784 PolarHBondContact NH1-OE1 3.01Å; R149-E784 IonicContact NH2-OE1 2.74Å; R149-E784 PolarHBondContact NH2-OE1 3.28Å; A780-E784 PolarHBondContact O-N 3.16Å; E781-E784 PolarHBondContact O-N 2.85Å; E784-A786 VanDerWaalsContact C-N 3.33Å; E784-A786 PolarHBondContact O-N 2.95Å; E784-V787 PolarHBondContact O-N 3.15Å; E784-V787 VanDerWaalsContact O-N 3.1Å; E784-F788 PolarHBondContact O-N 2.8Å
785	R	62.1	Low	55.2	Low	100 Å²	100	64.2 Å²	64.2	38%	0.377	33%	0.334	S	S	.	.	H	α-helix	trans	-52.8	-49.8	170.8	177	-179.7	170.8	166.6	0.7	111.5	F151 N152 E781 V787 F788 E789	F151-R785 HydrophobicContact CE1-CG 4Å; F151-R785 HydrophobicContact CZ-CG 4.25Å; F151-R785 VanDerWaalsContact CZ-CZ 3.46Å; N152-R785 PolarHBondContact ND2-NH2 3.3Å; E781-R785 WeakPolarHBondContact O-CB 3.47Å; E781-R785 PolarHBondContact O-N 2.74Å; R785-V787 VanDerWaalsContact C-N 3.33Å; R785-V787 PolarHBondContact O-N 3.04Å; R785-F788 PolarHBondContact O-N 3Å; R785-E789 HydrophobicContact CG-CG 4.38Å; R785-E789 WeakPolarHBondContact CG-OE1 3.41Å; R785-E789 IonicContact CZ-OE1 2.75Å; R785-E789 IonicContact NE-OE1 3.99Å; R785-E789 PolarHBondContact NE-OE1 3.33Å; R785-E789 IonicContact NH2-OE1 2.69Å; R785-E789 PolarHBondContact NH2-OE1 3.49Å; R785-E789 WeakPolarHBondContact O-CB 3.21Å; R785-E789 VanDerWaalsContact O-CG 3.32Å; R785-E789 WeakPolarHBondContact O-CG 3.1Å; R785-E789 PolarHBondContact O-N 3.25Å
786	A	57.2	Low	56.5	Low	42 Å²	42	59.5 Å²	59.5	35%	0.347	31%	0.312	S	S	.	.	H	α-helix	trans	-62.7	-36.7	177.8	0	0	0	0	0	112.8	Q782 K783 E784 N790	Q782-A786 WeakPolarHBondContact O-CB 3.41Å; Q782-A786 PolarHBondContact O-N 2.97Å; K783-A786 PolarHBondContact O-N 3.01Å; E784-A786 VanDerWaalsContact C-N 3.33Å; E784-A786 PolarHBondContact O-N 2.95Å; A786-N790 WeakPolarHBondContact O-CB 3.13Å; A786-N790 PolarHBondContact O-N 3.46Å; A786-N790 VanDerWaalsContact O-N 3.08Å; A786-N790 PolarHBondContact O-ND2 3.27Å
787	V	53.3	Low	57.8	Low	32 Å²	32	60.6 Å²	60.6	19%	0.194	32%	0.316	C	S	.	.	H	α-helix	trans	-64.5	-45.3	173.8	169.4	0	0	0	0	111	K783 E784 R785 N790 I791	K783-V787 WeakPolarHBondContact O-CG2 3.42Å; K783-V787 PolarHBondContact O-N 2.94Å; E784-V787 PolarHBondContact O-N 3.15Å; E784-V787 VanDerWaalsContact O-N 3.1Å; R785-V787 VanDerWaalsContact C-N 3.33Å; R785-V787 PolarHBondContact O-N 3.04Å; V787-N790 PolarHBondContact O-N 2.73Å; V787-I791 HydrophobicContact CG1-CD1 3.97Å; V787-I791 WeakPolarHBondContact O-CG1 3.31Å; V787-I791 PolarHBondContact O-N 2.91Å
788	F	65.6	Low	58.6	Low	2 Å²	2	64.4 Å²	64.4	1%	0.009	34%	0.337	C	S	.	.	H	α-helix	trans	-62.7	-46.9	177.5	-179	-102	0	0	0	112.4	V119 Y122 V125 R149 E784 R785 N790 I791 I792	V119-F788 HydrophobicContact CG1-CE2 4.47Å; Y122-F788 HydrophobicContact CD2-CD2 4.41Å; Y122-F788 AromaticContact CD2-CE2 3.81Å; Y122-F788 HydrophobicContact CD2-CE2 3.81Å; Y122-F788 HydrophobicContact CE2-CD2 4.12Å; Y122-F788 AromaticContact CE2-CE2 3.93Å; Y122-F788 HydrophobicContact CE2-CE2 3.93Å; V125-F788 HydrophobicContact CG1-CZ 3.76Å; V125-F788 HydrophobicContact CG2-CZ 4.33Å; R149-F788 HydrophobicContact CB-CZ 4.34Å; R149-F788 HydrophobicContact CG-CE1 4.16Å; R149-F788 HydrophobicContact CG-CZ 3.99Å; E784-F788 PolarHBondContact O-N 2.8Å; R785-F788 PolarHBondContact O-N 3Å; F788-N790 VanDerWaalsContact C-N 3.28Å; F788-N790 PolarHBondContact O-N 2.83Å; F788-I791 PolarHBondContact O-N 3.01Å; F788-I792 HydrophobicContact CD1-CG1 4.32Å; F788-I792 HydrophobicContact CE1-CD1 4.28Å; F788-I792 HydrophobicContact CE1-CG1 3.86Å; F788-I792 HydrophobicContact CE2-CD1 4.13Å; F788-I792 HydrophobicContact CE2-CG1 4.37Å; F788-I792 HydrophobicContact CZ-CD1 3.79Å; F788-I792 HydrophobicContact CZ-CG1 3.89Å; F788-I792 PolarHBondContact O-N 2.63Å
789	E	70.5	Confident	58.1	Low	45 Å²	45	64.1 Å²	64.1	21%	0.21	34%	0.342	C	S	.	.	H	α-helix	trans	-58.2	-39.8	176.5	-69.5	-179.4	-178.3	0	0	111.3	F127 R785 I792 H793	F127-E789 HydrophobicContact CE1-CG 4.12Å; F127-E789 HydrophobicContact CZ-CG 3.68Å; R785-E789 HydrophobicContact CG-CG 4.38Å; R785-E789 WeakPolarHBondContact CG-OE1 3.41Å; R785-E789 IonicContact CZ-OE1 2.75Å; R785-E789 IonicContact NE-OE1 3.99Å; R785-E789 PolarHBondContact NE-OE1 3.33Å; R785-E789 IonicContact NH2-OE1 2.69Å; R785-E789 PolarHBondContact NH2-OE1 3.49Å; R785-E789 WeakPolarHBondContact O-CB 3.21Å; R785-E789 VanDerWaalsContact O-CG 3.32Å; R785-E789 WeakPolarHBondContact O-CG 3.1Å; R785-E789 PolarHBondContact O-N 3.25Å; E789-I792 PolarHBondContact O-N 3.18Å; E789-H793 VanDerWaalsContact O-CG 3.3Å; E789-H793 PolarHBondContact O-N 3.43Å
790	N	59.5	Low	57.6	Low	95 Å²	95	67.4 Å²	67.4	51%	0.508	36%	0.363	S	S	.	.	H	α-helix	trans	-66.4	-36.6	173.1	-80.7	-64.8	0	0	0	113.7	A786 V787 F788 H793 N794	A786-N790 WeakPolarHBondContact O-CB 3.13Å; A786-N790 PolarHBondContact O-N 3.46Å; A786-N790 VanDerWaalsContact O-N 3.08Å; A786-N790 PolarHBondContact O-ND2 3.27Å; V787-N790 PolarHBondContact O-N 2.73Å; F788-N790 VanDerWaalsContact C-N 3.28Å; F788-N790 PolarHBondContact O-N 2.83Å; N790-H793 PolarHBondContact O-N 2.91Å; N790-N794 PolarHBondContact O-N 3.28Å; N790-N794 PolarHBondContact O-ND2 3.39Å
791	I	64.7	Low	57	Low	26 Å²	26	74.6 Å²	74.6	13%	0.133	38%	0.377	C	S	.	.	H	α-helix	trans	-64.7	-45.1	175.5	-70.6	166.3	0	0	0	110.4	Y120 V787 F788 H793 N794 I795	Y120-I791 HydrophobicContact CD2-CD1 3.44Å; Y120-I791 VanDerWaalsContact CD2-CD1 3.44Å; Y120-I791 HydrophobicContact CE2-CD1 3.93Å; Y120-I791 HydrophobicContact CG-CD1 3.96Å; V787-I791 HydrophobicContact CG1-CD1 3.97Å; V787-I791 WeakPolarHBondContact O-CG1 3.31Å; V787-I791 PolarHBondContact O-N 2.91Å; F788-I791 PolarHBondContact O-N 3.01Å; I791-H793 VanDerWaalsContact C-N 3.34Å; I791-H793 PolarHBondContact O-N 3.09Å; I791-N794 PolarHBondContact O-N 3.12Å; I791-I795 HydrophobicContact CG2-CD1 3.91Å; I791-I795 WeakPolarHBondContact O-CG1 3.08Å; I791-I795 PolarHBondContact O-N 2.61Å
792	I	71.4	Confident	56.1	Low	0 Å²	0	79.8 Å²	79.8	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-60	-45.8	174	-58.6	-56	0	0	0	110.4	L93 F95 V119 V125 F127 F788 E789 N794 I795 V796	L93-I792 HydrophobicContact CD1-CD1 3.98Å; F95-I792 HydrophobicContact CB-CG2 4.43Å; F95-I792 HydrophobicContact CD1-CG2 4.06Å; F95-I792 HydrophobicContact CD2-CG2 3.89Å; F95-I792 HydrophobicContact CE1-CG2 4.24Å; F95-I792 HydrophobicContact CE2-CG2 4.08Å; F95-I792 HydrophobicContact CG-CG2 3.86Å; F95-I792 HydrophobicContact CZ-CG2 4.23Å; V119-I792 HydrophobicContact CG1-CD1 3.49Å; V119-I792 VanDerWaalsContact CG1-CD1 3.49Å; V125-I792 HydrophobicContact CG1-CD1 4.15Å; F127-I792 HydrophobicContact CD1-CB 4.42Å; F127-I792 HydrophobicContact CD1-CG1 4.16Å; F127-I792 HydrophobicContact CD1-CG2 4.16Å; F788-I792 HydrophobicContact CD1-CG1 4.32Å; F788-I792 HydrophobicContact CE1-CD1 4.28Å; F788-I792 HydrophobicContact CE1-CG1 3.86Å; F788-I792 HydrophobicContact CE2-CD1 4.13Å; F788-I792 HydrophobicContact CE2-CG1 4.37Å; F788-I792 HydrophobicContact CZ-CD1 3.79Å; F788-I792 HydrophobicContact CZ-CG1 3.89Å; F788-I792 PolarHBondContact O-N 2.63Å; E789-I792 PolarHBondContact O-N 3.18Å; I792-N794 VanDerWaalsContact C-N 3.3Å; I792-N794 PolarHBondContact O-N 3.19Å; I792-I795 PolarHBondContact O-N 2.66Å; I792-V796 HydrophobicContact CG2-CG2 3.82Å; I792-V796 VanDerWaalsContact O-CB 3.24Å; I792-V796 WeakPolarHBondContact O-CB 3.29Å; I792-V796 WeakPolarHBondContact O-CG2 3.45Å; I792-V796 PolarHBondContact O-N 3.16Å
793	H	67.3	Low	54.9	Low	73 Å²	73	83.1 Å²	83.1	34%	0.338	41%	0.413	S	S	.	.	H	α-helix	trans	-58.9	-37.3	176.3	-72.4	177.5	0	0	0	113.2	E789 N790 I791 F797	E789-H793 VanDerWaalsContact O-CG 3.3Å; E789-H793 PolarHBondContact O-N 3.43Å; N790-H793 PolarHBondContact O-N 2.91Å; I791-H793 VanDerWaalsContact C-N 3.34Å; I791-H793 PolarHBondContact O-N 3.09Å; H793-F797 HydrophobicContact CB-CD2 4.1Å; H793-F797 AromaticContact CD2-CE2 3.88Å; H793-F797 WeakPolarHBondContact O-CB 3.1Å; H793-F797 WeakPolarHBondContact O-CD2 3.24Å; H793-F797 PolarHBondContact O-N 2.96Å
794	N	64	Low	53.7	Low	124 Å²	124	89.5 Å²	89.5	66%	0.663	44%	0.435	S	S	*	.	H	α-helix	trans	-69.5	-38.8	176.5	-72.9	-34.3	0	0	0	113.1	N790 I791 I792	N790-N794 PolarHBondContact O-N 3.28Å; N790-N794 PolarHBondContact O-ND2 3.39Å; I791-N794 PolarHBondContact O-N 3.12Å; I792-N794 VanDerWaalsContact C-N 3.3Å; I792-N794 PolarHBondContact O-N 3.19Å
795	I	69.9	Low	52.3	Low	37 Å²	37	98.5 Å²	98.5	19%	0.19	47%	0.466	C	S	.	.	H	α-helix	trans	-68.5	-38.5	175.6	-66.7	165.5	0	0	0	110.9	L93 V119 I791 I792 V798	L93-I795 HydrophobicContact CD2-CG2 3.89Å; V119-I795 HydrophobicContact CG1-CD1 3.84Å; V119-I795 HydrophobicContact CG2-CD1 4.27Å; I791-I795 HydrophobicContact CG2-CD1 3.91Å; I791-I795 WeakPolarHBondContact O-CG1 3.08Å; I791-I795 PolarHBondContact O-N 2.61Å; I792-I795 PolarHBondContact O-N 2.66Å; I795-V798 WeakPolarHBondContact O-CG2 3.49Å
796	V	70.3	Confident	50.6	Low	0 Å²	0	98.2 Å²	98.2	0%	0	48%	0.479	C	S	.	.	H	α-helix	trans	-80	-50.3	-175.4	170.6	0	0	0	0	111.3	R34 I65 L66 F95 I792 V798	R34-V796 PolarHBondContact NH1-O 3.01Å; R34-V796 PolarHBondContact NH2-O 3.23Å; I65-V796 HydrophobicContact CB-CG2 4.4Å; I65-V796 HydrophobicContact CD1-CB 4.34Å; I65-V796 HydrophobicContact CD1-CG1 4.3Å; I65-V796 HydrophobicContact CD1-CG2 3.94Å; I65-V796 HydrophobicContact CG2-CG2 4.34Å; L66-V796 HydrophobicContact CD1-CG1 3.49Å; L66-V796 VanDerWaalsContact CD1-CG1 3.49Å; L66-V796 HydrophobicContact CD2-CG1 3.81Å; L66-V796 HydrophobicContact CG-CG1 3.53Å; F95-V796 HydrophobicContact CD1-CB 4.41Å; F95-V796 HydrophobicContact CD1-CG1 4.11Å; F95-V796 HydrophobicContact CD1-CG2 3.62Å; F95-V796 HydrophobicContact CE1-CB 4.44Å; F95-V796 HydrophobicContact CE1-CG1 4.04Å; F95-V796 HydrophobicContact CE1-CG2 4.06Å; F95-V796 HydrophobicContact CG-CG2 4.42Å; I792-V796 HydrophobicContact CG2-CG2 3.82Å; I792-V796 VanDerWaalsContact O-CB 3.24Å; I792-V796 WeakPolarHBondContact O-CB 3.29Å; I792-V796 WeakPolarHBondContact O-CG2 3.45Å; I792-V796 PolarHBondContact O-N 3.16Å; V796-V798 VanDerWaalsContact C-N 3.35Å; V796-V798 PolarHBondContact O-N 3.27Å; V796-V798 VanDerWaalsContact O-N 3.15Å
797	F	61.7	Low	49.2	Very low	116 Å²	116	103.8 Å²	103.8	51%	0.509	50%	0.503	S	S	.	.	S	Bend	trans	-93.5	53.9	-173.2	-60.5	-71.3	0	0	0	113.4	L66 H793 S799	L66-F797 HydrophobicContact CD1-CD1 4.2Å; L66-F797 HydrophobicContact CD1-CE1 3.63Å; L66-F797 HydrophobicContact CD1-CZ 4.19Å; L66-F797 HydrophobicContact CD2-CE1 4.07Å; L66-F797 HydrophobicContact CD2-CZ 3.81Å; L66-F797 HydrophobicContact CG-CE1 4.49Å; H793-F797 HydrophobicContact CB-CD2 4.1Å; H793-F797 AromaticContact CD2-CE2 3.88Å; H793-F797 WeakPolarHBondContact O-CB 3.1Å; H793-F797 WeakPolarHBondContact O-CD2 3.24Å; H793-F797 PolarHBondContact O-N 2.96Å; F797-S799 PolarHBondContact O-N 3.15Å
798	V	55.4	Low	47.9	Very low	98 Å²	98	105.8 Å²	105.8	59%	0.594	53%	0.53	S	S	*	.			trans	-57.7	108	175.9	-175.3	0	0	0	0	111	I795 V796 S800	I795-V798 WeakPolarHBondContact O-CG2 3.49Å; V796-V798 VanDerWaalsContact C-N 3.35Å; V796-V798 PolarHBondContact O-N 3.27Å; V796-V798 VanDerWaalsContact O-N 3.15Å; V798-S800 PolarHBondContact O-N 3.2Å
799	S	32	Very low	46	Very low	83 Å²	83	112.3 Å²	112.3	58%	0.58	57%	0.565	S	S	*	*			trans	-69.4	125.6	177.1	-171.6	0	0	0	0	111.1	F797 R801	F797-S799 PolarHBondContact O-N 3.15Å; S799-R801 PolarHBondContact O-N 2.98Å
800	S	31	Very low	44	Very low	107 Å²	107	116 Å²	116	75%	0.748	59%	0.593	S	S	*	*			trans	-71.4	73.8	178.9	-171.4	0	0	0	0	112.3	V798 H802	V798-S800 PolarHBondContact O-N 3.2Å; S800-H802 VanDerWaalsContact C-N 3.26Å; S800-H802 PolarHBondContact O-N 2.96Å
801	R	30.6	Very low	42.4	Very low	214 Å²	214	115.3 Å²	115.3	81%	0.808	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-78.3	2.3	-174.4	-74.8	-172.6	170	-165	-2.3	115	S799	S799-R801 PolarHBondContact O-N 2.98Å
802	H	31.6	Very low	40.6	Very low	194 Å²	194	121 Å²	121	90%	0.898	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-90.8	15.2	176.1	-77.9	-3.2	0	0	0	115.2	S800	S800-H802 VanDerWaalsContact C-N 3.26Å; S800-H802 PolarHBondContact O-N 2.96Å
803	K	30	Very low	38.5	Very low	190 Å²	190	126.3 Å²	126.3	83%	0.826	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-133.8	11.3	174	-114.1	177	-176.3	177.6	0	117.4
804	R	26.2	Very low	36.4	Very low	232 Å²	232	131.2 Å²	131.2	88%	0.875	68%	0.679	S	S	*	*			trans	-141.6	77.5	172.9	-71.3	-168.5	176.5	169.1	0.3	113.8
805	R	24.3	Very low	34.7	Very low	259 Å²	259	131.6 Å²	131.6	98%	0.977	68%	0.681	S	S	*	*			trans	-83.3	100.9	148.6	-90	-175.4	169.2	176.4	-3	108
806	S	26.8	Very low	32.5	Very low	93 Å²	93	137.1 Å²	137.1	65%	0.65	70%	0.704	S	S	*	*	S	Bend	trans	171.8	132.8	152.6	-175.5	0	0	0	0	110.3
807	N	26.3	Very low	30.3	Very low	160 Å²	160	145.2 Å²	145.2	86%	0.856	74%	0.735	S	S	*	*			trans	46.3	119.9	158.6	-59.3	-5.2	0	0	0	120.5
808	G	26.6	Very low	28.6	Very low	74 Å²	74	145.3 Å²	145.3	76%	0.763	75%	0.745	S	S	*	*			trans	149.4	96.1	158	0	0	0	0	0	115.1	P810	G808-P810 WeakPolarHBondContact O-CD 3.33Å
809	D	26.9	Very low	27.2	Very low	139 Å²	139	144.9 Å²	144.9	74%	0.743	74%	0.742	S	S	*	*			trans	-66.7	137.8	170.1	167.7	46.1	0	0	0	112.4	S811	D809-S811 PolarHBondContact OD1-N 2.75Å
810	P	28.6	Very low	27	Very low	123 Å²	123	144.4 Å²	144.4	80%	0.799	74%	0.736	S	S	*	*			trans	-129.8	98.3	153.2	34.6	-17.6	0	0	0	111.8	G808	G808-P810 WeakPolarHBondContact O-CD 3.33Å
811	S	25.6	Very low	26.7	Very low	79 Å²	79	145.7 Å²	145.7	55%	0.552	73%	0.73	S	S	*	*			trans	-91.2	161.1	172.1	62.7	0	0	0	0	113.6	D809	D809-S811 PolarHBondContact OD1-N 2.75Å
812	N	26.1	Very low	26.4	Very low	146 Å²	146	142.2 Å²	142.2	78%	0.781	72%	0.723	S	S	*	*			trans	87.3	144	160.5	-75.4	-83	0	0	0	122.8
813	V	27.1	Very low	26.3	Very low	112 Å²	112	136.5 Å²	136.5	68%	0.679	70%	0.703	S	S	*	*			trans	72.5	107.5	168.7	-161.4	0	0	0	0	115.7
814	K	24.3	Very low	26.1	Very low	176 Å²	176	132.5 Å²	132.5	77%	0.765	70%	0.699	S	S	*	*			cis	80.9	106.9	36	-68.5	-162.5	170.9	-172.9	0	117.5
815	N	26.6	Very low	26.2	Very low	131 Å²	131	124.9 Å²	124.9	70%	0.701	69%	0.693	S	S	*	*			trans	70.7	151.3	146.7	-49	20.1	0	0	0	115.1
816	K	25.5	Very low	26.3	Very low	154 Å²	154	119.5 Å²	119.5	67%	0.67	68%	0.682	S	S	*	*				-173.2	143.2	57.7	-92.4	-157.8	163.2	-157.4	0	115.5
817	Y	24	Very low	26.4	Very low	170 Å²	170	116.5 Å²	116.5	67%	0.667	66%	0.662	S	S	*	*				83.1	128.5	127.5	-75.7	-141.1	0	0	0	118.8
818	V	24.4	Very low	26.4	Very low	118 Å²	118	116.2 Å²	116.2	72%	0.715	65%	0.653	S	S	*	*				81	102.7	73.6	167.2	0	0	0	0	111.1
819	V	26	Very low	26.4	Very low	88 Å²	88	119.5 Å²	119.5	53%	0.533	65%	0.652	S	S	.	*				85.8	123.1	71	165.2	0	0	0	0	114.8
820	T	28.5	Very low	26.3	Very low	74 Å²	74	116.7 Å²	116.7	45%	0.454	65%	0.648	S	S	.	*			trans	-161.7	126.6	156.5	38.1	0	0	0	0	106.1	H775 E776	H775-T820 CarbonylContact C-O 3.59Å; H775-T820 VanDerWaalsContact CB-O 3.26Å; H775-T820 WeakPolarHBondContact CB-O 3.25Å; H775-T820 PolarHBondContact ND1-O 3.25Å; H775-T820 VanDerWaalsContact O-O 3.07Å; E776-T820 PolarHBondContact N-O 2.84Å
821	Q	25.2	Very low	26.2	Very low	134 Å²	134	118 Å²	118	63%	0.626	65%	0.648	S	S	*	*				82.4	96.2	63	-71.9	-171.2	-50	0	0	118.2	H775	H775-Q821 VanDerWaalsContact CB-O 3.27Å; H775-Q821 WeakPolarHBondContact CB-O 3.43Å
822	E	23.1	Very low	26.3	Very low	141 Å²	141	121.6 Å²	121.6	66%	0.659	66%	0.661	S	S	*	*				38.8	178	121.8	-101.7	-165.7	-179	0	0	123.6
823	P	29.9	Very low	26.3	Very low	74 Å²	74	121.2 Å²	121.2	48%	0.481	66%	0.659	S	S	.	*			cis	-143.3	-176.4	-20.8	35.9	-15.2	0	0	0	117.5
824	S	25.7	Very low	26.3	Very low	106 Å²	106	121 Å²	121	74%	0.741	66%	0.663	S	S	*	*			trans	79.1	156.8	141.3	74.3	0	0	0	0	123.4
825	G	28.5	Very low	26.5	Very low	71 Å²	71	124.5 Å²	124.5	73%	0.732	67%	0.671	S	S	*	*			trans	173.6	-13.9	174.1	0	0	0	0	0	124
826	L	27	Very low	26.5	Very low	146 Å²	146	122.9 Å²	122.9	76%	0.764	67%	0.67	S	S	*	*			trans	5.9	152.4	169.4	-87	168.5	0	0	0	126.8
827	S	27.7	Very low	26.6	Very low	31 Å²	31	124.3 Å²	124.3	22%	0.217	68%	0.676	C	S	.	*			trans	62.2	144.3	135.5	-174.4	0	0	0	0	120.6	V765 A766 N767	V765-S827 VanDerWaalsContact CG1-O 3.23Å; V765-S827 WeakPolarHBondContact CG1-O 3.28Å; A766-S827 CarbonylContact C-O 3.5Å; A766-S827 VanDerWaalsContact CA-O 3.3Å; A766-S827 WeakPolarHBondContact CA-O 3.25Å; A766-S827 PolarHBondContact N-O 2.78Å; N767-S827 PolarHBondContact N-O 2.88Å; N767-S827 WeakPolarHBondContact OD1-CA 3.26Å
828	F	26.2	Very low	26.8	Very low	154 Å²	154	121.6 Å²	121.6	68%	0.675	68%	0.678	S	S	*	*			cis	-151.2	-178.5	-13.4	-107.5	178.8	0	0	0	107.4	N767	N767-F828 VanDerWaalsContact CB-O 3.31Å; N767-F828 WeakPolarHBondContact CB-O 3.33Å; N767-F828 VanDerWaalsContact CG-CA 3.43Å; N767-F828 VanDerWaalsContact ND2-C 3.31Å
829	L	26.7	Very low	26.9	Very low	142 Å²	142	122.2 Å²	122.2	74%	0.743	68%	0.682	S	S	*	*			cis	-153.8	-151.2	8.5	-134.6	172	0	0	0	109.5
830	A	25.7	Very low	27.2	Very low	80 Å²	80	124 Å²	124	66%	0.661	70%	0.698	S	S	*	*			trans	-144.6	179.9	170.9	0	0	0	0	0	110.5
831	L	26.7	Very low	27.3	Very low	152 Å²	152	126.3 Å²	126.3	80%	0.796	72%	0.718	S	S	*	*			trans	-170.5	131.6	153	-107.3	165.7	0	0	0	117.2
832	N	26.8	Very low	27.8	Very low	154 Å²	154	125.5 Å²	125.5	82%	0.824	72%	0.724	S	S	*	*			trans	35	126.7	151.6	-68.5	-2	0	0	0	125
833	N	26.5	Very low	28.3	Very low	137 Å²	137	130 Å²	130	73%	0.733	74%	0.735	S	S	*	*			trans	-108.3	141.9	152.4	168.4	25.2	0	0	0	109.3
834	S	27.1	Very low	28.9	Very low	109 Å²	109	136.7 Å²	136.7	76%	0.762	76%	0.757	S	S	*	*			trans	-178.8	122.8	148	-87.6	0	0	0	0	114
835	R	28.5	Very low	29.9	Very low	248 Å²	248	136.1 Å²	136.1	94%	0.936	76%	0.758	S	S	*	*				-165.8	154.2	122.6	-104.5	164.7	-169.6	-166.5	2	111.8
836	S	27.3	Very low	31.4	Very low	97 Å²	97	135.6 Å²	135.6	68%	0.678	75%	0.747	S	S	*	*			trans	-100.5	-162.6	-166.4	50	0	0	0	0	113
837	F	26.6	Very low	33.5	Very low	184 Å²	184	134.9 Å²	134.9	81%	0.807	75%	0.748	S	S	*	*			trans	94	134.3	174.7	-72	-105.6	0	0	0	116.6
838	T	28.9	Very low	35.9	Very low	113 Å²	113	136.4 Å²	136.4	69%	0.693	76%	0.758	S	S	*	*			cis	-156.9	161.3	-17.9	3.3	0	0	0	0	113
839	T	27	Very low	38.8	Very low	132 Å²	132	132.3 Å²	132.3	81%	0.81	75%	0.745	S	S	*	*			trans	-34.7	152.1	166.7	43.1	0	0	0	0	120.1
840	S	31.8	Very low	41.7	Very low	125 Å²	125	129.7 Å²	129.7	87%	0.874	74%	0.735	S	S	*	*			trans	-144.4	160	139.8	56.6	0	0	0	0	111.4
841	S	30.8	Very low	44.8	Very low	123 Å²	123	128.1 Å²	128.1	86%	0.86	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-80.6	167.3	-152.7	-90	0	0	0	0	118.1
842	P	34.6	Very low	47.9	Very low	117 Å²	117	125.9 Å²	125.9	76%	0.76	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-102.4	173.1	-164.6	40.9	-37.4	0	0	0	115.8
843	R	34.9	Very low	51	Low	234 Å²	234	119.4 Å²	119.4	88%	0.883	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-90.7	154.4	157.1	-70.1	-179.1	174.5	176.3	-1.9	110	A845	R843-A845 PolarHBondContact O-N 2.89Å
844	K	42.1	Very low	54.1	Low	216 Å²	216	118.9 Å²	118.9	94%	0.939	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-57.6	124.8	-173.9	-68.2	178.6	177	178.9	0	111.8
845	A	45.5	Very low	57.1	Low	94 Å²	94	115.2 Å²	115.2	78%	0.777	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-78.6	151.2	173	0	0	0	0	0	111.7	R843	R843-A845 PolarHBondContact O-N 2.89Å
846	A	60.7	Low	60.1	Low	60 Å²	60	105.9 Å²	105.9	50%	0.496	62%	0.623	S	S	.	*	P	Polyproline II helix	trans	-72.7	151.5	168.6	0	0	0	0	0	110.9	V685	V685-A846 HydrophobicContact CG2-CB 3.71Å
847	V	71.2	Confident	63.2	Low	131 Å²	131	106 Å²	106	79%	0.794	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-83.2	127.5	179.1	-179.1	0	0	0	0	109.2
848	P	79.1	Confident	66.4	Low	63 Å²	63	99.7 Å²	99.7	41%	0.409	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-74.5	142.4	177	30.1	-34.5	0	0	0	112	Y684 V685	Y684-P848 CarbonylContact O-C 3.57Å; Y684-P848 VanDerWaalsContact O-CA 3.25Å; Y684-P848 WeakPolarHBondContact O-CA 3.5Å; V685-P848 HydrophobicContact CB-CB 4.18Å
849	V	86.3	Confident	69.5	Low	68 Å²	68	97.2 Å²	97.2	41%	0.412	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89	136.4	171.1	-179.5	0	0	0	0	108.8	S683 Y684	S683-V849 CarbonylContact C-O 3.58Å; S683-V849 WeakPolarHBondContact CA-O 3.47Å; Y684-V849 HydrophobicContact CD1-CB 4.14Å; Y684-V849 HydrophobicContact CD2-CB 4.45Å; Y684-V849 HydrophobicContact CE1-CB 3.71Å; Y684-V849 HydrophobicContact CE1-CG1 3.71Å; Y684-V849 HydrophobicContact CE2-CB 4.06Å; Y684-V849 HydrophobicContact CE2-CG2 4.15Å; Y684-V849 HydrophobicContact CG-CB 4.49Å; Y684-V849 PolarHBondContact N-O 2.85Å; Y684-V849 PolarHBondContact O-N 2.81Å
850	V	88.4	Confident	72.6	Confident	86 Å²	86	91 Å²	91	52%	0.521	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	137.5	-175.9	-170.3	0	0	0	0	111.4	V682	V682-V850 CarbonylContact O-C 3.3Å; V682-V850 WeakPolarHBondContact O-CA 3.43Å
851	V	90.9	Very high	75.4	Confident	48 Å²	48	90.8 Å²	90.8	29%	0.291	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	136.6	-175.9	-175.1	0	0	0	0	110.6	V682 V853 F858	V682-V851 PolarHBondContact N-O 3.24Å; V682-V851 PolarHBondContact O-N 2.82Å; V851-V853 HydrophobicContact CG1-CG2 4.3Å; V851-F858 HydrophobicContact CB-CE2 4.47Å; V851-F858 HydrophobicContact CB-CZ 4.2Å; V851-F858 HydrophobicContact CG1-CE2 3.97Å; V851-F858 HydrophobicContact CG1-CZ 4.14Å; V851-F858 HydrophobicContact CG2-CZ 3.99Å
852	N	91.5	Very high	78.2	Confident	104 Å²	104	92.2 Å²	92.2	56%	0.556	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	136.6	171.4	-72.5	15.6	0	0	0	110.6	Y680	Y680-N852 WeakPolarHBondContact O-CA 3.4Å
853	V	91	Very high	80.9	Confident	18 Å²	18	87.4 Å²	87.4	11%	0.109	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	130.7	-174	-170.8	0	0	0	0	109.7	W667 Y680 V682 V851 G855 F858	W667-V853 HydrophobicContact CH2-CB 4.41Å; W667-V853 HydrophobicContact CH2-CG1 4.16Å; W667-V853 HydrophobicContact CZ2-CB 4.34Å; W667-V853 HydrophobicContact CZ2-CG1 4.2Å; Y680-V853 WeakPolarHBondContact CD2-O 3.42Å; Y680-V853 PolarHBondContact N-O 3.31Å; Y680-V853 PolarHBondContact O-N 2.8Å; V682-V853 HydrophobicContact CG2-CG2 3.84Å; V851-V853 HydrophobicContact CG1-CG2 4.3Å; V853-G855 WeakPolarHBondContact CG1-O 3.48Å; V853-F858 HydrophobicContact CG2-CD2 3.99Å; V853-F858 HydrophobicContact CG2-CG 4.43Å
854	T	91.3	Very high	83.4	Confident	126 Å²	126	83 Å²	83	77%	0.773	47%	0.47	S	S	*	.	S	Bend	trans	-94.2	-28.7	176.5	49.8	0	0	0	0	113.2
855	G	90.1	Very high	85.7	Confident	32 Å²	32	74.4 Å²	74.4	33%	0.33	43%	0.433	S	S	.	.	S	Bend	trans	-78.9	-178.1	169.1	0	0	0	0	0	112.9	Y680 V853	Y680-G855 VanDerWaalsContact CD2-O 3.25Å; Y680-G855 WeakPolarHBondContact CD2-O 3.28Å; V853-G855 WeakPolarHBondContact CG1-O 3.48Å
856	T	92.3	Very high	87.7	Confident	52 Å²	52	71.7 Å²	71.7	32%	0.319	40%	0.404	S	S	.	.	S	Bend	trans	-111	29.2	179.9	68.4	0	0	0	0	113.7	R666 W667 Y680	R666-T856 CarbonylContact C-O 3.21Å; R666-T856 WeakPolarHBondContact CA-O 3.23Å; W667-T856 PolarHBondContact N-O 2.87Å; W667-T856 WeakPolarHBondContact O-CB 3.29Å; W667-T856 PolarHBondContact O-OG1 2.96Å; Y680-T856 HydrophobicContact CE2-CG2 3.83Å
857	N	92.5	Very high	88.9	Confident	100 Å²	100	69 Å²	69	54%	0.535	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	152	176.8	59.4	-8.3	0	0	0	112	I665 R666	I665-N857 VanDerWaalsContact O-CA 3.29Å; I665-N857 WeakPolarHBondContact O-CA 3.33Å; R666-N857 HydrophobicContact CG-CB 4.18Å
858	F	93.6	Very high	89.5	Confident	51 Å²	51	64.6 Å²	64.6	22%	0.224	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	154.4	178.5	-167.9	-111.2	0	0	0	111.5	I665 W667 V682 V851 V853 L860	I665-F858 PolarHBondContact N-O 3.29Å; I665-F858 PolarHBondContact O-N 2.91Å; W667-F858 HydrophobicContact CH2-CB 3.94Å; W667-F858 HydrophobicContact CZ3-CB 3.94Å; V682-F858 HydrophobicContact CG1-CD1 4.05Å; V682-F858 HydrophobicContact CG1-CE1 4.49Å; V851-F858 HydrophobicContact CB-CE2 4.47Å; V851-F858 HydrophobicContact CB-CZ 4.2Å; V851-F858 HydrophobicContact CG1-CE2 3.97Å; V851-F858 HydrophobicContact CG1-CZ 4.14Å; V851-F858 HydrophobicContact CG2-CZ 3.99Å; V853-F858 HydrophobicContact CG2-CD2 3.99Å; V853-F858 HydrophobicContact CG2-CG 4.43Å; F858-L860 HydrophobicContact CD1-CD1 3.8Å; F858-L860 HydrophobicContact CE1-CD1 4.12Å; F858-L860 HydrophobicContact CE1-CG 4.36Å
859	T	93.3	Very high	90	Very high	62 Å²	62	62.3 Å²	62.3	38%	0.38	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	138.8	178.2	-61.4	0	0	0	0	110.6	T664 E861	T664-T859 PolarHBondContact OG1-OG1 2.83Å; T859-E861 HydrophobicContact CG2-CG 4.42Å
860	L	92.6	Very high	90.2	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.005	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	137.6	178.8	-67.7	74.1	0	0	0	109	T662 I663 I665 Y684 F858 L863 I871	T662-L860 VanDerWaalsContact CA-O 3.31Å; T662-L860 WeakPolarHBondContact CA-O 3.45Å; I663-L860 HydrophobicContact CB-CB 4.42Å; I663-L860 PolarHBondContact N-O 3.28Å; I663-L860 PolarHBondContact O-N 2.79Å; I665-L860 HydrophobicContact CD1-CD1 3.7Å; I665-L860 HydrophobicContact CG1-CD1 4.15Å; Y684-L860 HydrophobicContact CD1-CD2 3.78Å; Y684-L860 HydrophobicContact CD1-CG 4.1Å; Y684-L860 HydrophobicContact CD2-CD2 3.69Å; Y684-L860 HydrophobicContact CE1-CD2 4.29Å; Y684-L860 HydrophobicContact CE1-CG 4.22Å; Y684-L860 HydrophobicContact CE2-CD2 4.21Å; Y684-L860 HydrophobicContact CG-CD2 3.45Å; Y684-L860 VanDerWaalsContact CG-CD2 3.45Å; Y684-L860 HydrophobicContact CG-CG 4.25Å; F858-L860 HydrophobicContact CD1-CD1 3.8Å; F858-L860 HydrophobicContact CE1-CD1 4.12Å; F858-L860 HydrophobicContact CE1-CG 4.36Å; L860-L863 HydrophobicContact CB-CD1 4.29Å; L860-I871 HydrophobicContact CD2-CD1 4.37Å; L860-I871 HydrophobicContact CD2-CG1 3.66Å
861	E	90.4	Very high	90.3	Very high	121 Å²	121	56.2 Å²	56.2	57%	0.565	30%	0.297	S	S	*	.			trans	-131.4	166	-174	-59.9	-179	170.9	0	0	111	T859	T859-E861 HydrophobicContact CG2-CG 4.42Å
862	N	89.4	Confident	90.4	Very high	152 Å²	152	56.5 Å²	56.5	81%	0.813	29%	0.294	S	S	*	.	S	Bend	trans	62.3	39.3	177.1	-53.7	-72.4	0	0	0	114.7	S661	S661-N862 PolarHBondContact O-N 3.32Å; S661-N862 VanDerWaalsContact O-N 3.16Å
863	L	91	Very high	90.4	Very high	16 Å²	16	51.5 Å²	51.5	8%	0.084	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-88.2	160.2	178.2	-50	179.7	0	0	0	112.1	S661 I663 L860 Y869 T897	S661-L863 WeakPolarHBondContact CA-O 3.22Å; S661-L863 VanDerWaalsContact CB-O 3.26Å; S661-L863 WeakPolarHBondContact CB-O 3.38Å; S661-L863 PolarHBondContact O-N 2.74Å; I663-L863 HydrophobicContact CB-CD1 4.05Å; I663-L863 HydrophobicContact CD1-CD1 3.64Å; I663-L863 HydrophobicContact CG1-CD1 3.62Å; L860-L863 HydrophobicContact CB-CD1 4.29Å; L863-Y869 HydrophobicContact CB-CD2 4.38Å; L863-Y869 HydrophobicContact CB-CE2 3.68Å; L863-Y869 HydrophobicContact CD1-CD2 4.19Å; L863-Y869 HydrophobicContact CD1-CE2 4.31Å; L863-Y869 HydrophobicContact CD2-CD1 4.11Å; L863-Y869 HydrophobicContact CD2-CD2 4.43Å; L863-Y869 HydrophobicContact CD2-CE1 3.8Å; L863-Y869 HydrophobicContact CD2-CE2 4.14Å; L863-Y869 HydrophobicContact CD2-CG 4.42Å; L863-Y869 HydrophobicContact CG-CE2 4.25Å; L863-T897 HydrophobicContact CB-CG2 3.75Å; L863-T897 HydrophobicContact CD1-CG2 4.03Å
864	R	89.2	Confident	90.6	Very high	143 Å²	143	53.1 Å²	53.1	54%	0.54	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-80.9	152.8	175	-68.8	-158.3	-86.5	-176.1	-8.5	112.2	A660 E686 T867 Y869 T897	A660-R864 CarbonylContact O-C 3.32Å; E686-R864 IonicContact OE1-CZ 2.74Å; E686-R864 IonicContact OE1-NE 3.79Å; E686-R864 IonicContact OE1-NH2 2.9Å; E686-R864 PolarHBondContact OE1-NH2 2.99Å; E686-R864 IonicContact OE2-CZ 3.64Å; E686-R864 VanDerWaalsContact OE2-CZ 3.29Å; E686-R864 IonicContact OE2-NE 2.86Å; E686-R864 PolarHBondContact OE2-NE 2.97Å; E686-R864 IonicContact OE2-NH2 3.96Å; E686-R864 PolarHBondContact OE2-NH2 2.91Å; R864-T867 HydrophobicContact CB-CG2 4.2Å; R864-Y869 PolarHBondContact N-OH 2.04Å; R864-T897 WeakPolarHBondContact O-CB 3.25Å; R864-T897 WeakPolarHBondContact O-CG2 3.5Å; R864-T897 PolarHBondContact O-OG1 2.81Å
865	H	89	Confident	90.6	Very high	35 Å²	35	47.1 Å²	47.1	16%	0.162	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	151.5	175.8	76.3	82.7	0	0	0	112.8	A660 T867 V900 D932	A660-H865 HydrophobicContact CB-CB 4.02Å; A660-H865 WeakPolarHBondContact O-CA 3.32Å; A660-H865 PolarHBondContact O-N 3.41Å; H865-T867 WeakPolarHBondContact O-CB 3.42Å; H865-T867 PolarHBondContact O-N 2.92Å; H865-T867 PolarHBondContact O-OG1 2.81Å; H865-V900 HydrophobicContact CB-CG2 4.1Å; H865-D932 IonicContact CD2-OD2 3.44Å; H865-D932 IonicContact CE1-OD1 3.72Å; H865-D932 IonicContact CE1-OD2 3Å; H865-D932 IonicContact NE2-OD1 2.75Å; H865-D932 PolarHBondContact NE2-OD1 2.87Å; H865-D932 IonicContact NE2-OD2 3.6Å; H865-D932 PolarHBondContact NE2-OD2 2.92Å
866	F	87.5	Confident	90.7	Very high	37 Å²	37	45.6 Å²	45.6	16%	0.162	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	30.2	50.2	-173.6	-154.8	-108.4	0	0	0	114.8	T897 L898 P899 N934 L989 A990	F866-T897 PolarHBondContact N-OG1 3.11Å; F866-L898 PolarHBondContact N-O 3.1Å; F866-P899 HydrophobicContact CB-CB 4.11Å; F866-P899 HydrophobicContact CD2-CB 3.71Å; F866-P899 HydrophobicContact CD2-CG 4.08Å; F866-P899 HydrophobicContact CE2-CB 4.46Å; F866-P899 HydrophobicContact CG-CB 4.14Å; F866-N934 HydrophobicContact CB-CB 4.15Å; F866-N934 HydrophobicContact CD1-CB 4.32Å; F866-N934 HydrophobicContact CG-CB 4.28Å; F866-L989 HydrophobicContact CE1-CB 4.3Å; F866-A990 HydrophobicContact CD1-CB 3.87Å; F866-A990 HydrophobicContact CD2-CB 4.03Å; F866-A990 HydrophobicContact CE1-CB 3.61Å; F866-A990 HydrophobicContact CE2-CB 3.78Å; F866-A990 HydrophobicContact CG-CB 4.06Å; F866-A990 HydrophobicContact CZ-CB 3.55Å
867	T	85.8	Confident	90.5	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.012	20%	0.204	C	C	.	.			trans	-130.2	135.8	-171.5	-67.1	0	0	0	0	110.5	E686 R689 R864 H865 Y869 S896 T897	E686-T867 VanDerWaalsContact CD-CG2 3.46Å; E686-T867 HydrophobicContact CG-CG2 3.47Å; E686-T867 VanDerWaalsContact CG-CG2 3.47Å; R689-T867 PolarHBondContact NH2-OG1 2.88Å; R864-T867 HydrophobicContact CB-CG2 4.2Å; H865-T867 WeakPolarHBondContact O-CB 3.42Å; H865-T867 PolarHBondContact O-N 2.92Å; H865-T867 PolarHBondContact O-OG1 2.81Å; T867-Y869 HydrophobicContact CG2-CE2 3.83Å; T867-Y869 WeakPolarHBondContact O-CD2 3.46Å; T867-S896 WeakPolarHBondContact O-CA 3.42Å; T867-T897 PolarHBondContact N-OG1 3.12Å; T867-T897 PolarHBondContact O-N 3.03Å; T867-T897 VanDerWaalsContact O-N 3.16Å; T867-T897 PolarHBondContact O-OG1 2.85Å
868	M	85	Confident	90.1	Very high	40 Å²	40	43 Å²	43	20%	0.197	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	130	-172.3	-167.6	61.5	150.4	0	0	111	E687 L711 L894 S896	E687-M868 HydrophobicContact CB-CB 4.34Å; E687-M868 HydrophobicContact CB-CG 4.31Å; E687-M868 PolarHBondContact N-O 3.4Å; L711-M868 HydrophobicContact CD1-CE 3.92Å; M868-L894 HydrophobicContact CE-CB 3.7Å; M868-L894 HydrophobicContact CE-CD2 4.24Å; M868-L894 HydrophobicContact CE-CG 4.4Å; M868-L894 HydrophobicContact CG-CD2 4.29Å; M868-S896 PolarHBondContact SD-N 3.01Å; M868-S896 VanDerWaalsContact SD-N 3.39Å; M868-S896 PolarHBondContact SD-OG 2.95Å
869	Y	89.2	Confident	89.1	Confident	15 Å²	15	47.8 Å²	47.8	6%	0.059	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	136.1	176.6	-71.7	-90.9	0	0	0	111.2	I663 V685 E686 L863 R864 T867 L894 K895 T897	I663-Y869 HydrophobicContact CD1-CD2 4.34Å; V685-Y869 WeakPolarHBondContact O-CA 3.31Å; E686-Y869 HydrophobicContact CB-CD1 4.04Å; E686-Y869 HydrophobicContact CB-CE1 3.66Å; E686-Y869 HydrophobicContact CG-CD1 4.28Å; E686-Y869 HydrophobicContact CG-CE1 3.78Å; E686-Y869 HydrophobicContact CG-CE2 4.47Å; E686-Y869 PolarHBondContact OE2-OH 3.36Å; L863-Y869 HydrophobicContact CB-CD2 4.38Å; L863-Y869 HydrophobicContact CB-CE2 3.68Å; L863-Y869 HydrophobicContact CD1-CD2 4.19Å; L863-Y869 HydrophobicContact CD1-CE2 4.31Å; L863-Y869 HydrophobicContact CD2-CD1 4.11Å; L863-Y869 HydrophobicContact CD2-CD2 4.43Å; L863-Y869 HydrophobicContact CD2-CE1 3.8Å; L863-Y869 HydrophobicContact CD2-CE2 4.14Å; L863-Y869 HydrophobicContact CD2-CG 4.42Å; L863-Y869 HydrophobicContact CG-CE2 4.25Å; R864-Y869 PolarHBondContact N-OH 2.04Å; T867-Y869 HydrophobicContact CG2-CE2 3.83Å; T867-Y869 WeakPolarHBondContact O-CD2 3.46Å; Y869-L894 WeakPolarHBondContact O-CA 3.49Å; Y869-K895 PolarHBondContact N-O 2.71Å; Y869-K895 PolarHBondContact O-N 3.36Å; Y869-K895 VanDerWaalsContact O-N 3.14Å; Y869-T897 HydrophobicContact CE2-CG2 4.4Å
870	E	89.3	Confident	88.2	Confident	25 Å²	25	49 Å²	49	12%	0.117	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	126.3	167.4	171.6	174.8	-173.8	0	0	109	Y684 V685 K872 R892 I893 L894	Y684-E870 CarbonylContact C-O 3.58Å; Y684-E870 WeakPolarHBondContact CA-O 3.5Å; V685-E870 HydrophobicContact CG1-CB 3.97Å; V685-E870 HydrophobicContact CG1-CG 4.37Å; V685-E870 PolarHBondContact N-O 2.77Å; V685-E870 PolarHBondContact O-N 2.79Å; E870-K872 HydrophobicContact CG-CG 4.44Å; E870-K872 WeakPolarHBondContact OE1-CE 3.42Å; E870-K872 IonicContact OE1-NZ 2.61Å; E870-R892 HydrophobicContact CG-CG 4.12Å; E870-R892 IonicContact OE1-CZ 2.66Å; E870-R892 IonicContact OE1-NE 2.75Å; E870-R892 PolarHBondContact OE1-NE 2.73Å; E870-R892 IonicContact OE1-NH2 2.78Å; E870-R892 IonicContact OE2-CZ 3.01Å; E870-R892 IonicContact OE2-NE 3.57Å; E870-R892 PolarHBondContact OE2-NE 3.42Å; E870-R892 IonicContact OE2-NH2 2.71Å; E870-R892 PolarHBondContact OE2-NH2 3.38Å; E870-I893 CarbonylContact C-O 3.17Å; E870-I893 WeakPolarHBondContact CA-O 3.33Å; E870-L894 HydrophobicContact CB-CD2 4.06Å
871	I	91.4	Very high	87.2	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	145.8	168.7	-47	93	0	0	0	109.1	I665 V682 S683 L860 R892 I893	I665-I871 HydrophobicContact CD1-CB 4.06Å; I665-I871 HydrophobicContact CD1-CD1 4.26Å; I665-I871 HydrophobicContact CD1-CG1 4Å; I665-I871 HydrophobicContact CD1-CG2 3.72Å; V682-I871 HydrophobicContact CG1-CG2 3.76Å; S683-I871 CarbonylContact O-C 3.57Å; S683-I871 VanDerWaalsContact O-CA 3.27Å; S683-I871 WeakPolarHBondContact O-CA 3.33Å; S683-I871 WeakPolarHBondContact O-CG2 3.4Å; L860-I871 HydrophobicContact CD2-CD1 4.37Å; L860-I871 HydrophobicContact CD2-CG1 3.66Å; I871-R892 CarbonylContact O-C 3.34Å; I871-I893 HydrophobicContact CB-CB 3.98Å; I871-I893 HydrophobicContact CB-CD1 4.4Å; I871-I893 HydrophobicContact CB-CG2 4.31Å; I871-I893 HydrophobicContact CD1-CB 4.35Å; I871-I893 HydrophobicContact CD1-CG2 3.82Å; I871-I893 PolarHBondContact N-O 3.44Å; I871-I893 WeakPolarHBondContact O-CB 3.42Å; I871-I893 PolarHBondContact O-N 2.84Å
872	K	92.2	Very high	86	Confident	54 Å²	54	50.7 Å²	50.7	24%	0.235	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	140.5	178.6	-63.8	-173.2	172.6	-156.1	0	110.6	V682 S683 E870 W874 E890 V891	V682-K872 CarbonylContact C-O 3.59Å; V682-K872 WeakPolarHBondContact CA-O 3.34Å; S683-K872 PolarHBondContact N-O 2.95Å; S683-K872 PolarHBondContact O-N 3.04Å; E870-K872 HydrophobicContact CG-CG 4.44Å; E870-K872 WeakPolarHBondContact OE1-CE 3.42Å; E870-K872 IonicContact OE1-NZ 2.61Å; K872-W874 HydrophobicContact CB-CE3 4.49Å; K872-W874 HydrophobicContact CB-CH2 3.59Å; K872-W874 HydrophobicContact CB-CZ2 4.36Å; K872-W874 HydrophobicContact CB-CZ3 3.67Å; K872-W874 HydrophobicContact CD-CH2 3.74Å; K872-W874 HydrophobicContact CD-CZ2 4.18Å; K872-W874 HydrophobicContact CG-CH2 4.34Å; K872-E890 HydrophobicContact CB-CB 4.05Å; K872-E890 HydrophobicContact CB-CG 4.23Å; K872-E890 HydrophobicContact CD-CG 3.96Å; K872-E890 WeakPolarHBondContact CD-OE1 3.42Å; K872-E890 WeakPolarHBondContact CE-OE1 3.41Å; K872-E890 HydrophobicContact CG-CB 4.47Å; K872-E890 HydrophobicContact CG-CG 4.1Å; K872-E890 IonicContact NZ-OE1 3.64Å; K872-E890 PolarHBondContact NZ-OE1 2.8Å; K872-V891 CarbonylContact C-O 3.47Å; K872-V891 VanDerWaalsContact CA-O 3.29Å; K872-V891 WeakPolarHBondContact CA-O 3.28Å
873	I	93	Very high	85.1	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	132	177.7	-48.2	-177.7	0	0	0	111.8	V650 V652 I665 W667 M681 V682 E890 V891 I893	V650-I873 HydrophobicContact CG2-CB 4.13Å; V650-I873 HydrophobicContact CG2-CG2 3.86Å; V652-I873 HydrophobicContact CG2-CD1 4.4Å; I665-I873 HydrophobicContact CG2-CD1 4.05Å; W667-I873 HydrophobicContact CD2-CD1 4.14Å; W667-I873 HydrophobicContact CE3-CD1 3.74Å; W667-I873 HydrophobicContact CZ3-CD1 3.97Å; M681-I873 CarbonylContact O-C 3.56Å; M681-I873 VanDerWaalsContact O-CA 3.28Å; M681-I873 WeakPolarHBondContact O-CA 3.27Å; V682-I873 HydrophobicContact CG1-CG1 4.49Å; V682-I873 HydrophobicContact CG2-CG1 4.29Å; V682-I873 HydrophobicContact CG2-CG2 4.35Å; I873-E890 CarbonylContact O-C 3.59Å; I873-E890 VanDerWaalsContact O-CA 3.24Å; I873-E890 WeakPolarHBondContact O-CA 3.38Å; I873-V891 PolarHBondContact N-O 3.15Å; I873-V891 PolarHBondContact O-N 2.85Å; I873-I893 HydrophobicContact CD1-CD1 3.72Å; I873-I893 HydrophobicContact CG1-CD1 4.09Å
874	W	93.6	Very high	84.5	Confident	52 Å²	52	51.6 Å²	51.6	20%	0.197	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	154.8	171.2	-61	-99.4	0	0	0	111.1	Y680 M681 K872 E890	Y680-W874 WeakPolarHBondContact CA-O 3.39Å; Y680-W874 WeakPolarHBondContact CB-O 3.46Å; M681-W874 HydrophobicContact CB-CB 4.44Å; M681-W874 HydrophobicContact CB-CE3 4.07Å; M681-W874 HydrophobicContact CE-CB 3.99Å; M681-W874 HydrophobicContact CE-CD2 4.19Å; M681-W874 HydrophobicContact CE-CE3 4.37Å; M681-W874 HydrophobicContact CE-CG 4.06Å; M681-W874 PolarHBondContact N-O 3.42Å; M681-W874 PolarHBondContact O-N 3.33Å; K872-W874 HydrophobicContact CB-CE3 4.49Å; K872-W874 HydrophobicContact CB-CH2 3.59Å; K872-W874 HydrophobicContact CB-CZ2 4.36Å; K872-W874 HydrophobicContact CB-CZ3 3.67Å; K872-W874 HydrophobicContact CD-CH2 3.74Å; K872-W874 HydrophobicContact CD-CZ2 4.18Å; K872-W874 HydrophobicContact CG-CH2 4.34Å; W874-E890 HydrophobicContact CD2-CB 4.08Å; W874-E890 HydrophobicContact CG-CB 4.5Å; W874-E890 HydrophobicContact CH2-CB 4.41Å; W874-E890 HydrophobicContact CZ2-CB 3.82Å; W874-E890 HydrophobicContact CZ2-CG 4.35Å
875	A	92.4	Very high	84.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	139.6	167.5	0	0	0	0	0	110.4	V650 P670 V677 Y680 C886 S887	V650-A875 HydrophobicContact CG1-CB 3.97Å; P670-A875 HydrophobicContact CG-CB 3.45Å; P670-A875 VanDerWaalsContact CG-CB 3.45Å; V677-A875 HydrophobicContact CG1-CB 4.37Å; Y680-A875 HydrophobicContact CD1-CB 3.79Å; Y680-A875 HydrophobicContact CE1-CB 3.81Å; A875-C886 CarbonylContact O-C 3.59Å; A875-C886 VanDerWaalsContact O-CA 3.25Å; A875-C886 WeakPolarHBondContact O-CA 3.23Å; A875-S887 PolarHBondContact N-OG 2.87Å; A875-S887 PolarHBondContact O-N 3.48Å
876	C	91.9	Very high	84.4	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	149.4	-170.1	-58.6	0	0	0	0	113.4	T678 H679 F885 C886	T678-C876 PolarHBondContact N-O 2.89Å; T678-C876 PolarHBondContact OG1-O 2.88Å; H679-C876 VanDerWaalsContact CE1-CB 3.49Å; H679-C876 WeakPolarHBondContact CE1-CB 3.13Å; H679-C876 PolarHBondContact N-O 2.82Å; H679-C876 PolarHBondContact O-N 3.05Å; C876-F885 CarbonylContact C-O 3.5Å; C876-F885 VanDerWaalsContact CA-O 3.26Å; C876-F885 WeakPolarHBondContact CA-O 3.27Å; C876-F885 HydrophobicContact CB-CE2 4.28Å; C876-F885 HydrophobicContact CB-CZ 4.3Å; C876-C886 HydrophobicContact CB-CB 4.1Å; C876-C886 WeakPolarHBondContact CB-SG 3.31Å; C876-C886 WeakPolarHBondContact SG-CB 3.46Å; C876-C886 CovalentContact SG-SG 2.04Å; C876-C886 PolarHBondContact SG-SG 3.06Å
877	Q	88.7	Confident	84.4	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.232	C	C	.	.			trans	-94.9	-155.7	179.5	-57.5	-173.9	-8.5	0	0	111	G645 P647 P673 E676 T678 I881 F885	G645-Q877 PolarHBondContact O-NE2 3.43Å; P647-Q877 HydrophobicContact CG-CG 3.62Å; P673-Q877 PolarHBondContact O-NE2 2.94Å; E676-Q877 VanDerWaalsContact O-CA 3.25Å; E676-Q877 WeakPolarHBondContact O-CA 3.45Å; E676-Q877 VanDerWaalsContact O-CB 3.24Å; E676-Q877 WeakPolarHBondContact O-CB 3.18Å; E676-Q877 WeakPolarHBondContact O-CG 3.34Å; T678-Q877 PolarHBondContact OG1-O 2.84Å; Q877-I881 HydrophobicContact CB-CD1 4.16Å; Q877-I881 VanDerWaalsContact OE1-CD1 3.3Å; Q877-F885 PolarHBondContact N-O 2.65Å; Q877-F885 WeakPolarHBondContact O-CE2 3.28Å
878	N	84	Confident	84.1	Confident	97 Å²	97	52.5 Å²	52.5	52%	0.519	27%	0.265	S	S	.	.			trans	-77.6	140.5	172.2	-168.3	-4.2	0	0	0	110.8	T678 S880 I881	T678-N878 HydrophobicContact CG2-CB 4.42Å; N878-S880 PolarHBondContact ND2-OG 3Å; N878-S880 PolarHBondContact O-N 2.84Å; N878-S880 VanDerWaalsContact O-N 3.12Å; N878-I881 WeakPolarHBondContact O-CB 3.06Å; N878-I881 PolarHBondContact O-N 2.92Å
879	Q	72.4	Confident	84	Confident	152 Å²	152	59.1 Å²	59.1	71%	0.71	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-9.8	-174.7	-159.6	172.7	11.6	0	0	113.9	I881 F885	Q879-I881 PolarHBondContact O-N 3.05Å; Q879-F885 VanDerWaalsContact CA-CE2 3.47Å; Q879-F885 HydrophobicContact CB-CD2 4.38Å; Q879-F885 HydrophobicContact CB-CE2 3.77Å; Q879-F885 HydrophobicContact CB-CZ 4.1Å; Q879-F885 HydrophobicContact CG-CE1 4.45Å; Q879-F885 HydrophobicContact CG-CE2 4.06Å; Q879-F885 HydrophobicContact CG-CZ 3.99Å
880	S	74.5	Confident	83.8	Confident	86 Å²	86	61.4 Å²	61.4	60%	0.601	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-16.1	167	57.4	0	0	0	0	114	N878 T882	N878-S880 PolarHBondContact ND2-OG 3Å; N878-S880 PolarHBondContact O-N 2.84Å; N878-S880 VanDerWaalsContact O-N 3.12Å; S880-T882 PolarHBondContact O-N 3.45Å
881	I	70.9	Confident	83.7	Confident	32 Å²	32	60.9 Å²	60.9	16%	0.164	30%	0.297	C	S	.	.			trans	-94.9	79.4	-178.5	-53.6	176.2	0	0	0	108.6	F644 Q877 N878 Q879 E883 N884 F885	F644-I881 HydrophobicContact CB-CD1 4.46Å; F644-I881 HydrophobicContact CB-CG2 4.41Å; F644-I881 HydrophobicContact CD1-CD1 3.58Å; F644-I881 HydrophobicContact CE1-CD1 3.95Å; F644-I881 HydrophobicContact CG-CD1 4.05Å; Q877-I881 HydrophobicContact CB-CD1 4.16Å; Q877-I881 VanDerWaalsContact OE1-CD1 3.3Å; N878-I881 WeakPolarHBondContact O-CB 3.06Å; N878-I881 PolarHBondContact O-N 2.92Å; Q879-I881 PolarHBondContact O-N 3.05Å; I881-E883 PolarHBondContact O-N 2.81Å; I881-N884 HydrophobicContact CG2-CB 3.87Å; I881-F885 WeakPolarHBondContact O-CA 3.4Å; I881-F885 WeakPolarHBondContact O-CB 3.48Å; I881-F885 PolarHBondContact O-N 3.12Å
882	T	66.4	Low	83.5	Confident	126 Å²	126	66 Å²	66	77%	0.773	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-44.1	-167.1	48.8	0	0	0	0	114.9	S880	S880-T882 PolarHBondContact O-N 3.45Å
883	E	70.3	Confident	83.3	Confident	161 Å²	161	63.5 Å²	63.5	75%	0.752	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-27.6	-174.6	-61.6	-168.2	155.1	0	0	114.1	H646 I881	H646-E883 PolarHBondContact CE1-O 3.21Å; H646-E883 PolarHBondContact NE2-O 3.25Å; I881-E883 PolarHBondContact O-N 2.81Å
884	N	78.4	Confident	83	Confident	26 Å²	26	65.7 Å²	65.7	14%	0.139	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	15	-167.6	-65.9	-41.5	0	0	0	113.3	F644 H646 I881 C886	F644-N884 PolarHBondContact O-ND2 2.77Å; H646-N884 PolarHBondContact CE1-OD1 2.79Å; H646-N884 PolarHBondContact ND1-OD1 2.9Å; I881-N884 HydrophobicContact CG2-CB 3.87Å; N884-C886 PolarHBondContact O-N 2.83Å
885	F	86	Confident	82.8	Confident	49 Å²	49	63.5 Å²	63.5	22%	0.215	31%	0.309	C	S	.	.	S	Bend	trans	-53.4	-44.2	-165.6	179.3	-131.9	0	0	0	115.9	H679 C876 Q877 Q879 I881	H679-F885 AromaticContact CE1-CZ 3.73Å; C876-F885 CarbonylContact C-O 3.5Å; C876-F885 VanDerWaalsContact CA-O 3.26Å; C876-F885 WeakPolarHBondContact CA-O 3.27Å; C876-F885 HydrophobicContact CB-CE2 4.28Å; C876-F885 HydrophobicContact CB-CZ 4.3Å; Q877-F885 PolarHBondContact N-O 2.65Å; Q877-F885 WeakPolarHBondContact O-CE2 3.28Å; Q879-F885 VanDerWaalsContact CA-CE2 3.47Å; Q879-F885 HydrophobicContact CB-CD2 4.38Å; Q879-F885 HydrophobicContact CB-CE2 3.77Å; Q879-F885 HydrophobicContact CB-CZ 4.1Å; Q879-F885 HydrophobicContact CG-CE1 4.45Å; Q879-F885 HydrophobicContact CG-CE2 4.06Å; Q879-F885 HydrophobicContact CG-CZ 3.99Å; I881-F885 WeakPolarHBondContact O-CA 3.4Å; I881-F885 WeakPolarHBondContact O-CB 3.48Å; I881-F885 PolarHBondContact O-N 3.12Å
886	C	89.1	Confident	82.5	Confident	22 Å²	22	64.6 Å²	64.6	15%	0.149	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-132.4	166.5	-176.5	-63.1	0	0	0	0	112.2	H646 A875 C876 N884 K888	H646-C886 PolarHBondContact CD2-O 2.9Å; A875-C886 CarbonylContact O-C 3.59Å; A875-C886 VanDerWaalsContact O-CA 3.25Å; A875-C886 WeakPolarHBondContact O-CA 3.23Å; C876-C886 HydrophobicContact CB-CB 4.1Å; C876-C886 WeakPolarHBondContact CB-SG 3.31Å; C876-C886 WeakPolarHBondContact SG-CB 3.46Å; C876-C886 CovalentContact SG-SG 2.04Å; C876-C886 PolarHBondContact SG-SG 3.06Å; N884-C886 PolarHBondContact O-N 2.83Å; C886-K888 PolarHBondContact O-N 2.93Å
887	S	87.5	Confident	82.4	Confident	4 Å²	4	64.6 Å²	64.6	3%	0.028	32%	0.317	C	S	.	.			trans	-59.4	130.8	178.3	59.5	0	0	0	0	112.6	P647 A875 R889	P647-S887 VanDerWaalsContact O-CA 3.28Å; P647-S887 WeakPolarHBondContact O-CA 3.41Å; P647-S887 WeakPolarHBondContact O-CB 3.47Å; A875-S887 PolarHBondContact N-OG 2.87Å; A875-S887 PolarHBondContact O-N 3.48Å; S887-R889 PolarHBondContact O-N 2.76Å; S887-R889 PolarHBondContact OG-O 3.38Å
888	K	81	Confident	82.4	Confident	162 Å²	162	67 Å²	67	70%	0.704	33%	0.33	S	S	*	.	S	Bend	trans	-58.6	-12.1	-178.5	-71.9	-164	176.3	-178.8	0	115.1	H646 C886	H646-K888 HydrophobicContact CB-CG 4.04Å; H646-K888 VanDerWaalsContact CD2-CE 3.49Å; H646-K888 WeakPolarHBondContact CD2-CE 3.48Å; H646-K888 WeakPolarHBondContact CD2-CG 3.28Å; H646-K888 WeakPolarHBondContact CE1-CE 3.37Å; H646-K888 VanDerWaalsContact ND1-CE 3.27Å; H646-K888 WeakPolarHBondContact ND1-CE 3.4Å; H646-K888 WeakPolarHBondContact NE2-CE 3.29Å; C886-K888 PolarHBondContact O-N 2.93Å
889	R	82.5	Confident	82.6	Confident	178 Å²	178	64.9 Å²	64.9	67%	0.672	32%	0.321	S	S	*	.	S	Bend	trans	-136	142.1	175.5	-62.4	179.8	179.7	176.3	-0.5	108.3	P649 S887	P649-R889 HydrophobicContact CG-CB 4.09Å; S887-R889 PolarHBondContact O-N 2.76Å; S887-R889 PolarHBondContact OG-O 3.38Å
890	E	85.4	Confident	83.4	Confident	64 Å²	64	60.1 Å²	60.1	30%	0.299	30%	0.302	S	S	.	.			trans	-68.9	158.6	156.2	59.3	-91.9	-124.7	0	0	111.4	K872 I873 W874	K872-E890 HydrophobicContact CB-CB 4.05Å; K872-E890 HydrophobicContact CB-CG 4.23Å; K872-E890 HydrophobicContact CD-CG 3.96Å; K872-E890 WeakPolarHBondContact CD-OE1 3.42Å; K872-E890 WeakPolarHBondContact CE-OE1 3.41Å; K872-E890 HydrophobicContact CG-CB 4.47Å; K872-E890 HydrophobicContact CG-CG 4.1Å; K872-E890 IonicContact NZ-OE1 3.64Å; K872-E890 PolarHBondContact NZ-OE1 2.8Å; I873-E890 CarbonylContact O-C 3.59Å; I873-E890 VanDerWaalsContact O-CA 3.24Å; I873-E890 WeakPolarHBondContact O-CA 3.38Å; W874-E890 HydrophobicContact CD2-CB 4.08Å; W874-E890 HydrophobicContact CG-CB 4.5Å; W874-E890 HydrophobicContact CH2-CB 4.41Å; W874-E890 HydrophobicContact CZ2-CB 3.82Å; W874-E890 HydrophobicContact CZ2-CG 4.35Å
891	V	86	Confident	83.9	Confident	13 Å²	13	63.8 Å²	63.8	8%	0.079	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	114.7	151.5	-175	0	0	0	0	107.9	P649 V650 V652 K872 I873 I893	P649-V891 HydrophobicContact CB-CG2 3.74Å; V650-V891 HydrophobicContact CG2-CB 4.37Å; V650-V891 HydrophobicContact CG2-CG2 3.64Å; V650-V891 VanDerWaalsContact O-CG2 3.31Å; V650-V891 WeakPolarHBondContact O-CG2 3.38Å; V652-V891 HydrophobicContact CG2-CB 4.29Å; V652-V891 HydrophobicContact CG2-CG1 3.8Å; V652-V891 HydrophobicContact CG2-CG2 4.49Å; K872-V891 CarbonylContact C-O 3.47Å; K872-V891 VanDerWaalsContact CA-O 3.29Å; K872-V891 WeakPolarHBondContact CA-O 3.28Å; I873-V891 PolarHBondContact N-O 3.15Å; I873-V891 PolarHBondContact O-N 2.85Å; V891-I893 HydrophobicContact CG1-CG1 4.31Å
892	R	87.8	Confident	84.7	Confident	108 Å²	108	66.5 Å²	66.5	41%	0.408	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	130.6	172.4	-165.3	-176.4	-170.3	-122.4	-8.9	109.3	E687 E870 I871	E687-R892 IonicContact OE1-CZ 3.16Å; E687-R892 IonicContact OE1-NH1 2.66Å; E687-R892 IonicContact OE1-NH2 3.88Å; E687-R892 PolarHBondContact OE1-NH2 2.85Å; E870-R892 HydrophobicContact CG-CG 4.12Å; E870-R892 IonicContact OE1-CZ 2.66Å; E870-R892 IonicContact OE1-NE 2.75Å; E870-R892 PolarHBondContact OE1-NE 2.73Å; E870-R892 IonicContact OE1-NH2 2.78Å; E870-R892 IonicContact OE2-CZ 3.01Å; E870-R892 IonicContact OE2-NE 3.57Å; E870-R892 PolarHBondContact OE2-NE 3.42Å; E870-R892 IonicContact OE2-NH2 2.71Å; E870-R892 PolarHBondContact OE2-NH2 3.38Å; I871-R892 CarbonylContact O-C 3.34Å
893	I	88.1	Confident	85.8	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.005	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	139.4	-175.5	-59.7	177.2	0	0	0	106.9	V652 V655 I665 M713 E870 I871 I873 V891	V652-I893 HydrophobicContact CG1-CD1 4.31Å; V652-I893 HydrophobicContact CG2-CD1 4.32Å; V655-I893 HydrophobicContact CG2-CG2 4.36Å; I665-I893 HydrophobicContact CD1-CD1 4.22Å; I665-I893 HydrophobicContact CG2-CD1 4.01Å; M713-I893 HydrophobicContact CE-CB 4.2Å; M713-I893 HydrophobicContact CE-CD1 3.87Å; M713-I893 HydrophobicContact CE-CG1 3.69Å; M713-I893 HydrophobicContact CE-CG2 3.7Å; M713-I893 HydrophobicContact CG-CG2 4.25Å; M713-I893 HydrophobicContact SD-CG2 3.63Å; E870-I893 CarbonylContact C-O 3.17Å; E870-I893 WeakPolarHBondContact CA-O 3.33Å; I871-I893 HydrophobicContact CB-CB 3.98Å; I871-I893 HydrophobicContact CB-CD1 4.4Å; I871-I893 HydrophobicContact CB-CG2 4.31Å; I871-I893 HydrophobicContact CD1-CB 4.35Å; I871-I893 HydrophobicContact CD1-CG2 3.82Å; I871-I893 PolarHBondContact N-O 3.44Å; I871-I893 WeakPolarHBondContact O-CB 3.42Å; I871-I893 PolarHBondContact O-N 2.84Å; I873-I893 HydrophobicContact CD1-CD1 3.72Å; I873-I893 HydrophobicContact CG1-CD1 4.09Å; V891-I893 HydrophobicContact CG1-CG1 4.31Å
894	L	86.7	Confident	86.7	Confident	47 Å²	47	56.3 Å²	56.3	25%	0.246	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	114	-179.4	-87.5	177.8	0	0	0	109	E687 M868 Y869 E870	E687-L894 WeakPolarHBondContact OE2-CD2 3.25Å; M868-L894 HydrophobicContact CE-CB 3.7Å; M868-L894 HydrophobicContact CE-CD2 4.24Å; M868-L894 HydrophobicContact CE-CG 4.4Å; M868-L894 HydrophobicContact CG-CD2 4.29Å; Y869-L894 WeakPolarHBondContact O-CA 3.49Å; E870-L894 HydrophobicContact CB-CD2 4.06Å
895	K	88	Confident	87.3	Confident	5 Å²	5	57.8 Å²	57.8	2%	0.022	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	134.6	-175.5	179.1	66.7	-176.6	175.5	0	111.2	V655 I663 D709 Y869	V655-K895 HydrophobicContact CG1-CB 4.2Å; V655-K895 HydrophobicContact CG1-CD 4.45Å; V655-K895 HydrophobicContact CG1-CG 3.92Å; I663-K895 HydrophobicContact CD1-CB 4.16Å; I663-K895 HydrophobicContact CD1-CG 4.02Å; I663-K895 HydrophobicContact CG1-CG 4.27Å; I663-K895 HydrophobicContact CG2-CG 4.32Å; D709-K895 IonicContact OD1-NZ 3.25Å; D709-K895 PolarHBondContact OD1-NZ 2.86Å; Y869-K895 PolarHBondContact N-O 2.71Å; Y869-K895 PolarHBondContact O-N 3.36Å; Y869-K895 VanDerWaalsContact O-N 3.14Å
896	S	86.3	Confident	87.5	Confident	24 Å²	24	56.2 Å²	56.2	17%	0.168	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	152.7	170.1	-69.1	0	0	0	0	112.3	S657 T867 M868	S657-S896 WeakPolarHBondContact CB-O 3.34Å; T867-S896 WeakPolarHBondContact O-CA 3.42Å; M868-S896 PolarHBondContact SD-N 3.01Å; M868-S896 VanDerWaalsContact SD-N 3.39Å; M868-S896 PolarHBondContact SD-OG 2.95Å
897	T	91	Very high	87.6	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-74	163.9	158.2	50.6	0	0	0	0	112.5	S657 A660 L863 R864 F866 T867 Y869	S657-T897 WeakPolarHBondContact OG-CA 3.38Å; A660-T897 WeakPolarHBondContact O-CB 3.21Å; L863-T897 HydrophobicContact CB-CG2 3.75Å; L863-T897 HydrophobicContact CD1-CG2 4.03Å; R864-T897 WeakPolarHBondContact O-CB 3.25Å; R864-T897 WeakPolarHBondContact O-CG2 3.5Å; R864-T897 PolarHBondContact O-OG1 2.81Å; F866-T897 PolarHBondContact N-OG1 3.11Å; T867-T897 PolarHBondContact N-OG1 3.12Å; T867-T897 PolarHBondContact O-N 3.03Å; T867-T897 VanDerWaalsContact O-N 3.16Å; T867-T897 PolarHBondContact O-OG1 2.85Å; Y869-T897 HydrophobicContact CE2-CG2 4.4Å
898	L	88.8	Confident	87.7	Confident	51 Å²	51	63.1 Å²	63.1	27%	0.267	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-70.9	153.6	177.4	-62.5	176.5	0	0	0	113.2	A660 F866	A660-L898 WeakPolarHBondContact CB-O 3.39Å; F866-L898 PolarHBondContact N-O 3.1Å
899	P	87.8	Confident	88.1	Confident	51 Å²	51	61.2 Å²	61.2	33%	0.331	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-81.2	173.4	173.8	34.2	-34.5	0	0	0	113.3	F866 N934 A990	F866-P899 HydrophobicContact CB-CB 4.11Å; F866-P899 HydrophobicContact CD2-CB 3.71Å; F866-P899 HydrophobicContact CD2-CG 4.08Å; F866-P899 HydrophobicContact CE2-CB 4.46Å; F866-P899 HydrophobicContact CG-CB 4.14Å; P899-N934 WeakPolarHBondContact CA-OD1 3.27Å; P899-N934 HydrophobicContact CB-CB 4.17Å; P899-N934 WeakPolarHBondContact CB-OD1 3.36Å; P899-A990 HydrophobicContact CB-CB 4.16Å
900	V	89.5	Confident	88.5	Confident	53 Å²	53	53.6 Å²	53.6	32%	0.321	28%	0.284	S	S	.	.			trans	-124.7	113.1	175.6	-180	0	0	0	0	108.9	A660 H865 S902 K903 N934	A660-V900 HydrophobicContact CB-CG2 4.39Å; H865-V900 HydrophobicContact CB-CG2 4.1Å; V900-S902 PolarHBondContact O-N 2.74Å; V900-K903 HydrophobicContact CB-CG 3.91Å; V900-K903 HydrophobicContact CG1-CG 4.01Å; V900-K903 WeakPolarHBondContact O-CB 3.35Å; V900-K903 PolarHBondContact O-N 3.05Å; V900-N934 PolarHBondContact N-OD1 2.96Å; V900-N934 PolarHBondContact O-ND2 2.83Å; V900-N934 PolarHBondContact O-OD1 2.98Å
901	E	83.9	Confident	88.8	Confident	162 Å²	162	51.5 Å²	51.5	76%	0.757	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-53.2	-46.3	-165.6	-64.2	-178.8	159.7	0	0	114.2	K903 Q991	E901-K903 PolarHBondContact O-N 3.3Å; E901-Q991 PolarHBondContact O-NE2 2.91Å
902	S	87.7	Confident	88.9	Confident	90 Å²	90	55.6 Å²	55.6	63%	0.629	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-78.1	16.7	-173.8	75.3	0	0	0	0	115.3	V900	V900-S902 PolarHBondContact O-N 2.74Å
903	K	90.2	Very high	88.9	Confident	71 Å²	71	53.3 Å²	53.3	31%	0.309	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-93.6	-11.4	-177.9	-75.2	-65	-167	153.8	0	114.4	V900 E901 D932 P933	V900-K903 HydrophobicContact CB-CG 3.91Å; V900-K903 HydrophobicContact CG1-CG 4.01Å; V900-K903 WeakPolarHBondContact O-CB 3.35Å; V900-K903 PolarHBondContact O-N 3.05Å; E901-K903 PolarHBondContact O-N 3.3Å; K903-D932 WeakPolarHBondContact CB-O 3.43Å; K903-D932 HydrophobicContact CD-CB 4.38Å; K903-D932 WeakPolarHBondContact CD-O 3.35Å; K903-D932 WeakPolarHBondContact CE-OD2 3.46Å; K903-D932 IonicContact NZ-OD2 3.85Å; K903-D932 PolarHBondContact NZ-OD2 2.94Å; K903-P933 WeakPolarHBondContact O-CA 3.38Å
904	D	89.1	Confident	88.8	Confident	1 Å²	1	59 Å²	59	1%	0.005	31%	0.313	C	S	.	.	S	Bend	trans	-111.7	9.4	-174.4	-57.9	-39.1	0	0	0	113.7	P933 N934 A986 S988 Q991	D904-P933 WeakPolarHBondContact OD1-CA 3.48Å; D904-P933 WeakPolarHBondContact OD1-CB 3.26Å; D904-N934 PolarHBondContact OD1-N 3.47Å; D904-N934 PolarHBondContact OD2-ND2 2.93Å; D904-A986 WeakPolarHBondContact O-CB 3.37Å; D904-S988 WeakPolarHBondContact OD1-CB 3.4Å; D904-S988 PolarHBondContact OD1-OG 3.38Å; D904-S988 WeakPolarHBondContact OD2-CB 3.36Å; D904-S988 PolarHBondContact OD2-OG 3.2Å; D904-Q991 WeakPolarHBondContact OD2-CG 3.3Å; D904-Q991 PolarHBondContact OD2-NE2 3.15Å
905	D	90.2	Very high	88.4	Confident	57 Å²	57	61.6 Å²	61.6	31%	0.305	33%	0.328	S	S	.	.			trans	-87.6	143.9	-178.1	-62.8	-43.6	0	0	0	112.2	P930 S994	D905-P930 WeakPolarHBondContact O-CG 3.27Å; D905-S994 WeakPolarHBondContact OD1-CA 3.22Å; D905-S994 WeakPolarHBondContact OD1-CB 3.15Å; D905-S994 PolarHBondContact OD1-N 2.72Å; D905-S994 PolarHBondContact OD1-OG 3.41Å
906	I	91	Very high	87.7	Confident	17 Å²	17	63.7 Å²	63.7	9%	0.087	35%	0.346	C	S	.	.			trans	-86.2	136.4	179.1	-57.8	175.5	0	0	0	110.3	E908 Y940 I984 A986 T996	I906-E908 PolarHBondContact O-N 2.94Å; I906-Y940 HydrophobicContact CD1-CD1 3.91Å; I906-Y940 HydrophobicContact CD1-CE1 4.18Å; I906-I984 HydrophobicContact CD1-CB 4.33Å; I906-I984 HydrophobicContact CD1-CG2 3.7Å; I906-A986 HydrophobicContact CD1-CB 4.07Å; I906-A986 HydrophobicContact CG1-CB 3.79Å; I906-T996 HydrophobicContact CB-CG2 4.39Å
907	D	91.1	Very high	86.9	Confident	89 Å²	89	65 Å²	65	48%	0.476	36%	0.355	S	S	.	.			trans	-70.8	105	168.4	-177.3	-10.1	0	0	0	111	T909 T910	D907-T909 VanDerWaalsContact CG-OG1 3.23Å; D907-T909 PolarHBondContact O-N 2.86Å; D907-T909 VanDerWaalsContact O-N 3.14Å; D907-T909 VanDerWaalsContact OD1-CB 3.31Å; D907-T909 WeakPolarHBondContact OD1-CB 3.1Å; D907-T909 WeakPolarHBondContact OD1-CG2 3.34Å; D907-T909 PolarHBondContact OD1-N 2.8Å; D907-T909 PolarHBondContact OD1-OG1 2.92Å; D907-T909 PolarHBondContact OD2-OG1 2.9Å; D907-T910 HydrophobicContact CB-CG2 3.9Å; D907-T910 WeakPolarHBondContact O-CB 3.44Å; D907-T910 PolarHBondContact O-N 2.95Å; D907-T910 VanDerWaalsContact O-N 3.14Å; D907-T910 PolarHBondContact O-OG1 3.03Å
908	E	90.3	Very high	85.6	Confident	81 Å²	81	73 Å²	73	38%	0.379	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-57.8	-24.8	179.4	-62.2	-164.1	-178.7	0	0	113.8	I906 T910 V911 T996 S997	I906-E908 PolarHBondContact O-N 2.94Å; E908-T910 PolarHBondContact O-N 3.23Å; E908-T910 VanDerWaalsContact O-N 3.14Å; E908-V911 PolarHBondContact O-N 2.88Å; E908-T996 HydrophobicContact CG-CG2 4.02Å; E908-T996 WeakPolarHBondContact OE1-CA 3.15Å; E908-S997 PolarHBondContact OE1-N 2.87Å; E908-S997 VanDerWaalsContact OE2-CB 3.29Å; E908-S997 WeakPolarHBondContact OE2-CB 3.49Å; E908-S997 PolarHBondContact OE2-OG 2.86Å
909	T	89.4	Confident	84.4	Confident	123 Å²	123	75.9 Å²	75.9	76%	0.755	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-68.5	-11.8	-179.7	71.6	0	0	0	0	113.1	D907	D907-T909 VanDerWaalsContact CG-OG1 3.23Å; D907-T909 PolarHBondContact O-N 2.86Å; D907-T909 VanDerWaalsContact O-N 3.14Å; D907-T909 VanDerWaalsContact OD1-CB 3.31Å; D907-T909 WeakPolarHBondContact OD1-CB 3.1Å; D907-T909 WeakPolarHBondContact OD1-CG2 3.34Å; D907-T909 PolarHBondContact OD1-N 2.8Å; D907-T909 PolarHBondContact OD1-OG1 2.92Å; D907-T909 PolarHBondContact OD2-OG1 2.9Å
910	T	90.6	Very high	83.5	Confident	18 Å²	18	75.2 Å²	75.2	11%	0.11	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-95.2	-8	-175.3	71.4	0	0	0	0	113.6	D907 E908 N928	D907-T910 HydrophobicContact CB-CG2 3.9Å; D907-T910 WeakPolarHBondContact O-CB 3.44Å; D907-T910 PolarHBondContact O-N 2.95Å; D907-T910 VanDerWaalsContact O-N 3.14Å; D907-T910 PolarHBondContact O-OG1 3.03Å; E908-T910 PolarHBondContact O-N 3.23Å; E908-T910 VanDerWaalsContact O-N 3.14Å; T910-N928 HydrophobicContact CG2-CB 3.88Å; T910-N928 VanDerWaalsContact CG2-ND2 3.35Å; T910-N928 WeakPolarHBondContact CG2-ND2 3.14Å; T910-N928 PolarHBondContact OG1-N 3.26Å
911	V	91	Very high	82.9	Confident	20 Å²	20	74.9 Å²	74.9	12%	0.121	42%	0.415	C	S	.	.			trans	-76.8	127.1	-173.7	-175.1	0	0	0	0	111.9	E908 I925 S926 W927 F982 I984 F999	E908-V911 PolarHBondContact O-N 2.88Å; V911-I925 HydrophobicContact CG1-CG2 4.37Å; V911-S926 CarbonylContact C-O 3.33Å; V911-S926 WeakPolarHBondContact CA-O 3.26Å; V911-W927 HydrophobicContact CG2-CB 4.03Å; V911-F982 HydrophobicContact CG1-CE2 4.25Å; V911-F982 HydrophobicContact CG1-CZ 4.37Å; V911-I984 HydrophobicContact CG1-CD1 3.95Å; V911-I984 HydrophobicContact CG2-CD1 4.23Å; V911-F999 HydrophobicContact CB-CE1 3.83Å; V911-F999 HydrophobicContact CB-CE2 4.06Å; V911-F999 HydrophobicContact CB-CZ 3.55Å; V911-F999 HydrophobicContact CG1-CD1 4.27Å; V911-F999 HydrophobicContact CG1-CD2 4.13Å; V911-F999 HydrophobicContact CG1-CE1 4.01Å; V911-F999 HydrophobicContact CG1-CE2 3.87Å; V911-F999 HydrophobicContact CG1-CG 4.34Å; V911-F999 HydrophobicContact CG1-CZ 3.81Å; V911-F999 HydrophobicContact CG2-CE1 4.39Å; V911-F999 HydrophobicContact CG2-CE2 3.92Å; V911-F999 HydrophobicContact CG2-CZ 3.62Å
912	Q	89	Confident	82.9	Confident	98 Å²	98	68.5 Å²	68.5	46%	0.458	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	149.9	-176.6	-61.3	178.7	3.8	0	0	111.8	Y914 I925 S926	Q912-Y914 HydrophobicContact CB-CE2 3.68Å; Q912-Y914 PolarHBondContact OE1-OH 2.97Å; Q912-I925 CarbonylContact O-C 3.51Å; Q912-I925 VanDerWaalsContact O-CA 3.28Å; Q912-I925 WeakPolarHBondContact O-CA 3.41Å; Q912-S926 PolarHBondContact N-O 3.4Å; Q912-S926 PolarHBondContact O-N 3.29Å
913	V	87.2	Confident	82.8	Confident	60 Å²	60	65.4 Å²	65.4	36%	0.364	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	134.6	-175.4	-174	0	0	0	0	111.4	F924 I925 F982	V913-F924 CarbonylContact C-O 3.52Å; V913-F924 WeakPolarHBondContact CA-O 3.46Å; V913-I925 HydrophobicContact CG1-CG1 4.41Å; V913-I925 HydrophobicContact CG2-CG1 4.4Å; V913-I925 HydrophobicContact CG2-CG2 4.44Å; V913-F982 HydrophobicContact CG2-CE1 3.76Å; V913-F982 HydrophobicContact CG2-CZ 3.52Å
914	Y	85.1	Confident	82.8	Confident	120 Å²	120	64.5 Å²	64.5	47%	0.471	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	158.7	-175.3	-58.6	-90.3	0	0	0	111.7	Q912 R923 F924	Q912-Y914 HydrophobicContact CB-CE2 3.68Å; Q912-Y914 PolarHBondContact OE1-OH 2.97Å; Y914-R923 WeakPolarHBondContact O-CA 3.09Å; Y914-F924 HydrophobicContact CD2-CD1 4.09Å; Y914-F924 PolarHBondContact N-O 3.17Å; Y914-F924 PolarHBondContact O-N 3.26Å
915	N	78.5	Confident	82.9	Confident	103 Å²	103	64.4 Å²	64.4	55%	0.551	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	135.3	164.9	-67.8	-17.7	0	0	0	109	R923	N915-R923 PolarHBondContact OD1-NE 3.48Å; N915-R923 PolarHBondContact OD1-NH1 3Å
916	A	73.5	Confident	83	Confident	48 Å²	48	63.1 Å²	63.1	40%	0.397	35%	0.352	S	S	.	.	S	Bend	trans	-88.7	-18.3	-179.9	0	0	0	0	0	114	D922 F924 V971	A916-D922 HydrophobicContact CB-CB 3.86Å; A916-D922 PolarHBondContact N-O 2.83Å; A916-F924 HydrophobicContact CB-CB 4.23Å; A916-V971 HydrophobicContact CB-CG1 4.2Å
917	S	70.2	Confident	83.1	Confident	52 Å²	52	62.7 Å²	62.7	36%	0.364	35%	0.349	S	S	.	.			trans	-158	149.1	168.5	-179.6	0	0	0	0	109.5	S919	S917-S919 PolarHBondContact O-N 3.19Å; S917-S919 PolarHBondContact OG-N 3.29Å; S917-S919 PolarHBondContact OG-OG 3.15Å; S917-S919 VanDerWaalsContact OG-OG 3.11Å
918	D	64.5	Low	83.2	Confident	169 Å²	169	63 Å²	63	90%	0.904	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-11.6	174.5	-66.1	-41.8	0	0	0	113.3
919	S	63.3	Low	83.2	Confident	111 Å²	111	62.1 Å²	62.1	78%	0.776	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.6	4.7	-175.6	62.2	0	0	0	0	115	S917	S917-S919 PolarHBondContact O-N 3.19Å; S917-S919 PolarHBondContact OG-N 3.29Å; S917-S919 PolarHBondContact OG-OG 3.15Å; S917-S919 VanDerWaalsContact OG-OG 3.11Å
920	S	68.6	Low	83.2	Confident	36 Å²	36	57.1 Å²	57.1	25%	0.252	32%	0.322	S	S	.	.	S	Bend	trans	-131.4	162.8	178.3	75.3	0	0	0	0	113.1	D922	S920-D922 VanDerWaalsContact CB-OD2 3.28Å; S920-D922 WeakPolarHBondContact CB-OD2 3.5Å; S920-D922 PolarHBondContact O-N 2.95Å; S920-D922 WeakPolarHBondContact OG-CB 3.33Å; S920-D922 PolarHBondContact OG-OD2 3.17Å
921	N	77	Confident	83.1	Confident	46 Å²	46	64.4 Å²	64.4	25%	0.246	36%	0.36	C	S	.	.	S	Bend	trans	-81.6	13.8	178.1	-73.4	4.7	0	0	0	113	L975 I1003	N921-L975 WeakPolarHBondContact CB-O 3.34Å; N921-L975 PolarHBondContact ND2-O 3.44Å; N921-I1003 HydrophobicContact CB-CG2 3.68Å; N921-I1003 VanDerWaalsContact CG-CG2 3.41Å; N921-I1003 WeakPolarHBondContact O-CD1 3.43Å
922	D	83.9	Confident	82.9	Confident	28 Å²	28	66.8 Å²	66.8	15%	0.15	37%	0.372	C	S	.	.			trans	-83.2	147.4	-170.1	-53.4	-33	0	0	0	111.6	A916 S920 V971 I972 R973 D974	A916-D922 HydrophobicContact CB-CB 3.86Å; A916-D922 PolarHBondContact N-O 2.83Å; S920-D922 VanDerWaalsContact CB-OD2 3.28Å; S920-D922 WeakPolarHBondContact CB-OD2 3.5Å; S920-D922 PolarHBondContact O-N 2.95Å; S920-D922 WeakPolarHBondContact OG-CB 3.33Å; S920-D922 PolarHBondContact OG-OD2 3.17Å; D922-V971 HydrophobicContact CB-CG1 4.23Å; D922-I972 WeakPolarHBondContact CA-O 3.3Å; D922-R973 WeakPolarHBondContact OD1-CA 3.44Å; D922-D974 PolarHBondContact OD1-N 3.08Å
923	R	85.5	Confident	82.8	Confident	26 Å²	26	63.1 Å²	63.1	10%	0.098	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	126.5	-178.1	-63.6	-66.5	177.6	-96.2	8.9	110.8	Y914 N915 V971 I972 L1001 L1002 I1003	Y914-R923 WeakPolarHBondContact O-CA 3.09Å; N915-R923 PolarHBondContact OD1-NE 3.48Å; N915-R923 PolarHBondContact OD1-NH1 3Å; R923-V971 CarbonylContact O-C 3.47Å; R923-V971 WeakPolarHBondContact O-CA 2.96Å; R923-I972 PolarHBondContact N-O 3.36Å; R923-I972 PolarHBondContact O-N 3.38Å; R923-L1001 HydrophobicContact CB-CD2 4.24Å; R923-L1001 HydrophobicContact CG-CD1 4.15Å; R923-L1001 HydrophobicContact CG-CD2 4.17Å; R923-L1002 PolarHBondContact NH2-O 3.12Å; R923-I1003 HydrophobicContact CG-CD1 4.42Å
924	F	90	Very high	82.9	Confident	51 Å²	51	60.3 Å²	60.3	22%	0.224	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	134.7	177.6	-176.9	-79.3	0	0	0	109.4	V913 Y914 A916 N967 L968 F970 V971	V913-F924 CarbonylContact C-O 3.52Å; V913-F924 WeakPolarHBondContact CA-O 3.46Å; Y914-F924 HydrophobicContact CD2-CD1 4.09Å; Y914-F924 PolarHBondContact N-O 3.17Å; Y914-F924 PolarHBondContact O-N 3.26Å; A916-F924 HydrophobicContact CB-CB 4.23Å; F924-N967 WeakPolarHBondContact CE2-O 3.29Å; F924-N967 WeakPolarHBondContact CZ-O 3.37Å; F924-L968 HydrophobicContact CZ-CB 4.41Å; F924-L968 WeakPolarHBondContact CZ-O 3.39Å; F924-F970 CarbonylContact C-O 3.46Å; F924-F970 WeakPolarHBondContact CA-O 3.29Å; F924-V971 HydrophobicContact CB-CG2 4.38Å; F924-V971 HydrophobicContact CD2-CG2 3.59Å; F924-V971 HydrophobicContact CE2-CG2 4.34Å; F924-V971 HydrophobicContact CG-CG2 4.37Å
925	I	91.2	Very high	82.8	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	135.1	-174.3	-52.9	175.2	0	0	0	108.5	V911 Q912 V913 W927 I942 G969 F970 I972 F982 I984	V911-I925 HydrophobicContact CG1-CG2 4.37Å; Q912-I925 CarbonylContact O-C 3.51Å; Q912-I925 VanDerWaalsContact O-CA 3.28Å; Q912-I925 WeakPolarHBondContact O-CA 3.41Å; V913-I925 HydrophobicContact CG1-CG1 4.41Å; V913-I925 HydrophobicContact CG2-CG1 4.4Å; V913-I925 HydrophobicContact CG2-CG2 4.44Å; I925-W927 HydrophobicContact CB-CZ3 4.28Å; I925-W927 HydrophobicContact CG2-CE3 3.97Å; I925-W927 HydrophobicContact CG2-CZ3 3.83Å; I925-I942 HydrophobicContact CD1-CD1 3.82Å; I925-G969 CarbonylContact O-C 3.57Å; I925-G969 WeakPolarHBondContact O-CA 3.44Å; I925-F970 PolarHBondContact N-O 2.89Å; I925-F970 PolarHBondContact O-N 2.66Å; I925-I972 HydrophobicContact CD1-CD1 3.63Å; I925-I972 HydrophobicContact CD1-CG1 4.01Å; I925-F982 HydrophobicContact CD1-CD1 4.26Å; I925-F982 HydrophobicContact CD1-CD2 4.14Å; I925-F982 HydrophobicContact CD1-CE1 4.05Å; I925-F982 HydrophobicContact CD1-CE2 3.95Å; I925-F982 HydrophobicContact CD1-CG 4.3Å; I925-F982 HydrophobicContact CD1-CZ 3.89Å; I925-F982 HydrophobicContact CG1-CZ 4.41Å; I925-F982 HydrophobicContact CG2-CE2 3.79Å; I925-F982 HydrophobicContact CG2-CZ 3.9Å; I925-I984 HydrophobicContact CG2-CD1 4.37Å
926	S	92.7	Very high	83	Confident	30 Å²	30	51.2 Å²	51.2	21%	0.21	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	158.1	-179.3	-163.7	0	0	0	0	111.8	V911 Q912 L968	V911-S926 CarbonylContact C-O 3.33Å; V911-S926 WeakPolarHBondContact CA-O 3.26Å; Q912-S926 PolarHBondContact N-O 3.4Å; Q912-S926 PolarHBondContact O-N 3.29Å; S926-L968 WeakPolarHBondContact CB-O 3.35Å; S926-L968 PolarHBondContact OG-O 3.03Å
927	W	93.3	Very high	83.7	Confident	7 Å²	7	49.9 Å²	49.9	3%	0.027	29%	0.29	C	S	.	.			trans	-165	168.1	-176.4	59.5	88.4	0	0	0	110.9	V911 I925 Y940 F964 F970 I984	V911-W927 HydrophobicContact CG2-CB 4.03Å; I925-W927 HydrophobicContact CB-CZ3 4.28Å; I925-W927 HydrophobicContact CG2-CE3 3.97Å; I925-W927 HydrophobicContact CG2-CZ3 3.83Å; W927-Y940 AromaticContact CD1-CE1 3.94Å; W927-Y940 AromaticContact CE2-CD1 3.91Å; W927-Y940 AromaticContact CZ2-CD1 3.98Å; W927-Y940 HydrophobicContact CZ2-CD1 3.98Å; W927-Y940 AromaticContact CZ2-CD2 3.97Å; W927-Y940 HydrophobicContact CZ2-CD2 3.97Å; W927-Y940 AromaticContact CZ2-CG 3.65Å; W927-Y940 HydrophobicContact CZ2-CG 3.65Å; W927-Y940 AromaticContact NE1-CD1 3.26Å; W927-Y940 VanDerWaalsContact NE1-CD1 3.26Å; W927-Y940 AromaticContact NE1-CE1 3.11Å; W927-Y940 AromaticContact NE1-CG 3.79Å; W927-Y940 AromaticContact NE1-CZ 3.53Å; W927-F964 AromaticContact CD1-CZ 3.74Å; W927-F964 AromaticContact CD2-CE2 3.57Å; W927-F964 HydrophobicContact CD2-CE2 3.57Å; W927-F964 AromaticContact CD2-CZ 3.53Å; W927-F964 HydrophobicContact CD2-CZ 3.53Å; W927-F964 AromaticContact CE2-CE2 3.26Å; W927-F964 AromaticContact CE2-CZ 3.4Å; W927-F964 AromaticContact CE3-CE2 3.8Å; W927-F964 HydrophobicContact CE3-CE2 3.8Å; W927-F964 HydrophobicContact CE3-CZ 4.12Å; W927-F964 HydrophobicContact CG-CE2 4.31Å; W927-F964 AromaticContact CG-CZ 3.77Å; W927-F964 HydrophobicContact CG-CZ 3.77Å; W927-F964 HydrophobicContact CH2-CD2 4.02Å; W927-F964 AromaticContact CH2-CE2 3.56Å; W927-F964 HydrophobicContact CH2-CE2 3.56Å; W927-F964 HydrophobicContact CH2-CZ 4.48Å; W927-F964 AromaticContact CZ2-CD2 3.67Å; W927-F964 HydrophobicContact CZ2-CD2 3.67Å; W927-F964 AromaticContact CZ2-CE2 3.26Å; W927-F964 HydrophobicContact CZ2-CE2 3.26Å; W927-F964 AromaticContact CZ2-CZ 3.92Å; W927-F964 HydrophobicContact CZ2-CZ 3.92Å; W927-F964 AromaticContact CZ3-CE2 3.81Å; W927-F964 HydrophobicContact CZ3-CE2 3.81Å; W927-F964 AromaticContact NE1-CE1 3.97Å; W927-F964 AromaticContact NE1-CE2 3.81Å; W927-F964 AromaticContact NE1-CZ 3.49Å; W927-F964 WeakPolarHBondContact O-CE1 3.19Å; W927-F964 VanDerWaalsContact O-CZ 3.3Å; W927-F964 WeakPolarHBondContact O-CZ 3.3Å; W927-F970 HydrophobicContact CH2-CB 3.88Å; W927-F970 HydrophobicContact CZ3-CB 4.03Å; W927-I984 HydrophobicContact CD2-CD1 3.88Å; W927-I984 HydrophobicContact CD2-CG2 4.31Å; W927-I984 HydrophobicContact CE3-CD1 3.45Å; W927-I984 VanDerWaalsContact CE3-CD1 3.45Å; W927-I984 HydrophobicContact CE3-CG1 4.44Å; W927-I984 HydrophobicContact CH2-CD1 4.36Å; W927-I984 HydrophobicContact CH2-CG2 4.04Å; W927-I984 HydrophobicContact CZ2-CG2 3.72Å; W927-I984 HydrophobicContact CZ3-CD1 3.72Å; W927-I984 HydrophobicContact CZ3-CG1 4.29Å; W927-I984 HydrophobicContact CZ3-CG2 4.47Å
928	N	92.5	Very high	84.5	Confident	96 Å²	96	47.5 Å²	47.5	51%	0.513	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-90.8	148.4	177	-69.9	-9.6	0	0	0	112.8	T910	T910-N928 HydrophobicContact CG2-CB 3.88Å; T910-N928 VanDerWaalsContact CG2-ND2 3.35Å; T910-N928 WeakPolarHBondContact CG2-ND2 3.14Å; T910-N928 PolarHBondContact OG1-N 3.26Å
929	P	89.7	Confident	85.8	Confident	62 Å²	62	39.5 Å²	39.5	40%	0.403	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-74.6	154.6	170.1	32	-35.4	0	0	0	112.3	L937 Y940	P929-L937 HydrophobicContact CB-CD2 3.53Å; P929-Y940 WeakPolarHBondContact CB-OH 3.36Å
930	P	90.7	Very high	87.2	Confident	18 Å²	18	34.3 Å²	34.3	12%	0.117	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-63.7	141.2	167.8	-21.5	32.7	0	0	0	113.5	D905 A986	D905-P930 WeakPolarHBondContact O-CG 3.27Å; P930-A986 HydrophobicContact CG-CB 4.28Å
931	D	87.4	Confident	88.4	Confident	172 Å²	172	33.7 Å²	33.7	92%	0.92	19%	0.188	S	C	*	.	S	Bend	trans	-69.7	-39.1	-170.3	-73.4	-43.2	0	0	0	115.9
932	D	87.7	Confident	89.1	Confident	70 Å²	70	31.6 Å²	31.6	37%	0.374	18%	0.176	S	C	.	.	S	Bend	trans	-142.7	61.4	-170.5	176.5	44.9	0	0	0	110.8	H865 K903	H865-D932 IonicContact CD2-OD2 3.44Å; H865-D932 IonicContact CE1-OD1 3.72Å; H865-D932 IonicContact CE1-OD2 3Å; H865-D932 IonicContact NE2-OD1 2.75Å; H865-D932 PolarHBondContact NE2-OD1 2.87Å; H865-D932 IonicContact NE2-OD2 3.6Å; H865-D932 PolarHBondContact NE2-OD2 2.92Å; K903-D932 WeakPolarHBondContact CB-O 3.43Å; K903-D932 HydrophobicContact CD-CB 4.38Å; K903-D932 WeakPolarHBondContact CD-O 3.35Å; K903-D932 WeakPolarHBondContact CE-OD2 3.46Å; K903-D932 IonicContact NZ-OD2 3.85Å; K903-D932 PolarHBondContact NZ-OD2 2.94Å
933	P	87.2	Confident	89.5	Confident	21 Å²	21	30.5 Å²	30.5	14%	0.136	17%	0.17	C	C	.	.			trans	-65.9	157.8	-172.1	29	-37.4	0	0	0	112.7	K903 D904 G935 L937	K903-P933 WeakPolarHBondContact O-CA 3.38Å; D904-P933 WeakPolarHBondContact OD1-CA 3.48Å; D904-P933 WeakPolarHBondContact OD1-CB 3.26Å; P933-G935 PolarHBondContact O-N 3.12Å; P933-L937 HydrophobicContact CB-CB 4.39Å; P933-L937 HydrophobicContact CG-CB 4.06Å
934	N	88.2	Confident	89.7	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-66.1	98.1	176.5	-67.7	-65.1	0	0	0	110.4	F866 P899 V900 D904 A936 A990 Q991	F866-N934 HydrophobicContact CB-CB 4.15Å; F866-N934 HydrophobicContact CD1-CB 4.32Å; F866-N934 HydrophobicContact CG-CB 4.28Å; P899-N934 WeakPolarHBondContact CA-OD1 3.27Å; P899-N934 HydrophobicContact CB-CB 4.17Å; P899-N934 WeakPolarHBondContact CB-OD1 3.36Å; V900-N934 PolarHBondContact N-OD1 2.96Å; V900-N934 PolarHBondContact O-ND2 2.83Å; V900-N934 PolarHBondContact O-OD1 2.98Å; D904-N934 PolarHBondContact OD1-N 3.47Å; D904-N934 PolarHBondContact OD2-ND2 2.93Å; N934-A936 PolarHBondContact O-N 2.89Å; N934-A936 VanDerWaalsContact O-N 3.16Å; N934-A990 HydrophobicContact CB-CB 3.43Å; N934-A990 VanDerWaalsContact CB-CB 3.43Å; N934-Q991 PolarHBondContact ND2-NE2 3.12Å
935	G	82.8	Confident	89.4	Confident	7 Å²	7	27.8 Å²	27.8	7%	0.072	16%	0.162	C	C	.	.	S	Bend	trans	82.2	-79.8	-177.2	0	0	0	0	0	112.9	R689 P933	R689-G935 VanDerWaalsContact CZ-O 3.26Å; R689-G935 PolarHBondContact NH1-O 2.84Å; P933-G935 PolarHBondContact O-N 3.12Å
936	A	83.1	Confident	88.8	Confident	26 Å²	26	32.8 Å²	32.8	22%	0.215	18%	0.181	C	C	.	.			trans	-157.2	146.4	175.4	0	0	0	0	0	110.8	N934 S988 L989	N934-A936 PolarHBondContact O-N 2.89Å; N934-A936 VanDerWaalsContact O-N 3.16Å; A936-S988 CarbonylContact O-C 3.49Å; A936-S988 WeakPolarHBondContact O-CA 3.06Å; A936-L989 HydrophobicContact CB-CD1 3.7Å; A936-L989 HydrophobicContact CB-CG 4.07Å; A936-L989 PolarHBondContact O-N 2.63Å
937	L	87.3	Confident	87.7	Confident	19 Å²	19	35.6 Å²	35.6	10%	0.099	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	127.6	169.8	-177.5	64.2	0	0	0	109.2	P929 P933 Y940 A986	P929-L937 HydrophobicContact CB-CD2 3.53Å; P933-L937 HydrophobicContact CB-CB 4.39Å; P933-L937 HydrophobicContact CG-CB 4.06Å; L937-Y940 HydrophobicContact CD1-CE1 4.38Å; L937-Y940 WeakPolarHBondContact CD2-OH 3.31Å; L937-A986 HydrophobicContact CD1-CB 3.71Å
938	V	88.4	Confident	86.2	Confident	3 Å²	3	38.2 Å²	38.2	2%	0.018	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	-33.8	-170.5	-66.4	0	0	0	0	114.7	Y697 P702 Q961 L987 L989	Y697-V938 HydrophobicContact CD1-CB 4Å; Y697-V938 HydrophobicContact CD1-CG1 4.22Å; Y697-V938 HydrophobicContact CD1-CG2 4.04Å; Y697-V938 HydrophobicContact CD2-CB 3.64Å; Y697-V938 HydrophobicContact CD2-CG1 3.96Å; Y697-V938 HydrophobicContact CD2-CG2 4.49Å; Y697-V938 HydrophobicContact CE1-CB 4.32Å; Y697-V938 HydrophobicContact CE1-CG1 4.02Å; Y697-V938 HydrophobicContact CE2-CB 3.99Å; Y697-V938 HydrophobicContact CE2-CG1 3.76Å; Y697-V938 HydrophobicContact CG-CB 3.62Å; Y697-V938 HydrophobicContact CG-CG1 4.17Å; Y697-V938 HydrophobicContact CG-CG2 3.98Å; P702-V938 HydrophobicContact CG-CG2 3.96Å; V938-Q961 PolarHBondContact O-N 3.17Å; V938-L987 HydrophobicContact CG2-CB 4.05Å; V938-L987 VanDerWaalsContact CG2-O 3.26Å; V938-L987 WeakPolarHBondContact CG2-O 3.29Å; V938-L987 PolarHBondContact N-O 3.38Å; V938-L989 HydrophobicContact CG1-CD2 3.73Å; V938-L989 HydrophobicContact CG1-CG 4.01Å
939	A	90.7	Very high	84.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	173.9	-177.7	0	0	0	0	0	111.9	I959 L987	A939-I959 CarbonylContact C-O 3.58Å; A939-I959 VanDerWaalsContact CA-O 3.29Å; A939-I959 WeakPolarHBondContact CA-O 3.5Å; A939-I959 WeakPolarHBondContact CB-O 3.34Å; A939-L987 HydrophobicContact CB-CB 4.37Å; A939-L987 WeakPolarHBondContact O-CB 3.31Å; A939-L987 PolarHBondContact O-N 2.8Å
940	Y	93.7	Very high	83	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.008	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	141.5	167.3	-51.4	-92.4	0	0	0	110.3	I906 W927 P929 L937 C958 I959 Q961 F964 R985 A986	I906-Y940 HydrophobicContact CD1-CD1 3.91Å; I906-Y940 HydrophobicContact CD1-CE1 4.18Å; W927-Y940 AromaticContact CD1-CE1 3.94Å; W927-Y940 AromaticContact CE2-CD1 3.91Å; W927-Y940 AromaticContact CZ2-CD1 3.98Å; W927-Y940 HydrophobicContact CZ2-CD1 3.98Å; W927-Y940 AromaticContact CZ2-CD2 3.97Å; W927-Y940 HydrophobicContact CZ2-CD2 3.97Å; W927-Y940 AromaticContact CZ2-CG 3.65Å; W927-Y940 HydrophobicContact CZ2-CG 3.65Å; W927-Y940 AromaticContact NE1-CD1 3.26Å; W927-Y940 VanDerWaalsContact NE1-CD1 3.26Å; W927-Y940 AromaticContact NE1-CE1 3.11Å; W927-Y940 AromaticContact NE1-CG 3.79Å; W927-Y940 AromaticContact NE1-CZ 3.53Å; P929-Y940 WeakPolarHBondContact CB-OH 3.36Å; L937-Y940 HydrophobicContact CD1-CE1 4.38Å; L937-Y940 WeakPolarHBondContact CD2-OH 3.31Å; Y940-C958 VanDerWaalsContact O-CA 3.28Å; Y940-C958 WeakPolarHBondContact O-CA 3.3Å; Y940-C958 PolarHBondContact O-SG 2.6Å; Y940-C958 VanDerWaalsContact O-SG 3.35Å; Y940-I959 HydrophobicContact CD2-CG2 4.11Å; Y940-I959 PolarHBondContact N-O 3.31Å; Y940-I959 PolarHBondContact O-N 2.98Å; Y940-Q961 VanDerWaalsContact CZ-OE1 3.24Å; Y940-Q961 PolarHBondContact OH-OE1 2.91Å; Y940-F964 HydrophobicContact CD2-CB 4.11Å; Y940-F964 HydrophobicContact CD2-CD1 4.41Å; Y940-F964 HydrophobicContact CD2-CD2 4.32Å; Y940-F964 HydrophobicContact CD2-CG 4.02Å; Y940-F964 HydrophobicContact CE2-CB 3.83Å; Y940-F964 AromaticContact CE2-CD1 3.57Å; Y940-F964 HydrophobicContact CE2-CD1 3.57Å; Y940-F964 HydrophobicContact CE2-CD2 4.25Å; Y940-F964 HydrophobicContact CE2-CE1 4.18Å; Y940-F964 AromaticContact CE2-CG 3.6Å; Y940-F964 HydrophobicContact CE2-CG 3.6Å; Y940-R985 CarbonylContact C-O 3.52Å; Y940-R985 WeakPolarHBondContact CA-O 3.48Å; Y940-R985 WeakPolarHBondContact CB-O 3.22Å; Y940-A986 HydrophobicContact CD1-CB 4.02Å; Y940-A986 HydrophobicContact CE1-CB 4.07Å
941	E	93.5	Very high	81.7	Confident	24 Å²	24	50.6 Å²	50.6	11%	0.112	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	135.5	165.6	-76.3	175.6	-129.3	0	0	109.1	I984 R985 L987 R992 W995	E941-I984 CarbonylContact O-C 3.58Å; E941-I984 WeakPolarHBondContact O-CA 3.41Å; E941-R985 HydrophobicContact CB-CG 3.93Å; E941-R985 PolarHBondContact N-O 2.84Å; E941-R985 PolarHBondContact O-N 2.76Å; E941-R985 IonicContact OE1-CZ 3.45Å; E941-R985 IonicContact OE1-NE 2.8Å; E941-R985 PolarHBondContact OE1-NE 2.94Å; E941-R985 IonicContact OE1-NH2 3.56Å; E941-R985 PolarHBondContact OE1-NH2 2.98Å; E941-R985 IonicContact OE2-CZ 3.74Å; E941-R985 IonicContact OE2-NE 3.57Å; E941-R985 PolarHBondContact OE2-NE 3.1Å; E941-R985 IonicContact OE2-NH2 3.4Å; E941-R985 PolarHBondContact OE2-NH2 3.24Å; E941-L987 HydrophobicContact CB-CD1 4.18Å; E941-L987 HydrophobicContact CG-CD1 3.85Å; E941-R992 IonicContact OE1-CZ 3.97Å; E941-R992 IonicContact OE1-NE 3.96Å; E941-R992 PolarHBondContact OE1-NE 3.39Å; E941-R992 IonicContact OE1-NH2 3.91Å; E941-W995 HydrophobicContact CB-CH2 3.97Å; E941-W995 HydrophobicContact CB-CZ3 4.49Å
942	I	92.6	Very high	80.4	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	129.5	170.9	-173.4	173.2	0	0	0	109.8	I925 R956 D957 F970 F982 R983 I984	I925-I942 HydrophobicContact CD1-CD1 3.82Å; I942-R956 VanDerWaalsContact O-CA 3.31Å; I942-R956 WeakPolarHBondContact O-CA 3.5Å; I942-D957 HydrophobicContact CG2-CB 3.99Å; I942-D957 PolarHBondContact N-O 2.83Å; I942-D957 PolarHBondContact O-N 2.96Å; I942-F970 HydrophobicContact CD1-CD1 4.14Å; I942-F970 HydrophobicContact CG2-CD1 4.12Å; I942-F970 HydrophobicContact CG2-CD2 4.43Å; I942-F970 HydrophobicContact CG2-CE1 3.86Å; I942-F970 HydrophobicContact CG2-CE2 4.18Å; I942-F970 HydrophobicContact CG2-CG 4.42Å; I942-F970 HydrophobicContact CG2-CZ 3.9Å; I942-F982 HydrophobicContact CD1-CD2 3.99Å; I942-F982 HydrophobicContact CG1-CD2 4.38Å; I942-R983 WeakPolarHBondContact CA-O 3.36Å; I942-I984 HydrophobicContact CD1-CG1 4.36Å; I942-I984 HydrophobicContact CG1-CG1 4.22Å
943	E	91.7	Very high	79.7	Confident	6 Å²	6	55.4 Å²	55.4	3%	0.028	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	128.6	177.6	-178.8	-177.7	83.8	0	0	109.7	P954 K955 R956 F982 R983 W995 Y998	E943-P954 HydrophobicContact CG-CB 3.67Å; E943-P954 HydrophobicContact CG-CG 3.69Å; E943-K955 CarbonylContact C-O 3.04Å; E943-K955 WeakPolarHBondContact CA-O 3.4Å; E943-R956 HydrophobicContact CB-CG 4.01Å; E943-R956 HydrophobicContact CG-CG 3.94Å; E943-R956 IonicContact OE2-CZ 3.45Å; E943-R956 IonicContact OE2-NE 3.29Å; E943-R956 PolarHBondContact OE2-NE 3.32Å; E943-R956 IonicContact OE2-NH2 2.7Å; E943-R956 PolarHBondContact OE2-NH2 3.18Å; E943-F982 CarbonylContact O-C 3.58Å; E943-F982 WeakPolarHBondContact O-CA 3.39Å; E943-R983 HydrophobicContact CB-CG 4.15Å; E943-R983 PolarHBondContact N-O 2.82Å; E943-R983 PolarHBondContact O-N 2.84Å; E943-R983 IonicContact OE1-CZ 3.19Å; E943-R983 IonicContact OE1-NE 2.81Å; E943-R983 PolarHBondContact OE1-NE 3.36Å; E943-R983 IonicContact OE1-NH2 2.73Å; E943-R983 PolarHBondContact OE1-NH2 2.87Å; E943-R983 IonicContact OE2-NH2 3.72Å; E943-W995 HydrophobicContact CB-CH2 3.84Å; E943-W995 HydrophobicContact CB-CZ3 3.97Å; E943-Y998 PolarHBondContact OE1-OH 2.89Å
944	Y	89.5	Confident	79.3	Confident	10 Å²	10	56.4 Å²	56.4	4%	0.039	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	147.7	-178	62.2	-84.1	0	0	0	114.1	P954 K955 D957 I972 L975 S981	Y944-P954 CarbonylContact O-C 3.52Å; Y944-P954 WeakPolarHBondContact O-CA 3.24Å; Y944-P954 WeakPolarHBondContact O-CB 3.3Å; Y944-K955 HydrophobicContact CD1-CB 4.36Å; Y944-K955 HydrophobicContact CD2-CB 4.19Å; Y944-K955 HydrophobicContact CE1-CB 3.93Å; Y944-K955 HydrophobicContact CE2-CB 3.74Å; Y944-K955 HydrophobicContact CE2-CD 3.56Å; Y944-K955 HydrophobicContact CE2-CG 4.22Å; Y944-K955 HydrophobicContact CG-CB 4.47Å; Y944-K955 PolarHBondContact N-O 3.39Å; Y944-K955 PolarHBondContact O-N 3.45Å; Y944-K955 WeakPolarHBondContact OH-CD 3.28Å; Y944-D957 HydrophobicContact CE1-CB 4.37Å; Y944-D957 WeakPolarHBondContact CE1-OD2 3.18Å; Y944-D957 VanDerWaalsContact CZ-OD2 3.26Å; Y944-D957 PolarHBondContact OH-OD2 3.43Å; Y944-I972 HydrophobicContact CD1-CD1 4.26Å; Y944-I972 HydrophobicContact CD2-CD1 4.31Å; Y944-I972 HydrophobicContact CD2-CG2 4.16Å; Y944-I972 HydrophobicContact CE1-CG2 4.15Å; Y944-I972 HydrophobicContact CE2-CG2 3.51Å; Y944-I972 HydrophobicContact CG-CD1 4.11Å; Y944-L975 HydrophobicContact CD2-CD2 4.28Å; Y944-L975 HydrophobicContact CE2-CD2 3.85Å; Y944-S981 CarbonylContact C-O 3.55Å; Y944-S981 WeakPolarHBondContact CA-O 3.36Å
945	G	84.4	Confident	79.2	Confident	10 Å²	10	62.1 Å²	62.1	10%	0.103	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	157	-177.3	0	0	0	0	0	113.8	Y980 S981	G945-Y980 CarbonylContact O-C 3.59Å; G945-Y980 VanDerWaalsContact O-CA 3.25Å; G945-Y980 WeakPolarHBondContact O-CA 3.39Å; G945-S981 PolarHBondContact N-O 3.17Å; G945-S981 PolarHBondContact O-N 3.34Å
946	R	78.6	Confident	79.5	Confident	105 Å²	105	68.6 Å²	68.6	40%	0.396	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	115.4	176.7	-173.9	-161.2	-175.4	114.9	0.5	109.3	P977 N979 Y980	R946-P977 PolarHBondContact NH1-O 3.14Å; R946-P977 PolarHBondContact NH2-O 2.93Å; R946-N979 WeakPolarHBondContact CA-O 3.3Å; R946-N979 VanDerWaalsContact CG-O 3.26Å; R946-N979 WeakPolarHBondContact CG-O 3.49Å; R946-Y980 HydrophobicContact CB-CD1 3.93Å; R946-Y980 HydrophobicContact CB-CE1 3.62Å; R946-Y980 HydrophobicContact CB-CE2 4.34Å; R946-Y980 HydrophobicContact CB-CG 4.4Å; R946-Y980 HydrophobicContact CG-CE1 4.4Å; R946-Y980 HydrophobicContact CG-CE2 4.26Å
947	N	67.7	Low	79.9	Confident	89 Å²	89	70.4 Å²	70.4	48%	0.476	34%	0.339	S	S	.	.	S	Bend	trans	46.8	85.6	-171.7	-65.1	8.1	0	0	0	112.2	D949 S950	N947-D949 PolarHBondContact O-N 3.07Å; N947-S950 WeakPolarHBondContact O-CB 3.33Å; N947-S950 PolarHBondContact O-N 3.28Å
948	L	62.9	Low	80.1	Confident	61 Å²	61	71.5 Å²	71.5	32%	0.319	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-10.8	-175.4	-70.9	171.6	0	0	0	115.2	S950 P954 Y998	L948-S950 VanDerWaalsContact C-N 3.27Å; L948-S950 PolarHBondContact O-N 3.24Å; L948-P954 HydrophobicContact CD2-CB 4.15Å; L948-Y998 HydrophobicContact CD1-CD1 3.79Å; L948-Y998 HydrophobicContact CD1-CE1 3.52Å; L948-Y998 HydrophobicContact CD1-CE2 4.28Å; L948-Y998 HydrophobicContact CD1-CG 4.29Å
949	D	59.8	Low	80.3	Confident	166 Å²	166	72 Å²	72	89%	0.888	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-5	173.2	-46	-68.7	0	0	0	114.1	N947	N947-D949 PolarHBondContact O-N 3.07Å
950	S	56	Low	80.3	Confident	68 Å²	68	72.5 Å²	72.5	48%	0.476	35%	0.354	S	S	.	.	S	Bend	trans	-95.3	149.5	179.3	-170	0	0	0	0	111.8	N947 L948 Q952	N947-S950 WeakPolarHBondContact O-CB 3.33Å; N947-S950 PolarHBondContact O-N 3.28Å; L948-S950 VanDerWaalsContact C-N 3.27Å; L948-S950 PolarHBondContact O-N 3.24Å; S950-Q952 PolarHBondContact O-N 3.17Å
951	E	62	Low	80.1	Confident	202 Å²	202	73.6 Å²	73.6	94%	0.944	36%	0.359	S	S	*	.	S	Bend	trans	-64.3	2.7	-175.2	-61.6	-170.5	138.2	0	0	115.6	K953	E951-K953 PolarHBondContact O-N 2.78Å
952	Q	60.9	Low	79.8	Confident	148 Å²	148	74.1 Å²	74.1	69%	0.692	37%	0.368	S	S	*	.	S	Bend	trans	-76	114.2	172.8	-68	-170.9	-9.3	0	0	110.5	S950	S950-Q952 PolarHBondContact O-N 3.17Å
953	K	71.8	Confident	79.6	Confident	195 Å²	195	76.7 Å²	76.7	85%	0.848	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-51.5	134.1	170.3	-68.6	-177.4	177.8	-179.8	0	110.2	E951	E951-K953 PolarHBondContact O-N 2.78Å
954	P	80.6	Confident	79.6	Confident	43 Å²	43	76.9 Å²	76.9	28%	0.279	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-62.1	147.6	175.1	27.8	-34.9	0	0	0	110.2	E943 Y944 L948	E943-P954 HydrophobicContact CG-CB 3.67Å; E943-P954 HydrophobicContact CG-CG 3.69Å; Y944-P954 CarbonylContact O-C 3.52Å; Y944-P954 WeakPolarHBondContact O-CA 3.24Å; Y944-P954 WeakPolarHBondContact O-CB 3.3Å; L948-P954 HydrophobicContact CD2-CB 4.15Å
955	K	85.1	Confident	79.5	Confident	119 Å²	119	82.1 Å²	82.1	52%	0.517	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	149.3	168.1	-72.9	-175.1	172.2	-171.1	0	109.2	E943 Y944	E943-K955 CarbonylContact C-O 3.04Å; E943-K955 WeakPolarHBondContact CA-O 3.4Å; Y944-K955 HydrophobicContact CD1-CB 4.36Å; Y944-K955 HydrophobicContact CD2-CB 4.19Å; Y944-K955 HydrophobicContact CE1-CB 3.93Å; Y944-K955 HydrophobicContact CE2-CB 3.74Å; Y944-K955 HydrophobicContact CE2-CD 3.56Å; Y944-K955 HydrophobicContact CE2-CG 4.22Å; Y944-K955 HydrophobicContact CG-CB 4.47Å; Y944-K955 PolarHBondContact N-O 3.39Å; Y944-K955 PolarHBondContact O-N 3.45Å; Y944-K955 WeakPolarHBondContact OH-CD 3.28Å
956	R	89	Confident	79.7	Confident	144 Å²	144	90.4 Å²	90.4	54%	0.543	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	124.4	169.9	-69.8	-175.1	-179	172.4	0.4	108.7	I942 E943	I942-R956 VanDerWaalsContact O-CA 3.31Å; I942-R956 WeakPolarHBondContact O-CA 3.5Å; E943-R956 HydrophobicContact CB-CG 4.01Å; E943-R956 HydrophobicContact CG-CG 3.94Å; E943-R956 IonicContact OE2-CZ 3.45Å; E943-R956 IonicContact OE2-NE 3.29Å; E943-R956 PolarHBondContact OE2-NE 3.32Å; E943-R956 IonicContact OE2-NH2 2.7Å; E943-R956 PolarHBondContact OE2-NH2 3.18Å
957	D	90.9	Very high	80	Confident	63 Å²	63	89.4 Å²	89.4	34%	0.337	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	166.9	170	-63.2	-32.9	0	0	0	108.8	I942 Y944 F970	I942-D957 HydrophobicContact CG2-CB 3.99Å; I942-D957 PolarHBondContact N-O 2.83Å; I942-D957 PolarHBondContact O-N 2.96Å; Y944-D957 HydrophobicContact CE1-CB 4.37Å; Y944-D957 WeakPolarHBondContact CE1-OD2 3.18Å; Y944-D957 VanDerWaalsContact CZ-OD2 3.26Å; Y944-D957 PolarHBondContact OH-OD2 3.43Å; D957-F970 HydrophobicContact CB-CE1 4.39Å; D957-F970 HydrophobicContact CB-CE2 4.17Å; D957-F970 HydrophobicContact CB-CZ 3.53Å
958	C	92.9	Very high	81.1	Confident	43 Å²	43	91.4 Å²	91.4	29%	0.291	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	150	179	177.3	0	0	0	0	109.7	C698 Y940	C698-C958 WeakPolarHBondContact CA-SG 3.45Å; C698-C958 HydrophobicContact CB-CB 3.6Å; C698-C958 WeakPolarHBondContact CB-SG 3.31Å; C698-C958 WeakPolarHBondContact SG-CB 3.37Å; C698-C958 CovalentContact SG-SG 2.04Å; C698-C958 PolarHBondContact SG-SG 3.47Å; Y940-C958 VanDerWaalsContact O-CA 3.28Å; Y940-C958 WeakPolarHBondContact O-CA 3.3Å; Y940-C958 PolarHBondContact O-SG 2.6Å; Y940-C958 VanDerWaalsContact O-SG 3.35Å
959	I	92.3	Very high	82.3	Confident	13 Å²	13	88.5 Å²	88.5	7%	0.067	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	134.3	173.3	-171.5	167.3	0	0	0	109.8	C698 A939 Y940 D963 F964 G969 F970	C698-I959 PolarHBondContact SG-N 3.39Å; A939-I959 CarbonylContact C-O 3.58Å; A939-I959 VanDerWaalsContact CA-O 3.29Å; A939-I959 WeakPolarHBondContact CA-O 3.5Å; A939-I959 WeakPolarHBondContact CB-O 3.34Å; Y940-I959 HydrophobicContact CD2-CG2 4.11Å; Y940-I959 PolarHBondContact N-O 3.31Å; Y940-I959 PolarHBondContact O-N 2.98Å; I959-D963 HydrophobicContact CD1-CB 4.19Å; I959-D963 HydrophobicContact CG1-CB 3.7Å; I959-F964 HydrophobicContact CD1-CB 4.14Å; I959-F964 HydrophobicContact CD1-CD2 4.43Å; I959-F964 HydrophobicContact CG1-CB 4.2Å; I959-F964 HydrophobicContact CG2-CB 4.34Å; I959-F964 HydrophobicContact CG2-CD2 4.26Å; I959-G969 WeakPolarHBondContact CD1-O 3.21Å; I959-F970 HydrophobicContact CB-CD2 3.76Å; I959-F970 HydrophobicContact CB-CE2 4.12Å; I959-F970 HydrophobicContact CD1-CD2 3.96Å; I959-F970 HydrophobicContact CG1-CD2 4.43Å; I959-F970 HydrophobicContact CG2-CD2 3.81Å; I959-F970 HydrophobicContact CG2-CE2 4.49Å
960	T	91.3	Very high	83.8	Confident	10 Å²	10	81.5 Å²	81.5	6%	0.061	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	157.3	176.4	76.3	0	0	0	0	110.3	N696 A962 D963 F964	N696-T960 WeakPolarHBondContact OD1-CG2 3.31Å; T960-A962 PolarHBondContact O-N 3.17Å; T960-A962 PolarHBondContact OG1-N 2.62Å; T960-D963 PolarHBondContact O-N 3.1Å; T960-D963 WeakPolarHBondContact OG1-CB 3.33Å; T960-D963 VanDerWaalsContact OG1-CG 3.26Å; T960-D963 PolarHBondContact OG1-N 2.82Å; T960-D963 PolarHBondContact OG1-OD2 3.37Å; T960-F964 WeakPolarHBondContact O-CB 3.34Å; T960-F964 PolarHBondContact O-N 3.06Å
961	Q	89.1	Confident	85.3	Confident	25 Å²	25	80.3 Å²	80.3	12%	0.117	38%	0.384	C	S	.	.	H	α-helix	trans	-55.9	-40.2	172.7	177.1	62.7	12.5	0	0	111.2	V938 Y940 D963 F964 E965	V938-Q961 PolarHBondContact O-N 3.17Å; Y940-Q961 VanDerWaalsContact CZ-OE1 3.24Å; Y940-Q961 PolarHBondContact OH-OE1 2.91Å; Q961-D963 PolarHBondContact O-N 3.3Å; Q961-F964 PolarHBondContact O-N 3.25Å; Q961-E965 HydrophobicContact CG-CG 4.49Å; Q961-E965 PolarHBondContact NE2-OE1 3.28Å; Q961-E965 WeakPolarHBondContact O-CB 3.35Å; Q961-E965 WeakPolarHBondContact O-CG 3.48Å; Q961-E965 PolarHBondContact O-N 3.36Å
962	A	86.9	Confident	86.5	Confident	36 Å²	36	70.8 Å²	70.8	30%	0.298	34%	0.34	S	S	.	.	H	α-helix	trans	-69.5	-30.9	-179.5	0	0	0	0	0	113.7	T960 R966	T960-A962 PolarHBondContact O-N 3.17Å; T960-A962 PolarHBondContact OG1-N 2.62Å; A962-R966 WeakPolarHBondContact O-CB 3.4Å; A962-R966 PolarHBondContact O-N 2.67Å
963	D	88.7	Confident	87.6	Confident	55 Å²	55	71.7 Å²	71.7	29%	0.294	34%	0.337	S	S	.	.	H	α-helix	trans	-80.9	-34.5	173.6	-65.5	-56.1	0	0	0	111.6	I959 T960 Q961 R966 N967	I959-D963 HydrophobicContact CD1-CB 4.19Å; I959-D963 HydrophobicContact CG1-CB 3.7Å; T960-D963 PolarHBondContact O-N 3.1Å; T960-D963 WeakPolarHBondContact OG1-CB 3.33Å; T960-D963 VanDerWaalsContact OG1-CG 3.26Å; T960-D963 PolarHBondContact OG1-N 2.82Å; T960-D963 PolarHBondContact OG1-OD2 3.37Å; Q961-D963 PolarHBondContact O-N 3.3Å; D963-R966 PolarHBondContact O-N 2.92Å; D963-N967 VanDerWaalsContact O-CB 3.23Å; D963-N967 WeakPolarHBondContact O-CB 3.41Å; D963-N967 PolarHBondContact O-N 2.89Å; D963-N967 PolarHBondContact O-ND2 2.96Å
964	F	91.4	Very high	87.8	Confident	10 Å²	10	69 Å²	69	4%	0.044	33%	0.332	C	S	.	.	H	α-helix	trans	-64.6	-48.3	175	-176.6	-101.3	0	0	0	111.4	W927 Y940 I959 T960 Q961 R966 N967 L968 G969	W927-F964 AromaticContact CD1-CZ 3.74Å; W927-F964 AromaticContact CD2-CE2 3.57Å; W927-F964 HydrophobicContact CD2-CE2 3.57Å; W927-F964 AromaticContact CD2-CZ 3.53Å; W927-F964 HydrophobicContact CD2-CZ 3.53Å; W927-F964 AromaticContact CE2-CE2 3.26Å; W927-F964 AromaticContact CE2-CZ 3.4Å; W927-F964 AromaticContact CE3-CE2 3.8Å; W927-F964 HydrophobicContact CE3-CE2 3.8Å; W927-F964 HydrophobicContact CE3-CZ 4.12Å; W927-F964 HydrophobicContact CG-CE2 4.31Å; W927-F964 AromaticContact CG-CZ 3.77Å; W927-F964 HydrophobicContact CG-CZ 3.77Å; W927-F964 HydrophobicContact CH2-CD2 4.02Å; W927-F964 AromaticContact CH2-CE2 3.56Å; W927-F964 HydrophobicContact CH2-CE2 3.56Å; W927-F964 HydrophobicContact CH2-CZ 4.48Å; W927-F964 AromaticContact CZ2-CD2 3.67Å; W927-F964 HydrophobicContact CZ2-CD2 3.67Å; W927-F964 AromaticContact CZ2-CE2 3.26Å; W927-F964 HydrophobicContact CZ2-CE2 3.26Å; W927-F964 AromaticContact CZ2-CZ 3.92Å; W927-F964 HydrophobicContact CZ2-CZ 3.92Å; W927-F964 AromaticContact CZ3-CE2 3.81Å; W927-F964 HydrophobicContact CZ3-CE2 3.81Å; W927-F964 AromaticContact NE1-CE1 3.97Å; W927-F964 AromaticContact NE1-CE2 3.81Å; W927-F964 AromaticContact NE1-CZ 3.49Å; W927-F964 WeakPolarHBondContact O-CE1 3.19Å; W927-F964 VanDerWaalsContact O-CZ 3.3Å; W927-F964 WeakPolarHBondContact O-CZ 3.3Å; Y940-F964 HydrophobicContact CD2-CB 4.11Å; Y940-F964 HydrophobicContact CD2-CD1 4.41Å; Y940-F964 HydrophobicContact CD2-CD2 4.32Å; Y940-F964 HydrophobicContact CD2-CG 4.02Å; Y940-F964 HydrophobicContact CE2-CB 3.83Å; Y940-F964 AromaticContact CE2-CD1 3.57Å; Y940-F964 HydrophobicContact CE2-CD1 3.57Å; Y940-F964 HydrophobicContact CE2-CD2 4.25Å; Y940-F964 HydrophobicContact CE2-CE1 4.18Å; Y940-F964 AromaticContact CE2-CG 3.6Å; Y940-F964 HydrophobicContact CE2-CG 3.6Å; I959-F964 HydrophobicContact CD1-CB 4.14Å; I959-F964 HydrophobicContact CD1-CD2 4.43Å; I959-F964 HydrophobicContact CG1-CB 4.2Å; I959-F964 HydrophobicContact CG2-CB 4.34Å; I959-F964 HydrophobicContact CG2-CD2 4.26Å; T960-F964 WeakPolarHBondContact O-CB 3.34Å; T960-F964 PolarHBondContact O-N 3.06Å; Q961-F964 PolarHBondContact O-N 3.25Å; F964-R966 VanDerWaalsContact C-N 3.31Å; F964-R966 PolarHBondContact O-N 2.99Å; F964-N967 PolarHBondContact O-N 3.43Å; F964-L968 WeakPolarHBondContact O-CA 3.2Å; F964-L968 PolarHBondContact O-N 2.86Å; F964-G969 PolarHBondContact O-N 2.92Å
965	E	88.1	Confident	87.7	Confident	120 Å²	120	67.1 Å²	67.1	56%	0.561	32%	0.319	S	S	*	.	H	α-helix	trans	-58.4	-40.9	172.4	-74.7	174.9	-175.9	0	0	112.1	Q961	Q961-E965 HydrophobicContact CG-CG 4.49Å; Q961-E965 PolarHBondContact NE2-OE1 3.28Å; Q961-E965 WeakPolarHBondContact O-CB 3.35Å; Q961-E965 WeakPolarHBondContact O-CG 3.48Å; Q961-E965 PolarHBondContact O-N 3.36Å
966	R	88.1	Confident	87.3	Confident	184 Å²	184	64.8 Å²	64.8	69%	0.694	32%	0.316	S	S	*	.	H	α-helix	trans	-68.8	-38.2	179.7	-176.8	-174.7	-55.3	-175	6.1	113.1	A962 D963 F964	A962-R966 WeakPolarHBondContact O-CB 3.4Å; A962-R966 PolarHBondContact O-N 2.67Å; D963-R966 PolarHBondContact O-N 2.92Å; F964-R966 VanDerWaalsContact C-N 3.31Å; F964-R966 PolarHBondContact O-N 2.99Å
967	N	85.7	Confident	86.8	Confident	84 Å²	84	59.2 Å²	59.2	45%	0.449	30%	0.299	S	S	.	.	H	α-helix	trans	-93.6	-7.4	-175.7	-62.4	-32.2	0	0	0	112.9	F924 D963 F964 G969	F924-N967 WeakPolarHBondContact CE2-O 3.29Å; F924-N967 WeakPolarHBondContact CZ-O 3.37Å; D963-N967 VanDerWaalsContact O-CB 3.23Å; D963-N967 WeakPolarHBondContact O-CB 3.41Å; D963-N967 PolarHBondContact O-N 2.89Å; D963-N967 PolarHBondContact O-ND2 2.96Å; F964-N967 PolarHBondContact O-N 3.43Å; N967-G969 WeakPolarHBondContact CB-O 3.47Å; N967-G969 PolarHBondContact O-N 3.03Å
968	L	89.4	Confident	86.3	Confident	130 Å²	130	56.7 Å²	56.7	68%	0.681	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	21.7	-172.4	-54.7	174.1	0	0	0	113.7	F924 S926 F964	F924-L968 HydrophobicContact CZ-CB 4.41Å; F924-L968 WeakPolarHBondContact CZ-O 3.39Å; S926-L968 WeakPolarHBondContact CB-O 3.35Å; S926-L968 PolarHBondContact OG-O 3.03Å; F964-L968 WeakPolarHBondContact O-CA 3.2Å; F964-L968 PolarHBondContact O-N 2.86Å
969	G	89.5	Confident	85.9	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.293	C	S	.	.	S	Bend	trans	158.1	-170.8	-170	0	0	0	0	0	114.1	I925 I959 F964 N967	I925-G969 CarbonylContact O-C 3.57Å; I925-G969 WeakPolarHBondContact O-CA 3.44Å; I959-G969 WeakPolarHBondContact CD1-O 3.21Å; F964-G969 PolarHBondContact O-N 2.92Å; N967-G969 WeakPolarHBondContact CB-O 3.47Å; N967-G969 PolarHBondContact O-N 3.03Å
970	F	90.7	Very high	85.7	Confident	20 Å²	20	58.5 Å²	58.5	9%	0.088	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	146	176.6	-172.2	-92.2	0	0	0	110.6	F924 I925 W927 I942 D957 I959 I972	F924-F970 CarbonylContact C-O 3.46Å; F924-F970 WeakPolarHBondContact CA-O 3.29Å; I925-F970 PolarHBondContact N-O 2.89Å; I925-F970 PolarHBondContact O-N 2.66Å; W927-F970 HydrophobicContact CH2-CB 3.88Å; W927-F970 HydrophobicContact CZ3-CB 4.03Å; I942-F970 HydrophobicContact CD1-CD1 4.14Å; I942-F970 HydrophobicContact CG2-CD1 4.12Å; I942-F970 HydrophobicContact CG2-CD2 4.43Å; I942-F970 HydrophobicContact CG2-CE1 3.86Å; I942-F970 HydrophobicContact CG2-CE2 4.18Å; I942-F970 HydrophobicContact CG2-CG 4.42Å; I942-F970 HydrophobicContact CG2-CZ 3.9Å; D957-F970 HydrophobicContact CB-CE1 4.39Å; D957-F970 HydrophobicContact CB-CE2 4.17Å; D957-F970 HydrophobicContact CB-CZ 3.53Å; I959-F970 HydrophobicContact CB-CD2 3.76Å; I959-F970 HydrophobicContact CB-CE2 4.12Å; I959-F970 HydrophobicContact CD1-CD2 3.96Å; I959-F970 HydrophobicContact CG1-CD2 4.43Å; I959-F970 HydrophobicContact CG2-CD2 3.81Å; I959-F970 HydrophobicContact CG2-CE2 4.49Å; F970-I972 HydrophobicContact CD1-CG1 3.98Å; F970-I972 HydrophobicContact CE1-CB 4.49Å; F970-I972 HydrophobicContact CE1-CG1 3.82Å
971	V	88.1	Confident	85.6	Confident	43 Å²	43	59.1 Å²	59.1	26%	0.261	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	111.4	176.1	-176.9	0	0	0	0	110.8	A916 D922 R923 F924 R973	A916-V971 HydrophobicContact CB-CG1 4.2Å; D922-V971 HydrophobicContact CB-CG1 4.23Å; R923-V971 CarbonylContact O-C 3.47Å; R923-V971 WeakPolarHBondContact O-CA 2.96Å; F924-V971 HydrophobicContact CB-CG2 4.38Å; F924-V971 HydrophobicContact CD2-CG2 3.59Å; F924-V971 HydrophobicContact CE2-CG2 4.34Å; F924-V971 HydrophobicContact CG-CG2 4.37Å; V971-R973 HydrophobicContact CG1-CG 3.91Å
972	I	85.8	Confident	85.7	Confident	2 Å²	2	58 Å²	58	1%	0.01	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	125.8	167.1	-40.1	172.5	0	0	0	108.1	D922 R923 I925 Y944 F970 L975 L1001	D922-I972 WeakPolarHBondContact CA-O 3.3Å; R923-I972 PolarHBondContact N-O 3.36Å; R923-I972 PolarHBondContact O-N 3.38Å; I925-I972 HydrophobicContact CD1-CD1 3.63Å; I925-I972 HydrophobicContact CD1-CG1 4.01Å; Y944-I972 HydrophobicContact CD1-CD1 4.26Å; Y944-I972 HydrophobicContact CD2-CD1 4.31Å; Y944-I972 HydrophobicContact CD2-CG2 4.16Å; Y944-I972 HydrophobicContact CE1-CG2 4.15Å; Y944-I972 HydrophobicContact CE2-CG2 3.51Å; Y944-I972 HydrophobicContact CG-CD1 4.11Å; F970-I972 HydrophobicContact CD1-CG1 3.98Å; F970-I972 HydrophobicContact CE1-CB 4.49Å; F970-I972 HydrophobicContact CE1-CG1 3.82Å; I972-L975 HydrophobicContact CB-CD1 4.02Å; I972-L975 HydrophobicContact CB-CG 4.47Å; I972-L975 HydrophobicContact CD1-CD1 4.49Å; I972-L975 HydrophobicContact CG2-CD1 3.67Å; I972-L975 HydrophobicContact CG2-CD2 3.83Å; I972-L975 HydrophobicContact CG2-CG 3.72Å; I972-L1001 HydrophobicContact CD1-CD2 4.24Å
973	R	84.7	Confident	86	Confident	167 Å²	167	58.8 Å²	58.8	63%	0.63	29%	0.288	S	S	*	.			trans	-110.8	158.5	-174.9	-61.2	-174.9	-173	-145.1	0.8	113.9	D922 V971 L975	D922-R973 WeakPolarHBondContact OD1-CA 3.44Å; V971-R973 HydrophobicContact CG1-CG 3.91Å; R973-L975 PolarHBondContact O-N 3.29Å
974	D	76.1	Confident	86.2	Confident	139 Å²	139	56.1 Å²	56.1	74%	0.743	27%	0.274	S	S	*	.	S	Bend	trans	52.5	31.5	167.1	-66	-61.6	0	0	0	114.3	D922 P976	D922-D974 PolarHBondContact OD1-N 3.08Å; D974-P976 WeakPolarHBondContact O-CD 3.23Å
975	L	78.7	Confident	86.4	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.01	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-69.6	128.6	-179	-76.5	177.2	0	0	0	111.1	N921 Y944 I972 R973 Y980 L1001 I1003	N921-L975 WeakPolarHBondContact CB-O 3.34Å; N921-L975 PolarHBondContact ND2-O 3.44Å; Y944-L975 HydrophobicContact CD2-CD2 4.28Å; Y944-L975 HydrophobicContact CE2-CD2 3.85Å; I972-L975 HydrophobicContact CB-CD1 4.02Å; I972-L975 HydrophobicContact CB-CG 4.47Å; I972-L975 HydrophobicContact CD1-CD1 4.49Å; I972-L975 HydrophobicContact CG2-CD1 3.67Å; I972-L975 HydrophobicContact CG2-CD2 3.83Å; I972-L975 HydrophobicContact CG2-CG 3.72Å; R973-L975 PolarHBondContact O-N 3.29Å; L975-Y980 HydrophobicContact CD2-CD1 4.31Å; L975-Y980 HydrophobicContact CD2-CE1 3.8Å; L975-L1001 HydrophobicContact CD1-CD1 4.24Å; L975-I1003 HydrophobicContact CB-CD1 3.26Å; L975-I1003 HydrophobicContact CD1-CD1 3.48Å; L975-I1003 VanDerWaalsContact CD1-CD1 3.48Å; L975-I1003 HydrophobicContact CG-CD1 4.01Å
976	P	77	Confident	86.6	Confident	71 Å²	71	51.8 Å²	51.8	46%	0.461	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-60	140.6	172.8	-27.4	35.6	0	0	0	112.8	D974 G978 Y980	D974-P976 WeakPolarHBondContact O-CD 3.23Å; P976-G978 PolarHBondContact O-N 3.23Å; P976-Y980 WeakPolarHBondContact CD-OH 3.46Å; P976-Y980 VanDerWaalsContact O-CE2 3.28Å; P976-Y980 WeakPolarHBondContact O-CE2 3.33Å; P976-Y980 PolarHBondContact O-OH 3.36Å; P976-Y980 VanDerWaalsContact O-OH 3.08Å
977	P	77.5	Confident	86.8	Confident	27 Å²	27	43.1 Å²	43.1	18%	0.175	22%	0.219	C	C	.	.	S	Bend	trans	-50.9	122.3	178.6	-31.1	38.9	0	0	0	113.5	R946 I1003 A1004 D1005	R946-P977 PolarHBondContact NH1-O 3.14Å; R946-P977 PolarHBondContact NH2-O 2.93Å; P977-I1003 CarbonylContact C-O 3.54Å; P977-I1003 WeakPolarHBondContact CA-O 3.27Å; P977-A1004 VanDerWaalsContact CG-O 3.29Å; P977-A1004 WeakPolarHBondContact CG-O 3.45Å; P977-D1005 HydrophobicContact CB-CB 4.36Å; P977-D1005 WeakPolarHBondContact CB-OD1 3.31Å; P977-D1005 HydrophobicContact CG-CB 4.4Å; P977-D1005 WeakPolarHBondContact CG-OD1 3.23Å
978	G	80.3	Confident	86.9	Confident	10 Å²	10	39.1 Å²	39.1	10%	0.103	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.1	-179.6	-170.9	0	0	0	0	0	114.6	P976 I1003	P976-G978 PolarHBondContact O-N 3.23Å; G978-I1003 PolarHBondContact N-O 3.15Å; G978-I1003 PolarHBondContact O-N 3.15Å
979	N	85.5	Confident	86.7	Confident	75 Å²	75	36.2 Å²	36.2	40%	0.401	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	132.6	174.9	-172.3	28.4	0	0	0	110.2	R946 L1001 L1002	R946-N979 WeakPolarHBondContact CA-O 3.3Å; R946-N979 VanDerWaalsContact CG-O 3.26Å; R946-N979 WeakPolarHBondContact CG-O 3.49Å; N979-L1001 PolarHBondContact OD1-O 2.94Å; N979-L1002 HydrophobicContact CB-CD1 4.01Å
980	Y	86.8	Confident	86.5	Confident	19 Å²	19	37.3 Å²	37.3	8%	0.075	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	155.6	-174.5	-71.3	-102.5	0	0	0	111.3	G945 R946 L975 P976 T1000 L1001 I1003	G945-Y980 CarbonylContact O-C 3.59Å; G945-Y980 VanDerWaalsContact O-CA 3.25Å; G945-Y980 WeakPolarHBondContact O-CA 3.39Å; R946-Y980 HydrophobicContact CB-CD1 3.93Å; R946-Y980 HydrophobicContact CB-CE1 3.62Å; R946-Y980 HydrophobicContact CB-CE2 4.34Å; R946-Y980 HydrophobicContact CB-CG 4.4Å; R946-Y980 HydrophobicContact CG-CE1 4.4Å; R946-Y980 HydrophobicContact CG-CE2 4.26Å; L975-Y980 HydrophobicContact CD2-CD1 4.31Å; L975-Y980 HydrophobicContact CD2-CE1 3.8Å; P976-Y980 WeakPolarHBondContact CD-OH 3.46Å; P976-Y980 VanDerWaalsContact O-CE2 3.28Å; P976-Y980 WeakPolarHBondContact O-CE2 3.33Å; P976-Y980 PolarHBondContact O-OH 3.36Å; P976-Y980 VanDerWaalsContact O-OH 3.08Å; Y980-T1000 CarbonylContact O-C 3.54Å; Y980-T1000 VanDerWaalsContact O-CA 3.29Å; Y980-T1000 WeakPolarHBondContact O-CA 3.21Å; Y980-L1001 HydrophobicContact CD2-CD1 4.1Å; Y980-L1001 HydrophobicContact CG-CD1 4.18Å; Y980-L1001 PolarHBondContact N-O 3.11Å; Y980-L1001 PolarHBondContact O-N 2.82Å; Y980-I1003 HydrophobicContact CD2-CD1 4.45Å; Y980-I1003 HydrophobicContact CE2-CD1 4.42Å
981	S	89	Confident	86.2	Confident	23 Å²	23	38.7 Å²	38.7	16%	0.161	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	145.8	170.1	-52.7	0	0	0	0	110.5	Y944 G945 F999	Y944-S981 CarbonylContact C-O 3.55Å; Y944-S981 WeakPolarHBondContact CA-O 3.36Å; G945-S981 PolarHBondContact N-O 3.17Å; G945-S981 PolarHBondContact O-N 3.34Å; S981-F999 CarbonylContact C-O 3.55Å; S981-F999 WeakPolarHBondContact CA-O 3.36Å
982	F	91	Very high	86.3	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	157.6	-179.9	75.4	-90.5	0	0	0	113.5	V911 V913 I925 I942 E943 I984 Y998 F999 L1001	V911-F982 HydrophobicContact CG1-CE2 4.25Å; V911-F982 HydrophobicContact CG1-CZ 4.37Å; V913-F982 HydrophobicContact CG2-CE1 3.76Å; V913-F982 HydrophobicContact CG2-CZ 3.52Å; I925-F982 HydrophobicContact CD1-CD1 4.26Å; I925-F982 HydrophobicContact CD1-CD2 4.14Å; I925-F982 HydrophobicContact CD1-CE1 4.05Å; I925-F982 HydrophobicContact CD1-CE2 3.95Å; I925-F982 HydrophobicContact CD1-CG 4.3Å; I925-F982 HydrophobicContact CD1-CZ 3.89Å; I925-F982 HydrophobicContact CG1-CZ 4.41Å; I925-F982 HydrophobicContact CG2-CE2 3.79Å; I925-F982 HydrophobicContact CG2-CZ 3.9Å; I942-F982 HydrophobicContact CD1-CD2 3.99Å; I942-F982 HydrophobicContact CG1-CD2 4.38Å; E943-F982 CarbonylContact O-C 3.58Å; E943-F982 WeakPolarHBondContact O-CA 3.39Å; F982-I984 HydrophobicContact CD2-CG1 4.27Å; F982-I984 HydrophobicContact CE2-CD1 4.04Å; F982-I984 HydrophobicContact CE2-CG1 4.3Å; F982-Y998 CarbonylContact O-C 3.55Å; F982-Y998 WeakPolarHBondContact O-CA 3.44Å; F982-F999 HydrophobicContact CD1-CB 3.96Å; F982-F999 HydrophobicContact CD2-CB 4.34Å; F982-F999 HydrophobicContact CD2-CD2 4.35Å; F982-F999 HydrophobicContact CE1-CB 3.46Å; F982-F999 VanDerWaalsContact CE1-CB 3.46Å; F982-F999 HydrophobicContact CE1-CG 4.43Å; F982-F999 HydrophobicContact CE2-CB 3.87Å; F982-F999 AromaticContact CE2-CD2 3.82Å; F982-F999 HydrophobicContact CE2-CD2 3.82Å; F982-F999 HydrophobicContact CE2-CG 4.08Å; F982-F999 HydrophobicContact CG-CB 4.37Å; F982-F999 HydrophobicContact CZ-CB 3.4Å; F982-F999 VanDerWaalsContact CZ-CB 3.4Å; F982-F999 HydrophobicContact CZ-CD2 4.13Å; F982-F999 AromaticContact CZ-CG 3.9Å; F982-F999 HydrophobicContact CZ-CG 3.9Å; F982-F999 PolarHBondContact N-O 3.1Å; F982-F999 PolarHBondContact O-N 2.95Å; F982-L1001 HydrophobicContact CD1-CD2 4.03Å; F982-L1001 HydrophobicContact CE1-CD2 4.26Å
983	R	93.2	Very high	86.4	Confident	53 Å²	53	41.7 Å²	41.7	20%	0.2	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	159.3	172.5	61.3	173.1	177	174.5	-8.4	111.4	I942 E943 W995 Y998	I942-R983 WeakPolarHBondContact CA-O 3.36Å; E943-R983 HydrophobicContact CB-CG 4.15Å; E943-R983 PolarHBondContact N-O 2.82Å; E943-R983 PolarHBondContact O-N 2.84Å; E943-R983 IonicContact OE1-CZ 3.19Å; E943-R983 IonicContact OE1-NE 2.81Å; E943-R983 PolarHBondContact OE1-NE 3.36Å; E943-R983 IonicContact OE1-NH2 2.73Å; E943-R983 PolarHBondContact OE1-NH2 2.87Å; E943-R983 IonicContact OE2-NH2 3.72Å; R983-W995 HydrophobicContact CB-CE3 4.34Å; R983-W995 HydrophobicContact CG-CD2 4.37Å; R983-W995 HydrophobicContact CG-CE3 3.66Å; R983-W995 HydrophobicContact CG-CZ3 4.03Å; R983-Y998 HydrophobicContact CB-CD1 3.88Å; R983-Y998 HydrophobicContact CB-CE1 4.06Å; R983-Y998 HydrophobicContact CB-CG 4.43Å; R983-Y998 HydrophobicContact CG-CD1 3.9Å; R983-Y998 HydrophobicContact CG-CE1 3.54Å; R983-Y998 VanDerWaalsContact CZ-OH 3.24Å; R983-Y998 PolarHBondContact NE-OH 3.06Å; R983-Y998 VanDerWaalsContact NE-OH 3.13Å; R983-Y998 PolarHBondContact NH2-OH 3.27Å
984	I	94.4	Very high	86.7	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	155.8	-170.9	-50.2	156.2	0	0	0	109.6	I906 V911 I925 W927 E941 I942 F982 W995 T996	I906-I984 HydrophobicContact CD1-CB 4.33Å; I906-I984 HydrophobicContact CD1-CG2 3.7Å; V911-I984 HydrophobicContact CG1-CD1 3.95Å; V911-I984 HydrophobicContact CG2-CD1 4.23Å; I925-I984 HydrophobicContact CG2-CD1 4.37Å; W927-I984 HydrophobicContact CD2-CD1 3.88Å; W927-I984 HydrophobicContact CD2-CG2 4.31Å; W927-I984 HydrophobicContact CE3-CD1 3.45Å; W927-I984 VanDerWaalsContact CE3-CD1 3.45Å; W927-I984 HydrophobicContact CE3-CG1 4.44Å; W927-I984 HydrophobicContact CH2-CD1 4.36Å; W927-I984 HydrophobicContact CH2-CG2 4.04Å; W927-I984 HydrophobicContact CZ2-CG2 3.72Å; W927-I984 HydrophobicContact CZ3-CD1 3.72Å; W927-I984 HydrophobicContact CZ3-CG1 4.29Å; W927-I984 HydrophobicContact CZ3-CG2 4.47Å; E941-I984 CarbonylContact O-C 3.58Å; E941-I984 WeakPolarHBondContact O-CA 3.41Å; I942-I984 HydrophobicContact CD1-CG1 4.36Å; I942-I984 HydrophobicContact CG1-CG1 4.22Å; F982-I984 HydrophobicContact CD2-CG1 4.27Å; F982-I984 HydrophobicContact CE2-CD1 4.04Å; F982-I984 HydrophobicContact CE2-CG1 4.3Å; I984-W995 WeakPolarHBondContact O-CA 3.39Å; I984-T996 HydrophobicContact CB-CG2 4.32Å; I984-T996 PolarHBondContact N-OG1 2.99Å; I984-T996 WeakPolarHBondContact O-CG2 3.19Å; I984-T996 PolarHBondContact O-N 3.37Å
985	R	94.2	Very high	87.5	Confident	37 Å²	37	33.4 Å²	33.4	14%	0.14	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	152.6	161.7	62.5	175	172.6	-177.8	-1.4	112.4	Y940 E941 L987 S994 W995	Y940-R985 CarbonylContact C-O 3.52Å; Y940-R985 WeakPolarHBondContact CA-O 3.48Å; Y940-R985 WeakPolarHBondContact CB-O 3.22Å; E941-R985 HydrophobicContact CB-CG 3.93Å; E941-R985 PolarHBondContact N-O 2.84Å; E941-R985 PolarHBondContact O-N 2.76Å; E941-R985 IonicContact OE1-CZ 3.45Å; E941-R985 IonicContact OE1-NE 2.8Å; E941-R985 PolarHBondContact OE1-NE 2.94Å; E941-R985 IonicContact OE1-NH2 3.56Å; E941-R985 PolarHBondContact OE1-NH2 2.98Å; E941-R985 IonicContact OE2-CZ 3.74Å; E941-R985 IonicContact OE2-NE 3.57Å; E941-R985 PolarHBondContact OE2-NE 3.1Å; E941-R985 IonicContact OE2-NH2 3.4Å; E941-R985 PolarHBondContact OE2-NH2 3.24Å; R985-L987 HydrophobicContact CG-CD1 4.33Å; R985-S994 VanDerWaalsContact CB-O 3.23Å; R985-S994 WeakPolarHBondContact CB-O 3.34Å; R985-W995 HydrophobicContact CB-CD2 4.1Å; R985-W995 HydrophobicContact CB-CE3 3.93Å; R985-W995 HydrophobicContact CB-CG 4.49Å; R985-W995 HydrophobicContact CB-CZ3 4.37Å; R985-W995 HydrophobicContact CG-CD2 3.97Å; R985-W995 HydrophobicContact CG-CE3 3.83Å; R985-W995 HydrophobicContact CG-CH2 4.01Å; R985-W995 HydrophobicContact CG-CZ2 4.14Å; R985-W995 HydrophobicContact CG-CZ3 3.85Å
986	A	93	Very high	88.1	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.008	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	151.5	173.8	0	0	0	0	0	111.8	D904 I906 P930 L937 Y940 G993	D904-A986 WeakPolarHBondContact O-CB 3.37Å; I906-A986 HydrophobicContact CD1-CB 4.07Å; I906-A986 HydrophobicContact CG1-CB 3.79Å; P930-A986 HydrophobicContact CG-CB 4.28Å; L937-A986 HydrophobicContact CD1-CB 3.71Å; Y940-A986 HydrophobicContact CD1-CB 4.02Å; Y940-A986 HydrophobicContact CE1-CB 4.07Å; A986-G993 PolarHBondContact O-N 3.35Å
987	L	91.7	Very high	88.7	Confident	2 Å²	2	33 Å²	33	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	119.9	175.8	-77.8	74.7	0	0	0	108.5	Y704 V938 A939 E941 R985 R992	Y704-L987 WeakPolarHBondContact OH-CB 3.23Å; V938-L987 HydrophobicContact CG2-CB 4.05Å; V938-L987 VanDerWaalsContact CG2-O 3.26Å; V938-L987 WeakPolarHBondContact CG2-O 3.29Å; V938-L987 PolarHBondContact N-O 3.38Å; A939-L987 HydrophobicContact CB-CB 4.37Å; A939-L987 WeakPolarHBondContact O-CB 3.31Å; A939-L987 PolarHBondContact O-N 2.8Å; E941-L987 HydrophobicContact CB-CD1 4.18Å; E941-L987 HydrophobicContact CG-CD1 3.85Å; R985-L987 HydrophobicContact CG-CD1 4.33Å; L987-R992 HydrophobicContact CG-CG 4.21Å
988	S	89.1	Confident	89.2	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	179.5	173.4	77.8	0	0	0	0	111.3	Y704 D904 A936 A990 Q991	Y704-S988 WeakPolarHBondContact CE1-O 3.43Å; Y704-S988 PolarHBondContact OH-O 2.91Å; Y704-S988 VanDerWaalsContact OH-O 3.14Å; D904-S988 WeakPolarHBondContact OD1-CB 3.4Å; D904-S988 PolarHBondContact OD1-OG 3.38Å; D904-S988 WeakPolarHBondContact OD2-CB 3.36Å; D904-S988 PolarHBondContact OD2-OG 3.2Å; A936-S988 CarbonylContact O-C 3.49Å; A936-S988 WeakPolarHBondContact O-CA 3.06Å; S988-A990 VanDerWaalsContact C-N 3.28Å; S988-A990 PolarHBondContact OG-N 3.14Å; S988-A990 VanDerWaalsContact OG-N 3.17Å; S988-Q991 PolarHBondContact N-O 2.92Å; S988-Q991 PolarHBondContact OG-N 3.35Å; S988-Q991 VanDerWaalsContact OG-N 3.1Å; S988-Q991 PolarHBondContact OG-O 2.98Å; S988-Q991 VanDerWaalsContact OG-O 3.09Å
989	L	85.2	Confident	89.7	Confident	69 Å²	69	38.4 Å²	38.4	36%	0.361	19%	0.191	S	C	.	.	S	Bend	trans	-74.8	-17	170.4	-73.2	178.2	0	0	0	113	Y697 F866 A936 V938	Y697-L989 HydrophobicContact CE1-CD2 4.2Å; F866-L989 HydrophobicContact CE1-CB 4.3Å; A936-L989 HydrophobicContact CB-CD1 3.7Å; A936-L989 HydrophobicContact CB-CG 4.07Å; A936-L989 PolarHBondContact O-N 2.63Å; V938-L989 HydrophobicContact CG1-CD2 3.73Å; V938-L989 HydrophobicContact CG1-CG 4.01Å
990	A	83.9	Confident	89.6	Confident	23 Å²	23	39.6 Å²	39.6	19%	0.19	20%	0.201	C	C	.	.	S	Bend	trans	-94.5	-40.3	179.7	0	0	0	0	0	113.3	Y704 F866 P899 N934 S988	Y704-A990 WeakPolarHBondContact CD1-O 3.47Å; F866-A990 HydrophobicContact CD1-CB 3.87Å; F866-A990 HydrophobicContact CD2-CB 4.03Å; F866-A990 HydrophobicContact CE1-CB 3.61Å; F866-A990 HydrophobicContact CE2-CB 3.78Å; F866-A990 HydrophobicContact CG-CB 4.06Å; F866-A990 HydrophobicContact CZ-CB 3.55Å; P899-A990 HydrophobicContact CB-CB 4.16Å; N934-A990 HydrophobicContact CB-CB 3.43Å; N934-A990 VanDerWaalsContact CB-CB 3.43Å; S988-A990 VanDerWaalsContact C-N 3.28Å; S988-A990 PolarHBondContact OG-N 3.14Å; S988-A990 VanDerWaalsContact OG-N 3.17Å
991	Q	85.7	Confident	89.4	Confident	49 Å²	49	39.4 Å²	39.4	23%	0.229	20%	0.202	C	C	.	.			trans	-159.1	172.2	-169.4	56.2	174.1	12.5	0	0	111.8	Y704 E901 D904 N934 S988	Y704-Q991 WeakPolarHBondContact CE1-O 3.18Å; E901-Q991 PolarHBondContact O-NE2 2.91Å; D904-Q991 WeakPolarHBondContact OD2-CG 3.3Å; D904-Q991 PolarHBondContact OD2-NE2 3.15Å; N934-Q991 PolarHBondContact ND2-NE2 3.12Å; S988-Q991 PolarHBondContact N-O 2.92Å; S988-Q991 PolarHBondContact OG-N 3.35Å; S988-Q991 VanDerWaalsContact OG-N 3.1Å; S988-Q991 PolarHBondContact OG-O 2.98Å; S988-Q991 VanDerWaalsContact OG-O 3.09Å
992	R	90	Very high	88.9	Confident	102 Å²	102	44.2 Å²	44.2	39%	0.385	23%	0.225	S	C	.	.	B	Isolated β-bridge	trans	-88.8	128.5	161.8	-59.6	-166	170.1	79.6	-1.5	108.5	Y704 E941 L987	Y704-R992 HydrophobicContact CD2-CG 3.95Å; Y704-R992 HydrophobicContact CE2-CG 3.4Å; E941-R992 IonicContact OE1-CZ 3.97Å; E941-R992 IonicContact OE1-NE 3.96Å; E941-R992 PolarHBondContact OE1-NE 3.39Å; E941-R992 IonicContact OE1-NH2 3.91Å; L987-R992 HydrophobicContact CG-CG 4.21Å
993	G	88	Confident	88.3	Confident	6 Å²	6	44.6 Å²	44.6	6%	0.062	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-67.1	172.2	171.9	0	0	0	0	0	112.6	A986	A986-G993 PolarHBondContact O-N 3.35Å
994	S	90.7	Very high	87.1	Confident	72 Å²	72	45.6 Å²	45.6	50%	0.503	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-62.2	150.7	179.6	-56.8	0	0	0	0	112	D905 R985	D905-S994 WeakPolarHBondContact OD1-CA 3.22Å; D905-S994 WeakPolarHBondContact OD1-CB 3.15Å; D905-S994 PolarHBondContact OD1-N 2.72Å; D905-S994 PolarHBondContact OD1-OG 3.41Å; R985-S994 VanDerWaalsContact CB-O 3.23Å; R985-S994 WeakPolarHBondContact CB-O 3.34Å
995	W	92	Very high	85.4	Confident	60 Å²	60	52.5 Å²	52.5	23%	0.227	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-75.4	136.2	166.4	-76	106.8	0	0	0	110.1	E941 E943 R983 I984 R985	E941-W995 HydrophobicContact CB-CH2 3.97Å; E941-W995 HydrophobicContact CB-CZ3 4.49Å; E943-W995 HydrophobicContact CB-CH2 3.84Å; E943-W995 HydrophobicContact CB-CZ3 3.97Å; R983-W995 HydrophobicContact CB-CE3 4.34Å; R983-W995 HydrophobicContact CG-CD2 4.37Å; R983-W995 HydrophobicContact CG-CE3 3.66Å; R983-W995 HydrophobicContact CG-CZ3 4.03Å; I984-W995 WeakPolarHBondContact O-CA 3.39Å; R985-W995 HydrophobicContact CB-CD2 4.1Å; R985-W995 HydrophobicContact CB-CE3 3.93Å; R985-W995 HydrophobicContact CB-CG 4.49Å; R985-W995 HydrophobicContact CB-CZ3 4.37Å; R985-W995 HydrophobicContact CG-CD2 3.97Å; R985-W995 HydrophobicContact CG-CE3 3.83Å; R985-W995 HydrophobicContact CG-CH2 4.01Å; R985-W995 HydrophobicContact CG-CZ2 4.14Å; R985-W995 HydrophobicContact CG-CZ3 3.85Å
996	T	92.8	Very high	83.6	Confident	9 Å²	9	54.2 Å²	54.2	6%	0.055	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-62.6	164.2	165.9	68.3	0	0	0	0	111.6	I906 E908 I984	I906-T996 HydrophobicContact CB-CG2 4.39Å; E908-T996 HydrophobicContact CG-CG2 4.02Å; E908-T996 WeakPolarHBondContact OE1-CA 3.15Å; I984-T996 HydrophobicContact CB-CG2 4.32Å; I984-T996 PolarHBondContact N-OG1 2.99Å; I984-T996 WeakPolarHBondContact O-CG2 3.19Å; I984-T996 PolarHBondContact O-N 3.37Å
997	S	88.2	Confident	81.7	Confident	57 Å²	57	60.6 Å²	60.6	40%	0.399	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-54.5	165.3	157.8	70.5	0	0	0	0	112.6	E908	E908-S997 PolarHBondContact OE1-N 2.87Å; E908-S997 VanDerWaalsContact OE2-CB 3.29Å; E908-S997 WeakPolarHBondContact OE2-CB 3.49Å; E908-S997 PolarHBondContact OE2-OG 2.86Å
998	Y	88.4	Confident	79.3	Confident	102 Å²	102	69.9 Å²	69.9	40%	0.4	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-88.9	121.1	-178.4	-80.3	-73.8	0	0	0	111.8	E943 L948 F982 R983	E943-Y998 PolarHBondContact OE1-OH 2.89Å; L948-Y998 HydrophobicContact CD1-CD1 3.79Å; L948-Y998 HydrophobicContact CD1-CE1 3.52Å; L948-Y998 HydrophobicContact CD1-CE2 4.28Å; L948-Y998 HydrophobicContact CD1-CG 4.29Å; F982-Y998 CarbonylContact O-C 3.55Å; F982-Y998 WeakPolarHBondContact O-CA 3.44Å; R983-Y998 HydrophobicContact CB-CD1 3.88Å; R983-Y998 HydrophobicContact CB-CE1 4.06Å; R983-Y998 HydrophobicContact CB-CG 4.43Å; R983-Y998 HydrophobicContact CG-CD1 3.9Å; R983-Y998 HydrophobicContact CG-CE1 3.54Å; R983-Y998 VanDerWaalsContact CZ-OH 3.24Å; R983-Y998 PolarHBondContact NE-OH 3.06Å; R983-Y998 VanDerWaalsContact NE-OH 3.13Å; R983-Y998 PolarHBondContact NH2-OH 3.27Å
999	F	90	Very high	77.3	Confident	48 Å²	48	78.8 Å²	78.8	21%	0.211	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	163.8	170.7	-57.5	-88.3	0	0	0	110.9	V911 S981 F982	V911-F999 HydrophobicContact CB-CE1 3.83Å; V911-F999 HydrophobicContact CB-CE2 4.06Å; V911-F999 HydrophobicContact CB-CZ 3.55Å; V911-F999 HydrophobicContact CG1-CD1 4.27Å; V911-F999 HydrophobicContact CG1-CD2 4.13Å; V911-F999 HydrophobicContact CG1-CE1 4.01Å; V911-F999 HydrophobicContact CG1-CE2 3.87Å; V911-F999 HydrophobicContact CG1-CG 4.34Å; V911-F999 HydrophobicContact CG1-CZ 3.81Å; V911-F999 HydrophobicContact CG2-CE1 4.39Å; V911-F999 HydrophobicContact CG2-CE2 3.92Å; V911-F999 HydrophobicContact CG2-CZ 3.62Å; S981-F999 CarbonylContact C-O 3.55Å; S981-F999 WeakPolarHBondContact CA-O 3.36Å; F982-F999 HydrophobicContact CD1-CB 3.96Å; F982-F999 HydrophobicContact CD2-CB 4.34Å; F982-F999 HydrophobicContact CD2-CD2 4.35Å; F982-F999 HydrophobicContact CE1-CB 3.46Å; F982-F999 VanDerWaalsContact CE1-CB 3.46Å; F982-F999 HydrophobicContact CE1-CG 4.43Å; F982-F999 HydrophobicContact CE2-CB 3.87Å; F982-F999 AromaticContact CE2-CD2 3.82Å; F982-F999 HydrophobicContact CE2-CD2 3.82Å; F982-F999 HydrophobicContact CE2-CG 4.08Å; F982-F999 HydrophobicContact CG-CB 4.37Å; F982-F999 HydrophobicContact CZ-CB 3.4Å; F982-F999 VanDerWaalsContact CZ-CB 3.4Å; F982-F999 HydrophobicContact CZ-CD2 4.13Å; F982-F999 AromaticContact CZ-CG 3.9Å; F982-F999 HydrophobicContact CZ-CG 3.9Å; F982-F999 PolarHBondContact N-O 3.1Å; F982-F999 PolarHBondContact O-N 2.95Å
1000	T	84	Confident	75.2	Confident	100 Å²	100	79.6 Å²	79.6	61%	0.613	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.3	147.5	-176	56.2	0	0	0	0	113.8	Y980	Y980-T1000 CarbonylContact O-C 3.54Å; Y980-T1000 VanDerWaalsContact O-CA 3.29Å; Y980-T1000 WeakPolarHBondContact O-CA 3.21Å
1001	L	83.6	Confident	73.3	Confident	15 Å²	15	87.4 Å²	87.4	8%	0.079	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	155.7	176.1	69.5	82.3	0	0	0	113.6	R923 I972 L975 N979 Y980 F982 I1003	R923-L1001 HydrophobicContact CB-CD2 4.24Å; R923-L1001 HydrophobicContact CG-CD1 4.15Å; R923-L1001 HydrophobicContact CG-CD2 4.17Å; I972-L1001 HydrophobicContact CD1-CD2 4.24Å; L975-L1001 HydrophobicContact CD1-CD1 4.24Å; N979-L1001 PolarHBondContact OD1-O 2.94Å; Y980-L1001 HydrophobicContact CD2-CD1 4.1Å; Y980-L1001 HydrophobicContact CG-CD1 4.18Å; Y980-L1001 PolarHBondContact N-O 3.11Å; Y980-L1001 PolarHBondContact O-N 2.82Å; F982-L1001 HydrophobicContact CD1-CD2 4.03Å; F982-L1001 HydrophobicContact CE1-CD2 4.26Å; L1001-I1003 HydrophobicContact CD1-CD1 3.85Å; L1001-I1003 HydrophobicContact CD1-CG1 3.94Å
1002	L	78.5	Confident	71.6	Confident	123 Å²	123	90.8 Å²	90.8	64%	0.644	50%	0.504	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.5	145.4	-175.6	-170.5	71.8	0	0	0	112.7	R923 N979	R923-L1002 PolarHBondContact NH2-O 3.12Å; N979-L1002 HydrophobicContact CB-CD1 4.01Å
1003	I	77.3	Confident	69.9	Low	8 Å²	8	92.7 Å²	92.7	4%	0.041	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	139.3	-175.7	-55.1	179.4	0	0	0	110.1	N921 R923 L975 P977 G978 Y980 L1001	N921-I1003 HydrophobicContact CB-CG2 3.68Å; N921-I1003 VanDerWaalsContact CG-CG2 3.41Å; N921-I1003 WeakPolarHBondContact O-CD1 3.43Å; R923-I1003 HydrophobicContact CG-CD1 4.42Å; L975-I1003 HydrophobicContact CB-CD1 3.26Å; L975-I1003 HydrophobicContact CD1-CD1 3.48Å; L975-I1003 VanDerWaalsContact CD1-CD1 3.48Å; L975-I1003 HydrophobicContact CG-CD1 4.01Å; P977-I1003 CarbonylContact C-O 3.54Å; P977-I1003 WeakPolarHBondContact CA-O 3.27Å; G978-I1003 PolarHBondContact N-O 3.15Å; G978-I1003 PolarHBondContact O-N 3.15Å; Y980-I1003 HydrophobicContact CD2-CD1 4.45Å; Y980-I1003 HydrophobicContact CE2-CD1 4.42Å; L1001-I1003 HydrophobicContact CD1-CD1 3.85Å; L1001-I1003 HydrophobicContact CD1-CG1 3.94Å
1004	A	68.6	Low	68.4	Low	74 Å²	74	98 Å²	98	61%	0.612	55%	0.551	S	S	*	*			trans	-110.2	158.9	-171.9	0	0	0	0	0	113.7	P977	P977-A1004 VanDerWaalsContact CG-O 3.29Å; P977-A1004 WeakPolarHBondContact CG-O 3.45Å
1005	D	59.5	Low	66.8	Low	145 Å²	145	100.5 Å²	100.5	78%	0.775	56%	0.558	S	S	*	*			trans	-78.7	149.3	-175.8	-79	-70.2	0	0	0	114.6	P977	P977-D1005 HydrophobicContact CB-CB 4.36Å; P977-D1005 WeakPolarHBondContact CB-OD1 3.31Å; P977-D1005 HydrophobicContact CG-CB 4.4Å; P977-D1005 WeakPolarHBondContact CG-OD1 3.23Å
1006	A	55.7	Low	65.1	Low	73 Å²	73	104.7 Å²	104.7	60%	0.603	58%	0.584	S	S	*	*			trans	-129.5	144.6	178.6	0	0	0	0	0	112.5
1007	P	51.9	Low	63.5	Low	136 Å²	136	110 Å²	110	88%	0.883	61%	0.611	S	S	*	*			trans	-78.3	154	-174	31.6	-35.9	0	0	0	114.1
1008	K	42.9	Very low	62.2	Low	197 Å²	197	110.2 Å²	110.2	86%	0.857	62%	0.616	S	S	*	*			trans	-119.8	137.9	-170.8	-64.3	-177.1	177.7	-177.7	0	114.6
1009	M	45.8	Very low	61.1	Low	187 Å²	187	110 Å²	110	92%	0.921	63%	0.625	S	S	*	*			trans	-155.7	145.4	163.2	-69.3	-71.7	-80.6	0	0	108.1
1010	A	42.1	Very low	59.9	Low	86 Å²	86	110.1 Å²	110.1	71%	0.711	64%	0.64	S	S	*	*			cis	-157.9	142.2	-34.7	0	0	0	0	0	107.4
1011	E	44.7	Very low	59	Low	187 Å²	187	109.4 Å²	109.4	87%	0.874	64%	0.638	S	S	*	*			trans	-96.3	148.9	-174.8	-60.6	-176.8	126.8	0	0	113.2
1012	T	49.5	Very low	58.3	Low	119 Å²	119	112 Å²	112	73%	0.73	66%	0.657	S	S	*	*			trans	-160.6	-28.2	165.7	-17.8	0	0	0	0	116.5
1013	I	53	Low	57.7	Low	143 Å²	143	109.1 Å²	109.1	73%	0.733	65%	0.652	S	S	*	*	S	Bend	trans	-82.6	-29.7	-165.2	-65.1	174.3	0	0	0	114.2	I1015	I1013-I1015 PolarHBondContact O-N 3.05Å
1014	V	56.4	Low	57.2	Low	117 Å²	117	116.5 Å²	116.5	71%	0.709	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-32.2	-168.9	-178.7	0	0	0	0	113.6	L1016 I1017	V1014-L1016 PolarHBondContact O-N 2.85Å; V1014-I1017 PolarHBondContact O-N 3.11Å
1015	I	57.8	Low	57.2	Low	124 Å²	124	116.2 Å²	116.2	64%	0.636	68%	0.681	S	S	*	*	H	α-helix	trans	-66.1	-35.9	-167.2	-62.4	173.5	0	0	0	112.6	I1013 I1017	I1013-I1015 PolarHBondContact O-N 3.05Å; I1015-I1017 PolarHBondContact O-N 2.85Å
1016	L	56.3	Low	57.8	Low	148 Å²	148	114 Å²	114	78%	0.775	67%	0.673	S	S	*	*	H	α-helix	trans	-69.9	-30.8	-174.6	-75.3	168.4	0	0	0	113.7	V1014	V1014-L1016 PolarHBondContact O-N 2.85Å
1017	I	60.1	Low	58.4	Low	121 Å²	121	116.2 Å²	116.2	62%	0.621	67%	0.674	S	S	*	*	H	α-helix	trans	-76.9	-40.7	-178.3	-60.1	175.9	0	0	0	110.6	V1014 I1015 V1019 G1020 C1021	V1014-I1017 PolarHBondContact O-N 3.11Å; I1015-I1017 PolarHBondContact O-N 2.85Å; I1017-V1019 VanDerWaalsContact C-N 3.35Å; I1017-V1019 PolarHBondContact O-N 2.77Å; I1017-G1020 PolarHBondContact O-N 3.29Å; I1017-C1021 PolarHBondContact O-N 2.85Å
1018	A	61.4	Low	59.3	Low	62 Å²	62	115.9 Å²	115.9	51%	0.512	66%	0.659	S	S	.	*	H	α-helix	trans	-59.5	-42	-178.1	0	0	0	0	0	112.9	G1020 S1022	A1018-G1020 PolarHBondContact O-N 2.99Å; A1018-S1022 PolarHBondContact O-N 3.27Å; A1018-S1022 VanDerWaalsContact O-N 3.14Å
1019	V	64.6	Low	60.7	Low	96 Å²	96	108 Å²	108	58%	0.582	63%	0.633	S	S	*	*	H	α-helix	trans	-63	-45.7	-178.4	178.6	0	0	0	0	111.1	I1017 C1021 S1022 A1023	I1017-V1019 VanDerWaalsContact C-N 3.35Å; I1017-V1019 PolarHBondContact O-N 2.77Å; V1019-C1021 PolarHBondContact O-N 3.3Å; V1019-S1022 PolarHBondContact O-N 2.82Å; V1019-S1022 PolarHBondContact O-OG 2.97Å; V1019-A1023 PolarHBondContact O-N 2.69Å
1020	G	64.4	Low	61.9	Low	51 Å²	51	103.2 Å²	103.2	53%	0.526	61%	0.614	S	S	.	*	H	α-helix	trans	-61.7	-44.5	-179.5	0	0	0	0	0	113.4	I1017 A1018	I1017-G1020 PolarHBondContact O-N 3.29Å; A1018-G1020 PolarHBondContact O-N 2.99Å
1021	C	65.9	Low	63.2	Low	86 Å²	86	104 Å²	104	58%	0.581	61%	0.606	S	S	*	*	H	α-helix	trans	-66.8	-38.2	178.6	-65.8	0	0	0	0	112.6	I1017 V1019 A1023 F1024 A1025	I1017-C1021 PolarHBondContact O-N 2.85Å; V1019-C1021 PolarHBondContact O-N 3.3Å; C1021-A1023 PolarHBondContact O-N 2.89Å; C1021-F1024 PolarHBondContact O-N 3.49Å; C1021-A1025 PolarHBondContact O-N 3.34Å
1022	S	67.1	Low	64.4	Low	68 Å²	68	99.7 Å²	99.7	48%	0.476	59%	0.588	S	S	.	*	H	α-helix	trans	-64.4	-39.9	-177.1	70.8	0	0	0	0	113.2	A1018 V1019 F1024 V1026	A1018-S1022 PolarHBondContact O-N 3.27Å; A1018-S1022 VanDerWaalsContact O-N 3.14Å; V1019-S1022 PolarHBondContact O-N 2.82Å; V1019-S1022 PolarHBondContact O-OG 2.97Å; S1022-F1024 PolarHBondContact O-N 2.87Å; S1022-V1026 WeakPolarHBondContact O-CG2 3.44Å; S1022-V1026 PolarHBondContact O-N 2.89Å
1023	A	66.8	Low	65.2	Low	64 Å²	64	98.7 Å²	98.7	53%	0.529	58%	0.582	S	S	.	*	H	α-helix	trans	-63.3	-40.7	-180	0	0	0	0	0	112.8	V1019 C1021 L1027	V1019-A1023 PolarHBondContact O-N 2.69Å; C1021-A1023 PolarHBondContact O-N 2.89Å; A1023-L1027 PolarHBondContact O-N 2.92Å
1024	F	66.3	Low	65.7	Low	163 Å²	163	94.7 Å²	94.7	72%	0.715	57%	0.565	S	S	*	*	H	α-helix	trans	-71.4	-39.2	-177.3	-154	-92.3	0	0	0	112.1	C1021 S1022 L1027 F1028	C1021-F1024 PolarHBondContact O-N 3.49Å; S1022-F1024 PolarHBondContact O-N 2.87Å; F1024-L1027 PolarHBondContact O-N 3.32Å; F1024-F1028 PolarHBondContact O-N 3.3Å; F1024-F1028 VanDerWaalsContact O-N 3.16Å
1025	A	68.9	Low	66.1	Low	67 Å²	67	91.3 Å²	91.3	55%	0.554	55%	0.549	S	S	*	.	H	α-helix	trans	-63.2	-44.5	179.4	0	0	0	0	0	112.7	C1021 G1029	C1021-A1025 PolarHBondContact O-N 3.34Å; A1025-G1029 PolarHBondContact O-N 2.68Å
1026	V	71.5	Confident	66.4	Low	100 Å²	100	89.2 Å²	89.2	61%	0.606	54%	0.542	S	S	*	.	H	α-helix	trans	-63.2	-44.1	179.1	174	0	0	0	0	111.2	S1022 F1028 G1029 V1030	S1022-V1026 WeakPolarHBondContact O-CG2 3.44Å; S1022-V1026 PolarHBondContact O-N 2.89Å; V1026-F1028 PolarHBondContact O-N 2.77Å; V1026-G1029 PolarHBondContact O-N 3.11Å; V1026-V1030 WeakPolarHBondContact O-CG2 3.28Å; V1026-V1030 PolarHBondContact O-N 3.48Å
1027	L	69.3	Low	66.5	Low	119 Å²	119	89.9 Å²	89.9	62%	0.623	54%	0.535	S	S	*	.	H	α-helix	trans	-68.9	-37.3	-175.5	-150.3	139.9	0	0	0	112	A1023 F1024 L1031	A1023-L1027 PolarHBondContact O-N 2.92Å; F1024-L1027 PolarHBondContact O-N 3.32Å; L1027-L1031 HydrophobicContact CD2-CD1 4.11Å; L1027-L1031 PolarHBondContact O-N 3.29Å
1028	F	70.3	Confident	66.4	Low	128 Å²	128	94 Å²	94	56%	0.561	54%	0.542	S	S	*	.	H	α-helix	trans	-69.6	-39.9	173.2	-161.1	-106.7	0	0	0	112.3	F1024 V1026 L1031 L1032	F1024-F1028 PolarHBondContact O-N 3.3Å; F1024-F1028 VanDerWaalsContact O-N 3.16Å; V1026-F1028 PolarHBondContact O-N 2.77Å; F1028-L1031 PolarHBondContact O-N 3.34Å; F1028-L1032 HydrophobicContact CD1-CD1 3.75Å; F1028-L1032 HydrophobicContact CD1-CG 4.47Å; F1028-L1032 HydrophobicContact CE1-CD1 3.59Å; F1028-L1032 HydrophobicContact CE1-CG 4.3Å; F1028-L1032 HydrophobicContact CZ-CD1 4.49Å; F1028-L1032 PolarHBondContact O-N 3.02Å
1029	G	71.7	Confident	66.1	Low	31 Å²	31	101.5 Å²	101.5	32%	0.32	56%	0.558	S	S	.	*	H	α-helix	trans	-60.6	-45.5	176.1	0	0	0	0	0	113.2	A1025 V1026 L1031 L1032 V1033	A1025-G1029 PolarHBondContact O-N 2.68Å; V1026-G1029 PolarHBondContact O-N 3.11Å; G1029-L1031 PolarHBondContact O-N 2.91Å; G1029-L1032 PolarHBondContact O-N 2.95Å; G1029-V1033 WeakPolarHBondContact O-CG2 3.35Å; G1029-V1033 PolarHBondContact O-N 3.47Å
1030	V	72.2	Confident	65.3	Low	87 Å²	87	105.2 Å²	105.2	53%	0.527	57%	0.566	S	S	.	*	H	α-helix	trans	-65.2	-37.8	177.9	173.4	0	0	0	0	111.8	V1026 T1034	V1026-V1030 WeakPolarHBondContact O-CG2 3.28Å; V1026-V1030 PolarHBondContact O-N 3.48Å; V1030-T1034 HydrophobicContact CG1-CG2 4.4Å; V1030-T1034 WeakPolarHBondContact O-CB 3.2Å; V1030-T1034 WeakPolarHBondContact O-CG2 3.36Å; V1030-T1034 PolarHBondContact O-N 3.24Å; V1030-T1034 PolarHBondContact O-OG1 3.21Å
1031	L	69.4	Low	64.3	Low	104 Å²	104	110.4 Å²	110.4	55%	0.545	57%	0.574	S	S	.	*	H	α-helix	trans	-66.3	-41.9	174.5	-77.3	165.2	0	0	0	112.2	L1027 F1028 G1029 T1034 A1035	L1027-L1031 HydrophobicContact CD2-CD1 4.11Å; L1027-L1031 PolarHBondContact O-N 3.29Å; F1028-L1031 PolarHBondContact O-N 3.34Å; G1029-L1031 PolarHBondContact O-N 2.91Å; L1031-T1034 PolarHBondContact O-OG1 3.01Å; L1031-A1035 WeakPolarHBondContact O-CB 3.26Å; L1031-A1035 PolarHBondContact O-N 3.14Å
1032	L	68.4	Low	62.7	Low	95 Å²	95	115.1 Å²	115.1	50%	0.497	59%	0.585	S	S	.	*	H	α-helix	trans	-63.1	-49	174.5	-86.1	169.6	0	0	0	112.2	F1028 G1029 T1034 A1035 V1036	F1028-L1032 HydrophobicContact CD1-CD1 3.75Å; F1028-L1032 HydrophobicContact CD1-CG 4.47Å; F1028-L1032 HydrophobicContact CE1-CD1 3.59Å; F1028-L1032 HydrophobicContact CE1-CG 4.3Å; F1028-L1032 HydrophobicContact CZ-CD1 4.49Å; F1028-L1032 PolarHBondContact O-N 3.02Å; G1029-L1032 PolarHBondContact O-N 2.95Å; L1032-T1034 PolarHBondContact O-N 3.46Å; L1032-A1035 PolarHBondContact O-N 3.38Å; L1032-V1036 WeakPolarHBondContact O-CB 3.48Å; L1032-V1036 WeakPolarHBondContact O-CG2 3.48Å; L1032-V1036 PolarHBondContact O-N 3.38Å
1033	V	68.1	Low	61	Low	98 Å²	98	121.4 Å²	121.4	59%	0.594	60%	0.604	S	S	*	*	H	α-helix	trans	-61.6	-46	179.8	171.3	0	0	0	0	110.8	G1029 A1035 V1036 Y1037	G1029-V1033 WeakPolarHBondContact O-CG2 3.35Å; G1029-V1033 PolarHBondContact O-N 3.47Å; V1033-A1035 PolarHBondContact O-N 3.25Å; V1033-V1036 PolarHBondContact O-N 2.86Å; V1033-Y1037 VanDerWaalsContact O-CB 3.26Å; V1033-Y1037 WeakPolarHBondContact O-CB 3.32Å; V1033-Y1037 PolarHBondContact O-N 2.88Å
1034	T	63.4	Low	59.3	Low	60 Å²	60	127.5 Å²	127.5	37%	0.368	62%	0.618	S	S	.	*	H	α-helix	trans	-68.1	-33	178.5	54.4	0	0	0	0	113	V1030 L1031 L1032 R1038	V1030-T1034 HydrophobicContact CG1-CG2 4.4Å; V1030-T1034 WeakPolarHBondContact O-CB 3.2Å; V1030-T1034 WeakPolarHBondContact O-CG2 3.36Å; V1030-T1034 PolarHBondContact O-N 3.24Å; V1030-T1034 PolarHBondContact O-OG1 3.21Å; L1031-T1034 PolarHBondContact O-OG1 3.01Å; L1032-T1034 PolarHBondContact O-N 3.46Å; T1034-R1038 VanDerWaalsContact O-CB 3.26Å; T1034-R1038 WeakPolarHBondContact O-CB 3.43Å; T1034-R1038 VanDerWaalsContact O-CG 3.22Å; T1034-R1038 WeakPolarHBondContact O-CG 3.35Å; T1034-R1038 PolarHBondContact O-N 3.39Å
1035	A	64.2	Low	58	Low	45 Å²	45	128 Å²	128	37%	0.372	63%	0.627	S	S	.	*	H	α-helix	trans	-68.2	-43.7	173.1	0	0	0	0	0	112.5	L1031 L1032 V1033 R1039	L1031-A1035 WeakPolarHBondContact O-CB 3.26Å; L1031-A1035 PolarHBondContact O-N 3.14Å; L1032-A1035 PolarHBondContact O-N 3.38Å; V1033-A1035 PolarHBondContact O-N 3.25Å; A1035-R1039 WeakPolarHBondContact O-CB 3.49Å; A1035-R1039 WeakPolarHBondContact O-CG 3.48Å; A1035-R1039 PolarHBondContact O-N 3.44Å
1036	V	65.1	Low	56.6	Low	81 Å²	81	128.6 Å²	128.6	49%	0.491	63%	0.626	S	S	.	*	H	α-helix	trans	-65.5	-45.3	176.7	170.5	0	0	0	0	110.9	L1032 V1033 R1038 R1039 K1040	L1032-V1036 WeakPolarHBondContact O-CB 3.48Å; L1032-V1036 WeakPolarHBondContact O-CG2 3.48Å; L1032-V1036 PolarHBondContact O-N 3.38Å; V1033-V1036 PolarHBondContact O-N 2.86Å; V1036-R1038 PolarHBondContact O-N 3.13Å; V1036-R1039 PolarHBondContact O-N 2.95Å; V1036-K1040 PolarHBondContact O-N 2.77Å
1037	Y	56.6	Low	55	Low	162 Å²	162	133 Å²	133	64%	0.635	64%	0.64	S	S	*	*	H	α-helix	trans	-63.4	-42.4	178.7	-158.1	-93	0	0	0	111.8	V1033 R1039 K1040	V1033-Y1037 VanDerWaalsContact O-CB 3.26Å; V1033-Y1037 WeakPolarHBondContact O-CB 3.32Å; V1033-Y1037 PolarHBondContact O-N 2.88Å; Y1037-R1039 VanDerWaalsContact C-N 3.34Å; Y1037-R1039 PolarHBondContact O-N 3.16Å; Y1037-K1040 PolarHBondContact O-N 3.31Å
1038	R	58.3	Low	53.3	Low	206 Å²	206	137.4 Å²	137.4	78%	0.777	65%	0.65	S	S	*	*	H	α-helix	trans	-69.7	-25.8	175.3	-72.7	176.1	176.6	-169.3	0.3	113.6	T1034 V1036	T1034-R1038 VanDerWaalsContact O-CB 3.26Å; T1034-R1038 WeakPolarHBondContact O-CB 3.43Å; T1034-R1038 VanDerWaalsContact O-CG 3.22Å; T1034-R1038 WeakPolarHBondContact O-CG 3.35Å; T1034-R1038 PolarHBondContact O-N 3.39Å; V1036-R1038 PolarHBondContact O-N 3.13Å
1039	R	56.1	Low	51.6	Low	220 Å²	220	139.1 Å²	139.1	83%	0.83	66%	0.664	S	S	*	*	H	α-helix	trans	-80.5	-31.8	174.3	-79.1	179.1	172.8	175	-1.6	113.6	A1035 V1036 Y1037	A1035-R1039 WeakPolarHBondContact O-CB 3.49Å; A1035-R1039 WeakPolarHBondContact O-CG 3.48Å; A1035-R1039 PolarHBondContact O-N 3.44Å; V1036-R1039 PolarHBondContact O-N 2.95Å; Y1037-R1039 VanDerWaalsContact C-N 3.34Å; Y1037-R1039 PolarHBondContact O-N 3.16Å
1040	K	48	Very low	49.8	Very low	175 Å²	175	144 Å²	144	76%	0.761	68%	0.682	S	S	*	*	H	α-helix	trans	-79.7	-15.9	-178.3	-89.8	-170.6	170.1	-175.2	0	116	V1036 Y1037	V1036-K1040 PolarHBondContact O-N 2.77Å; Y1037-K1040 PolarHBondContact O-N 3.31Å
1041	F	43.6	Very low	47.8	Very low	160 Å²	160	147 Å²	147	70%	0.702	70%	0.695	S	S	*	*	S	Bend	trans	-121.3	23.7	-166.8	-98.3	-78.5	0	0	0	116.8
1042	K	31.3	Very low	46.1	Very low	184 Å²	184	148.8 Å²	148.8	80%	0.8	71%	0.71	S	S	*	*			trans	-139.2	124.9	171.6	-78.2	-166	174.4	-175.5	0	114.9
1043	K	31.2	Very low	44.2	Very low	201 Å²	201	153 Å²	153	87%	0.874	73%	0.725	S	S	*	*			trans	97.8	131	161.7	-62.5	-175.3	175.9	-178.3	0	118.7
1044	K	32.1	Very low	42.5	Very low	192 Å²	192	153.5 Å²	153.5	84%	0.835	73%	0.732	S	S	*	*			trans	71.8	97	155.3	-69.9	-169	169.7	-160.8	0	119.7
1045	L	39.2	Very low	40.9	Very low	172 Å²	172	155.9 Å²	155.9	90%	0.901	76%	0.758	S	S	*	*			trans	-65.3	134.4	136.7	173.9	74.5	0	0	0	110
1046	P	37.7	Very low	39.6	Very low	80 Å²	80	157.9 Å²	157.9	52%	0.519	76%	0.762	S	S	.	*			trans	-144.1	145.5	154.4	34.8	-16.6	0	0	0	115.9
1047	E	38.2	Very low	38.6	Very low	194 Å²	194	158.4 Å²	158.4	91%	0.907	77%	0.767	S	S	*	*				41.3	87	129.3	-59.4	152.5	132.1	0	0	119
1048	Y	33.7	Very low	38	Very low	211 Å²	211	158.8 Å²	158.8	83%	0.827	78%	0.775	S	S	*	*			trans	-129.6	-9.9	160.2	157.8	-112.2	0	0	0	112.8	L1050	Y1048-L1050 VanDerWaalsContact C-N 3.33Å; Y1048-L1050 PolarHBondContact O-N 3.02Å
1049	L	36	Very low	37.2	Very low	164 Å²	164	158.5 Å²	158.5	86%	0.859	78%	0.775	S	S	*	*	S	Bend	trans	-84.9	9.9	-173.6	-74.9	168.9	0	0	0	115.5
1050	L	32.1	Very low	36.3	Very low	133 Å²	133	153.1 Å²	153.1	70%	0.696	76%	0.762	S	S	*	*			trans	-134.3	111.4	170.2	-77.9	89.6	0	0	0	109.6	Y1048	Y1048-L1050 VanDerWaalsContact C-N 3.33Å; Y1048-L1050 PolarHBondContact O-N 3.02Å
1051	N	31.5	Very low	35.8	Very low	149 Å²	149	148.4 Å²	148.4	80%	0.797	75%	0.751	S	S	*	*			trans	157.5	61.7	144.8	-80.4	-16.7	0	0	0	113.6
1052	V	33.4	Very low	35.8	Very low	142 Å²	142	149.2 Å²	149.2	86%	0.861	76%	0.757	S	S	*	*			trans	-137.5	71.5	149.1	-170	0	0	0	0	108.7
1053	F	29.5	Very low	36.2	Very low	185 Å²	185	147.9 Å²	147.9	81%	0.811	76%	0.758	S	S	*	*			trans	-101.6	103.4	171.3	-83.1	-84.5	0	0	0	109.7
1054	S	30.5	Very low	36.7	Very low	108 Å²	108	143.3 Å²	143.3	76%	0.755	74%	0.739	S	S	*	*			trans	-157	100.4	162.7	45.7	0	0	0	0	114.3	N1056	S1054-N1056 PolarHBondContact O-N 2.8Å
1055	A	30.5	Very low	37.8	Very low	109 Å²	109	139.5 Å²	139.5	90%	0.901	73%	0.732	S	S	*	*			trans	46.1	70.3	138.2	0	0	0	0	0	120.1
1056	N	37.1	Very low	39	Very low	88 Å²	88	133 Å²	133	47%	0.471	70%	0.696	S	S	.	*			trans	-139.8	118.3	139.3	-173.5	-22.5	0	0	0	110.2	S1054 E1058 Y1059	S1054-N1056 PolarHBondContact O-N 2.8Å; N1056-E1058 PolarHBondContact O-N 3.3Å; N1056-E1058 PolarHBondContact OD1-N 2.94Å; N1056-Y1059 HydrophobicContact CB-CD2 3.91Å; N1056-Y1059 HydrophobicContact CB-CE2 4.07Å
1057	P	43.1	Very low	40.3	Very low	92 Å²	92	135.6 Å²	135.6	60%	0.597	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-15.1	-176.2	-25	35.6	0	0	0	117.2
1058	E	45.9	Very low	42	Very low	169 Å²	169	130.1 Å²	130.1	79%	0.79	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-7.8	-169.6	-59.2	-166.3	160.6	0	0	114.5	N1056 I1060	N1056-E1058 PolarHBondContact O-N 3.3Å; N1056-E1058 PolarHBondContact OD1-N 2.94Å; E1058-I1060 PolarHBondContact O-N 3.23Å; E1058-I1060 VanDerWaalsContact O-N 3.15Å
1059	Y	40.9	Very low	44.3	Very low	200 Å²	200	123.5 Å²	123.5	78%	0.784	66%	0.659	S	S	*	*			trans	-83.3	26.1	179.4	-72.1	-87	0	0	0	114.6	N1056 S1061	N1056-Y1059 HydrophobicContact CB-CD2 3.91Å; N1056-Y1059 HydrophobicContact CB-CE2 4.07Å; Y1059-S1061 PolarHBondContact O-N 2.88Å
1060	I	37.3	Very low	46.6	Very low	108 Å²	108	122.7 Å²	122.7	55%	0.554	65%	0.651	S	S	*	*			trans	-78	112.7	171.8	-62.1	178.9	0	0	0	108.4	E1058 E1064	E1058-I1060 PolarHBondContact O-N 3.23Å; E1058-I1060 VanDerWaalsContact O-N 3.15Å; I1060-E1064 HydrophobicContact CG2-CB 4.1Å; I1060-E1064 HydrophobicContact CG2-CG 4.3Å
1061	S	37.7	Very low	49.3	Very low	76 Å²	76	117.6 Å²	117.6	53%	0.531	62%	0.622	S	S	.	*			trans	-55.9	148	-178.5	57.6	0	0	0	0	113	Y1059 L1063 E1064	Y1059-S1061 PolarHBondContact O-N 2.88Å; S1061-L1063 PolarHBondContact O-N 3.04Å; S1061-E1064 PolarHBondContact O-N 2.81Å
1062	Q	42.3	Very low	52.2	Low	176 Å²	176	112.6 Å²	112.6	82%	0.822	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	26.1	-176.6	-62.5	175.3	-22.3	0	0	115.3
1063	L	39.8	Very low	54.9	Low	156 Å²	156	106.7 Å²	106.7	82%	0.817	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.2	-5.5	176.1	-83.4	87.8	0	0	0	113.9	S1061 V1065	S1061-L1063 PolarHBondContact O-N 3.04Å; L1063-V1065 PolarHBondContact O-N 2.9Å
1064	E	42.4	Very low	57.8	Low	105 Å²	105	104.7 Å²	104.7	49%	0.491	55%	0.545	S	S	.	.			trans	-86.2	93.8	173.9	-69.9	-125.2	99.4	0	0	111.5	I1060 S1061 K1067	I1060-E1064 HydrophobicContact CG2-CB 4.1Å; I1060-E1064 HydrophobicContact CG2-CG 4.3Å; S1061-E1064 PolarHBondContact O-N 2.81Å; E1064-K1067 IonicContact OE1-NZ 3.3Å; E1064-K1067 PolarHBondContact OE1-NZ 3.08Å
1065	V	54.9	Low	60.7	Low	113 Å²	113	103.6 Å²	103.6	69%	0.685	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-65	142	163.8	-179.4	0	0	0	0	109.2	L1063 K1067	L1063-V1065 PolarHBondContact O-N 2.9Å; V1065-K1067 PolarHBondContact O-N 2.92Å
1066	Y	63.9	Low	63.5	Low	36 Å²	36	103.9 Å²	103.9	14%	0.141	51%	0.507	C	S	.	.	P	Polyproline II helix	trans	-54	116.4	171.9	179.1	-81.4	0	0	0	109.8	L1129 K1136 V1149 S1151	Y1066-L1129 HydrophobicContact CD1-CD1 4.44Å; Y1066-L1129 HydrophobicContact CD2-CB 3.93Å; Y1066-L1129 HydrophobicContact CD2-CD2 4.24Å; Y1066-L1129 HydrophobicContact CD2-CG 4.49Å; Y1066-L1129 HydrophobicContact CE2-CD2 4.37Å; Y1066-L1129 HydrophobicContact CG-CB 4.16Å; Y1066-L1129 HydrophobicContact CG-CD1 4.12Å; Y1066-L1129 HydrophobicContact CG-CD2 4.34Å; Y1066-L1129 HydrophobicContact CG-CG 4.44Å; Y1066-K1136 PolarHBondContact OH-NZ 3.03Å; Y1066-V1149 HydrophobicContact CE2-CG1 4.49Å; Y1066-S1151 VanDerWaalsContact CE1-CB 3.4Å; Y1066-S1151 WeakPolarHBondContact CE1-OG 3.31Å
1067	K	64.8	Low	66.1	Low	134 Å²	134	100.8 Å²	100.8	58%	0.583	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-95.3	130	173.3	-67.8	156.2	-170	160.5	0	107.6	E1064 V1065 D1069	E1064-K1067 IonicContact OE1-NZ 3.3Å; E1064-K1067 PolarHBondContact OE1-NZ 3.08Å; V1065-K1067 PolarHBondContact O-N 2.92Å; K1067-D1069 PolarHBondContact O-N 2.83Å
1068	P	74.8	Confident	68.5	Low	78 Å²	78	97.2 Å²	97.2	51%	0.506	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-52.9	131.9	167.8	-26.5	35.5	0	0	0	110.7	E1072	P1068-E1072 HydrophobicContact CB-CB 4.2Å; P1068-E1072 HydrophobicContact CB-CG 4.12Å
1069	D	81.3	Confident	70.7	Confident	72 Å²	72	94.3 Å²	94.3	39%	0.385	45%	0.452	S	S	.	.			trans	-133	-164.8	179.3	66.9	2.9	0	0	0	109.9	K1067 W1071 E1072 K1136	K1067-D1069 PolarHBondContact O-N 2.83Å; D1069-W1071 PolarHBondContact O-N 2.8Å; D1069-W1071 WeakPolarHBondContact OD1-CB 3.46Å; D1069-W1071 PolarHBondContact OD1-N 2.95Å; D1069-W1071 VanDerWaalsContact OD1-N 3.07Å; D1069-E1072 WeakPolarHBondContact O-CB 3.49Å; D1069-E1072 PolarHBondContact O-N 3.01Å; D1069-K1136 IonicContact OD1-NZ 3.6Å; D1069-K1136 PolarHBondContact OD1-NZ 3.26Å; D1069-K1136 IonicContact OD2-NZ 2.84Å; D1069-K1136 PolarHBondContact OD2-NZ 3.18Å
1070	E	85	Confident	73.1	Confident	148 Å²	148	88.3 Å²	88.3	69%	0.692	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-16.8	179.8	63.8	-176	-169.1	0	0	114.8	V1103	E1070-V1103 HydrophobicContact CB-CG2 4.36Å; E1070-V1103 HydrophobicContact CG-CG1 4.27Å; E1070-V1103 HydrophobicContact CG-CG2 4.14Å; E1070-V1103 WeakPolarHBondContact O-CG2 3.36Å
1071	W	89	Confident	75.7	Confident	25 Å²	25	87 Å²	87	10%	0.095	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-3.3	178.3	-62.2	77.1	0	0	0	114	D1069 L1073 V1103 K1136 L1146 G1148 V1149	D1069-W1071 PolarHBondContact O-N 2.8Å; D1069-W1071 WeakPolarHBondContact OD1-CB 3.46Å; D1069-W1071 PolarHBondContact OD1-N 2.95Å; D1069-W1071 VanDerWaalsContact OD1-N 3.07Å; W1071-L1073 PolarHBondContact O-N 2.78Å; W1071-V1103 HydrophobicContact CB-CG2 4.42Å; W1071-V1103 HydrophobicContact CD2-CB 4.2Å; W1071-V1103 HydrophobicContact CD2-CG2 3.8Å; W1071-V1103 HydrophobicContact CE3-CB 4.37Å; W1071-V1103 HydrophobicContact CE3-CG2 4.17Å; W1071-V1103 HydrophobicContact CG-CG2 3.92Å; W1071-V1103 HydrophobicContact CH2-CB 4.46Å; W1071-V1103 HydrophobicContact CZ2-CB 4.25Å; W1071-V1103 HydrophobicContact CZ2-CG1 4.22Å; W1071-V1103 HydrophobicContact CZ3-CB 4.5Å; W1071-K1136 HydrophobicContact CB-CD 4.47Å; W1071-K1136 HydrophobicContact CD2-CD 4.28Å; W1071-K1136 HydrophobicContact CD2-CG 3.9Å; W1071-K1136 HydrophobicContact CE3-CG 4.43Å; W1071-K1136 HydrophobicContact CG-CD 3.9Å; W1071-K1136 HydrophobicContact CG-CG 4.06Å; W1071-K1136 HydrophobicContact CZ2-CB 4.35Å; W1071-K1136 HydrophobicContact CZ2-CG 4.39Å; W1071-L1146 HydrophobicContact CD2-CD2 4.32Å; W1071-L1146 HydrophobicContact CE3-CD2 3.59Å; W1071-L1146 HydrophobicContact CE3-CG 3.94Å; W1071-L1146 HydrophobicContact CZ3-CB 4.01Å; W1071-L1146 HydrophobicContact CZ3-CD2 3.74Å; W1071-L1146 HydrophobicContact CZ3-CG 3.88Å; W1071-G1148 CarbonylContact O-C 3.18Å; W1071-G1148 WeakPolarHBondContact O-CA 3.49Å; W1071-V1149 PolarHBondContact O-N 2.84Å
1072	E	91.2	Very high	78.2	Confident	44 Å²	44	87.3 Å²	87.3	21%	0.206	43%	0.426	C	S	.	.	B	Isolated β-bridge	trans	-70.6	127.4	178.4	-169.4	70.4	-154.8	0	0	111.1	P1068 D1069 V1149 V1150 S1151 E1152	P1068-E1072 HydrophobicContact CB-CB 4.2Å; P1068-E1072 HydrophobicContact CB-CG 4.12Å; D1069-E1072 WeakPolarHBondContact O-CB 3.49Å; D1069-E1072 PolarHBondContact O-N 3.01Å; E1072-V1149 CarbonylContact C-O 3.45Å; E1072-V1149 WeakPolarHBondContact CA-O 3.28Å; E1072-V1150 WeakPolarHBondContact OE1-CA 3.32Å; E1072-S1151 PolarHBondContact OE1-N 2.92Å; E1072-S1151 PolarHBondContact OE1-OG 3.38Å; E1072-S1151 WeakPolarHBondContact OE2-CB 3.36Å; E1072-S1151 PolarHBondContact OE2-N 2.68Å; E1072-S1151 PolarHBondContact OE2-OG 2.95Å; E1072-E1152 PolarHBondContact OE1-N 3Å
1073	L	90.9	Very high	80.5	Confident	19 Å²	19	82.6 Å²	82.6	10%	0.099	40%	0.404	C	S	.	.			trans	-108.6	142.3	177.9	-58.2	-179.9	0	0	0	109.9	W1071 R1075 I1078 V1100 F1108 V1149 V1150 V1159	W1071-L1073 PolarHBondContact O-N 2.78Å; L1073-R1075 PolarHBondContact O-N 2.99Å; L1073-I1078 HydrophobicContact CD1-CD1 4.35Å; L1073-V1100 HydrophobicContact CD2-CG1 4.03Å; L1073-F1108 HydrophobicContact CD1-CZ 3.97Å; L1073-V1149 PolarHBondContact N-O 2.9Å; L1073-V1150 HydrophobicContact CB-CG2 4.05Å; L1073-V1150 WeakPolarHBondContact O-CG2 2.97Å; L1073-V1159 HydrophobicContact CD1-CB 4.08Å; L1073-V1159 HydrophobicContact CD1-CG1 4.46Å; L1073-V1159 HydrophobicContact CD1-CG2 4.02Å
1074	R	90	Very high	82.7	Confident	142 Å²	142	79.2 Å²	79.2	54%	0.536	39%	0.386	S	S	.	.			trans	-69.1	130	174.4	-57.1	179.7	-62.4	164.3	-4.6	109.8	E1076 D1077	R1074-E1076 HydrophobicContact CB-CG 3.79Å; R1074-E1076 WeakPolarHBondContact CD-OE1 3.43Å; R1074-E1076 IonicContact CZ-OE1 2.81Å; R1074-E1076 VanDerWaalsContact CZ-OE1 3.25Å; R1074-E1076 IonicContact NE-OE1 2.76Å; R1074-E1076 IonicContact NH1-OE1 2.69Å; R1074-E1076 PolarHBondContact NH1-OE1 3.01Å; R1074-E1076 PolarHBondContact O-N 3.46Å; R1074-E1076 VanDerWaalsContact O-N 3.11Å; R1074-D1077 IonicContact CZ-OD1 3.39Å; R1074-D1077 IonicContact CZ-OD2 2.73Å; R1074-D1077 IonicContact NE-OD2 3.04Å; R1074-D1077 PolarHBondContact NE-OD2 3.02Å; R1074-D1077 IonicContact NH2-OD1 2.63Å; R1074-D1077 PolarHBondContact NH2-OD1 3.45Å; R1074-D1077 IonicContact NH2-OD2 3.97Å; R1074-D1077 PolarHBondContact NH2-OD2 3.34Å; R1074-D1077 WeakPolarHBondContact O-CB 3.45Å; R1074-D1077 PolarHBondContact O-N 2.76Å
1075	R	91.5	Very high	84.5	Confident	85 Å²	85	75.6 Å²	75.6	32%	0.321	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-55.2	-32	178.4	-171	169.8	-71.7	-94.1	-3.3	113.3	L1073 D1077 I1078 V1150 E1152 G1153 P1155	L1073-R1075 PolarHBondContact O-N 2.99Å; R1075-D1077 PolarHBondContact O-N 3.46Å; R1075-I1078 PolarHBondContact O-N 2.92Å; R1075-V1150 HydrophobicContact CB-CG1 3.77Å; R1075-V1150 HydrophobicContact CG-CG1 4.27Å; R1075-E1152 VanDerWaalsContact CZ-O 3.26Å; R1075-E1152 PolarHBondContact NE-O 2.76Å; R1075-E1152 PolarHBondContact NH2-O 2.72Å; R1075-G1153 PolarHBondContact NH2-O 3.15Å; R1075-P1155 VanDerWaalsContact CZ-O 3.3Å; R1075-P1155 PolarHBondContact NH1-O 3.02Å; R1075-P1155 PolarHBondContact NH2-O 2.89Å
1076	E	90.3	Very high	85.8	Confident	116 Å²	116	78.9 Å²	78.9	54%	0.542	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-66.8	-16.7	176.9	55.1	172.1	-178.1	0	0	114.6	R1074 K1098	R1074-E1076 HydrophobicContact CB-CG 3.79Å; R1074-E1076 WeakPolarHBondContact CD-OE1 3.43Å; R1074-E1076 IonicContact CZ-OE1 2.81Å; R1074-E1076 VanDerWaalsContact CZ-OE1 3.25Å; R1074-E1076 IonicContact NE-OE1 2.76Å; R1074-E1076 IonicContact NH1-OE1 2.69Å; R1074-E1076 PolarHBondContact NH1-OE1 3.01Å; R1074-E1076 PolarHBondContact O-N 3.46Å; R1074-E1076 VanDerWaalsContact O-N 3.11Å; E1076-K1098 VanDerWaalsContact O-CE 3.25Å; E1076-K1098 WeakPolarHBondContact O-CE 3.47Å; E1076-K1098 PolarHBondContact O-NZ 2.78Å
1077	D	92.1	Very high	86	Confident	23 Å²	23	79.5 Å²	79.5	12%	0.123	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-90	-6.8	-179.4	-70.7	-35.3	0	0	0	113.9	R1074 R1075 A1097 K1098 V1100	R1074-D1077 IonicContact CZ-OD1 3.39Å; R1074-D1077 IonicContact CZ-OD2 2.73Å; R1074-D1077 IonicContact NE-OD2 3.04Å; R1074-D1077 PolarHBondContact NE-OD2 3.02Å; R1074-D1077 IonicContact NH2-OD1 2.63Å; R1074-D1077 PolarHBondContact NH2-OD1 3.45Å; R1074-D1077 IonicContact NH2-OD2 3.97Å; R1074-D1077 PolarHBondContact NH2-OD2 3.34Å; R1074-D1077 WeakPolarHBondContact O-CB 3.45Å; R1074-D1077 PolarHBondContact O-N 2.76Å; R1075-D1077 PolarHBondContact O-N 3.46Å; D1077-A1097 WeakPolarHBondContact O-CA 3.44Å; D1077-K1098 PolarHBondContact O-N 3Å; D1077-V1100 HydrophobicContact CB-CG2 3.66Å
1078	I	92.7	Very high	85.9	Confident	16 Å²	16	79.7 Å²	79.7	8%	0.082	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	115.9	-174.6	-54.7	-62.4	0	0	0	111.2	L1073 R1075 A1097 F1108 V1113 L1157 V1159	L1073-I1078 HydrophobicContact CD1-CD1 4.35Å; R1075-I1078 PolarHBondContact O-N 2.92Å; I1078-A1097 HydrophobicContact CD1-CB 3.78Å; I1078-F1108 HydrophobicContact CD1-CE2 4.01Å; I1078-F1108 HydrophobicContact CD1-CZ 4.33Å; I1078-V1113 HydrophobicContact CG2-CG2 4.03Å; I1078-L1157 HydrophobicContact CG2-CD1 4.43Å; I1078-V1159 HydrophobicContact CD1-CG1 4.21Å; I1078-V1159 HydrophobicContact CD1-CG2 4.3Å; I1078-V1159 HydrophobicContact CG1-CG2 4.27Å; I1078-V1159 HydrophobicContact CG2-CG2 4.45Å
1079	E	93.1	Very high	85.3	Confident	108 Å²	108	83.3 Å²	83.3	51%	0.505	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	132.3	173.5	177.9	179.7	-140.4	0	0	110.1	G1095 R1096	E1079-G1095 CarbonylContact O-C 3.35Å; E1079-G1095 WeakPolarHBondContact O-CA 3.25Å; E1079-R1096 HydrophobicContact CB-CB 4.29Å; E1079-R1096 WeakPolarHBondContact CB-O 3.13Å; E1079-R1096 PolarHBondContact N-O 3.25Å; E1079-R1096 PolarHBondContact O-N 3.01Å; E1079-R1096 IonicContact OE2-NH1 2.72Å
1080	L	90.8	Very high	85.1	Confident	74 Å²	74	80.7 Å²	80.7	39%	0.387	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	127.3	172.5	-59	-179.6	0	0	0	109.7	Y1093 V1113	L1080-Y1093 HydrophobicContact CD2-CG 4.48Å; L1080-V1113 HydrophobicContact CD2-CB 3.77Å; L1080-V1113 HydrophobicContact CD2-CG1 3.74Å; L1080-V1113 HydrophobicContact CD2-CG2 4.05Å
1081	V	91.5	Very high	85.2	Confident	80 Å²	80	74.6 Å²	74.6	49%	0.485	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	-64.3	-171.3	-175.7	0	0	0	0	112.1	A1094 R1096	V1081-A1094 HydrophobicContact CB-CB 4.47Å; V1081-A1094 WeakPolarHBondContact CB-O 3.45Å; V1081-A1094 PolarHBondContact N-O 2.9Å; V1081-R1096 HydrophobicContact CG2-CB 4.24Å
1082	N	90.6	Very high	85.2	Confident	83 Å²	83	75.2 Å²	75.2	44%	0.444	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	151.2	-179.5	67.8	-90.5	0	0	0	111.7	I1084 Y1093 A1094	N1082-I1084 VanDerWaalsContact ND2-CG2 3.35Å; N1082-I1084 WeakPolarHBondContact ND2-CG2 3.37Å; N1082-Y1093 CarbonylContact O-C 3.52Å; N1082-Y1093 WeakPolarHBondContact O-CA 3.31Å; N1082-A1094 PolarHBondContact O-N 3.39Å
1083	E	89.6	Confident	85.3	Confident	77 Å²	77	76.3 Å²	76.3	36%	0.36	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	133.7	172.9	-173.2	168.8	166	0	0	109.9	R1086 T1091 Y1093	E1083-R1086 VanDerWaalsContact CD-NH2 3.26Å; E1083-R1086 IonicContact OE1-CZ 2.72Å; E1083-R1086 VanDerWaalsContact OE1-CZ 3.25Å; E1083-R1086 IonicContact OE1-NE 3.45Å; E1083-R1086 PolarHBondContact OE1-NE 3.13Å; E1083-R1086 IonicContact OE1-NH2 2.73Å; E1083-R1086 PolarHBondContact OE1-NH2 3.03Å; E1083-R1086 IonicContact OE2-CZ 3.67Å; E1083-R1086 IonicContact OE2-NH2 3.41Å; E1083-R1086 PolarHBondContact OE2-NH2 3.39Å; E1083-T1091 VanDerWaalsContact CD-CG2 3.43Å; E1083-T1091 HydrophobicContact CG-CG2 3.61Å; E1083-Y1093 HydrophobicContact CB-CD1 4.33Å; E1083-Y1093 HydrophobicContact CB-CE1 4.15Å
1084	I	86.3	Confident	85.3	Confident	85 Å²	85	76 Å²	76	44%	0.436	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	-11	177.9	60.5	173.7	0	0	0	113.1	N1082 V1092 A1094 A1112 M1162	N1082-I1084 VanDerWaalsContact ND2-CG2 3.35Å; N1082-I1084 WeakPolarHBondContact ND2-CG2 3.37Å; I1084-V1092 HydrophobicContact CD1-CG1 3.92Å; I1084-V1092 HydrophobicContact CG1-CB 4.12Å; I1084-V1092 HydrophobicContact CG1-CG1 3.84Å; I1084-V1092 WeakPolarHBondContact CG1-O 3.38Å; I1084-V1092 PolarHBondContact N-O 3.17Å; I1084-A1094 HydrophobicContact CG2-CB 3.88Å; I1084-A1112 HydrophobicContact CD1-CB 4.17Å; I1084-M1162 HydrophobicContact CD1-CE 4.11Å; I1084-M1162 HydrophobicContact CD1-SD 4.17Å
1085	G	80.1	Confident	85.4	Confident	29 Å²	29	69.5 Å²	69.5	30%	0.299	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.7	153.9	173.7	0	0	0	0	0	112.9	V1092	G1085-V1092 PolarHBondContact N-O 2.89Å; G1085-V1092 PolarHBondContact O-N 2.89Å
1086	R	83	Confident	85.5	Confident	182 Å²	182	71.8 Å²	71.8	69%	0.687	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.1	140.8	176.1	-165.9	177.8	-65.1	-158.5	-3.4	109.6	E1083	E1083-R1086 VanDerWaalsContact CD-NH2 3.26Å; E1083-R1086 IonicContact OE1-CZ 2.72Å; E1083-R1086 VanDerWaalsContact OE1-CZ 3.25Å; E1083-R1086 IonicContact OE1-NE 3.45Å; E1083-R1086 PolarHBondContact OE1-NE 3.13Å; E1083-R1086 IonicContact OE1-NH2 2.73Å; E1083-R1086 PolarHBondContact OE1-NH2 3.03Å; E1083-R1086 IonicContact OE2-CZ 3.67Å; E1083-R1086 IonicContact OE2-NH2 3.41Å; E1083-R1086 PolarHBondContact OE2-NH2 3.39Å
1087	G	67.6	Low	85.5	Confident	49 Å²	49	66.5 Å²	66.5	51%	0.505	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	-177.9	177.3	0	0	0	0	0	112.1	F1089 G1090	G1087-F1089 PolarHBondContact O-N 2.84Å; G1087-F1089 VanDerWaalsContact O-N 3.12Å; G1087-G1090 PolarHBondContact N-O 3.46Å; G1087-G1090 PolarHBondContact O-N 3.21Å; G1087-G1090 VanDerWaalsContact O-N 3.17Å; G1087-G1090 VanDerWaalsContact O-O 3.14Å
1088	T	62.2	Low	85.3	Confident	139 Å²	139	72.1 Å²	72.1	85%	0.853	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-24.7	178.2	23.7	0	0	0	0	113.9
1089	F	63	Low	84.8	Confident	153 Å²	153	77.3 Å²	77.3	67%	0.671	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	15.9	-177.8	-51.4	-75.2	0	0	0	114.1	G1087	G1087-F1089 PolarHBondContact O-N 2.84Å; G1087-F1089 VanDerWaalsContact O-N 3.12Å
1090	G	77	Confident	84.4	Confident	17 Å²	17	73 Å²	73	18%	0.175	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	120.7	-159.8	176.3	0	0	0	0	0	115.1	G1087 T1115	G1087-G1090 PolarHBondContact N-O 3.46Å; G1087-G1090 PolarHBondContact O-N 3.21Å; G1087-G1090 VanDerWaalsContact O-N 3.17Å; G1087-G1090 VanDerWaalsContact O-O 3.14Å; G1090-T1115 WeakPolarHBondContact CA-O 3.43Å
1091	T	87.4	Confident	84.2	Confident	20 Å²	20	77.8 Å²	77.8	12%	0.123	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	144.6	-175.1	-49	0	0	0	0	109.8	E1083 Y1093 K1114 T1115	E1083-T1091 VanDerWaalsContact CD-CG2 3.43Å; E1083-T1091 HydrophobicContact CG-CG2 3.61Å; T1091-Y1093 HydrophobicContact CG2-CD2 4.19Å; T1091-Y1093 HydrophobicContact CG2-CE2 3.59Å; T1091-K1114 CarbonylContact O-C 3.57Å; T1091-K1114 WeakPolarHBondContact O-CA 3.45Å; T1091-T1115 PolarHBondContact N-O 3.05Å; T1091-T1115 PolarHBondContact O-N 3.4Å
1092	V	89.1	Confident	83.9	Confident	38 Å²	38	74.2 Å²	74.2	23%	0.23	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	127.1	174.6	-168.8	0	0	0	0	108.7	I1084 G1085 A1112 V1113 K1114	I1084-V1092 HydrophobicContact CD1-CG1 3.92Å; I1084-V1092 HydrophobicContact CG1-CB 4.12Å; I1084-V1092 HydrophobicContact CG1-CG1 3.84Å; I1084-V1092 WeakPolarHBondContact CG1-O 3.38Å; I1084-V1092 PolarHBondContact N-O 3.17Å; G1085-V1092 PolarHBondContact N-O 2.89Å; G1085-V1092 PolarHBondContact O-N 2.89Å; V1092-A1112 HydrophobicContact CG1-CB 4.14Å; V1092-V1113 WeakPolarHBondContact CA-O 2.91Å; V1092-K1114 HydrophobicContact CG2-CB 4.47Å; V1092-K1114 HydrophobicContact CG2-CG 4.18Å
1093	Y	91.9	Very high	83.6	Confident	67 Å²	67	73.2 Å²	73.2	26%	0.263	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	150	174.1	-67.1	-95.2	0	0	0	110.5	L1080 N1082 E1083 T1091 A1112 V1113 T1115	L1080-Y1093 HydrophobicContact CD2-CG 4.48Å; N1082-Y1093 CarbonylContact O-C 3.52Å; N1082-Y1093 WeakPolarHBondContact O-CA 3.31Å; E1083-Y1093 HydrophobicContact CB-CD1 4.33Å; E1083-Y1093 HydrophobicContact CB-CE1 4.15Å; T1091-Y1093 HydrophobicContact CG2-CD2 4.19Å; T1091-Y1093 HydrophobicContact CG2-CE2 3.59Å; Y1093-A1112 CarbonylContact O-C 3.16Å; Y1093-A1112 WeakPolarHBondContact O-CA 3.42Å; Y1093-V1113 PolarHBondContact N-O 2.84Å; Y1093-V1113 PolarHBondContact O-N 3.34Å; Y1093-T1115 HydrophobicContact CD2-CG2 3.95Å; Y1093-T1115 HydrophobicContact CE2-CG2 3.71Å
1094	A	91.8	Very high	83	Confident	13 Å²	13	72.2 Å²	72.2	11%	0.107	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	136.7	151	0	0	0	0	0	108.2	V1081 N1082 I1084 M1162	V1081-A1094 HydrophobicContact CB-CB 4.47Å; V1081-A1094 WeakPolarHBondContact CB-O 3.45Å; V1081-A1094 PolarHBondContact N-O 2.9Å; N1082-A1094 PolarHBondContact O-N 3.39Å; I1084-A1094 HydrophobicContact CG2-CB 3.88Å; A1094-M1162 HydrophobicContact CB-CE 3.61Å
1095	G	91.6	Very high	82.8	Confident	6 Å²	6	69.8 Å²	69.8	6%	0.062	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	155.4	179.8	0	0	0	0	0	112.4	E1079 C1111	E1079-G1095 CarbonylContact O-C 3.35Å; E1079-G1095 WeakPolarHBondContact O-CA 3.25Å; G1095-C1111 PolarHBondContact N-O 2.64Å; G1095-C1111 PolarHBondContact O-N 2.71Å; G1095-C1111 PolarHBondContact O-SG 2.85Å
1096	R	93.4	Very high	82.9	Confident	132 Å²	132	71.1 Å²	71.1	50%	0.498	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126	175.4	177	173.2	-72.2	142.4	-2.2	110.1	E1079 V1081 G1109	E1079-R1096 HydrophobicContact CB-CB 4.29Å; E1079-R1096 WeakPolarHBondContact CB-O 3.13Å; E1079-R1096 PolarHBondContact N-O 3.25Å; E1079-R1096 PolarHBondContact O-N 3.01Å; E1079-R1096 IonicContact OE2-NH1 2.72Å; V1081-R1096 HydrophobicContact CG2-CB 4.24Å; R1096-G1109 CarbonylContact C-O 3.53Å; R1096-G1109 VanDerWaalsContact CA-O 3.29Å; R1096-G1109 WeakPolarHBondContact CA-O 3.47Å
1097	A	90	Very high	83.1	Confident	5 Å²	5	66 Å²	66	4%	0.041	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	147.4	176.8	0	0	0	0	0	111.1	D1077 I1078 N1099 V1100 F1108 G1109	D1077-A1097 WeakPolarHBondContact O-CA 3.44Å; I1078-A1097 HydrophobicContact CD1-CB 3.78Å; A1097-N1099 PolarHBondContact O-N 3.19Å; A1097-V1100 HydrophobicContact CB-CB 4.37Å; A1097-V1100 HydrophobicContact CB-CG2 4Å; A1097-F1108 HydrophobicContact CB-CD2 3.45Å; A1097-F1108 VanDerWaalsContact CB-CD2 3.45Å; A1097-F1108 HydrophobicContact CB-CE2 3.31Å; A1097-F1108 HydrophobicContact CB-CG 4.44Å; A1097-F1108 HydrophobicContact CB-CZ 4.19Å; A1097-G1109 PolarHBondContact N-O 2.92Å
1098	K	89.3	Confident	84.1	Confident	141 Å²	141	63.9 Å²	63.9	61%	0.613	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.7	53	-179.5	-63.8	-179.1	-178.3	164.1	0	113.3	E1076 D1077 V1100	E1076-K1098 VanDerWaalsContact O-CE 3.25Å; E1076-K1098 WeakPolarHBondContact O-CE 3.47Å; E1076-K1098 PolarHBondContact O-NZ 2.78Å; D1077-K1098 PolarHBondContact O-N 3Å; K1098-V1100 VanDerWaalsContact C-N 3.29Å; K1098-V1100 PolarHBondContact O-N 2.83Å
1099	N	81.5	Confident	85.3	Confident	126 Å²	126	58.6 Å²	58.6	67%	0.674	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	52.2	46.4	-172	-65.1	-36.3	0	0	0	112.4	A1097 V1107 F1108	A1097-N1099 PolarHBondContact O-N 3.19Å; N1099-V1107 HydrophobicContact CB-CG1 4.07Å; N1099-F1108 WeakPolarHBondContact CA-O 3.28Å
1100	V	84.1	Confident	86.6	Confident	17 Å²	17	58 Å²	58	10%	0.103	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	137.8	-176.2	-178	0	0	0	0	109.7	L1073 D1077 A1097 K1098 V1107 F1108	L1073-V1100 HydrophobicContact CD2-CG1 4.03Å; D1077-V1100 HydrophobicContact CB-CG2 3.66Å; A1097-V1100 HydrophobicContact CB-CB 4.37Å; A1097-V1100 HydrophobicContact CB-CG2 4Å; K1098-V1100 VanDerWaalsContact C-N 3.29Å; K1098-V1100 PolarHBondContact O-N 2.83Å; V1100-V1107 VanDerWaalsContact O-CA 3.31Å; V1100-V1107 WeakPolarHBondContact O-CA 3.49Å; V1100-F1108 HydrophobicContact CB-CD1 4.39Å; V1100-F1108 HydrophobicContact CB-CE1 3.72Å; V1100-F1108 HydrophobicContact CB-CE2 4.37Å; V1100-F1108 HydrophobicContact CB-CZ 3.71Å; V1100-F1108 HydrophobicContact CG1-CE1 3.8Å; V1100-F1108 HydrophobicContact CG1-CZ 3.86Å; V1100-F1108 PolarHBondContact N-O 2.64Å; V1100-F1108 WeakPolarHBondContact O-CD1 3.26Å; V1100-F1108 WeakPolarHBondContact O-CE1 3.17Å; V1100-F1108 PolarHBondContact O-N 3.15Å
1101	R	87.4	Confident	87.4	Confident	174 Å²	174	57.1 Å²	57.1	66%	0.657	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	118	170.5	-174.3	-179	-62.6	-79.1	5.8	109.3	G1105 V1107	R1101-G1105 PolarHBondContact NH1-O 3.47Å; R1101-V1107 HydrophobicContact CB-CG2 4.26Å; R1101-V1107 HydrophobicContact CG-CG2 4.41Å
1102	S	86.1	Confident	87.7	Confident	6 Å²	6	56.5 Å²	56.5	4%	0.042	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-74.3	165.6	171	59.3	0	0	0	0	112.4	C1104 G1105 V1106 Y1147	S1102-C1104 PolarHBondContact O-N 2.94Å; S1102-G1105 WeakPolarHBondContact O-CA 3.3Å; S1102-G1105 PolarHBondContact O-N 3.17Å; S1102-V1106 PolarHBondContact N-O 3.32Å; S1102-V1106 WeakPolarHBondContact OG-CB 3.25Å; S1102-V1106 PolarHBondContact OG-N 3.14Å; S1102-V1106 PolarHBondContact OG-O 3.46Å; S1102-Y1147 WeakPolarHBondContact CB-O 3.45Å
1103	V	84.1	Confident	87.9	Confident	61 Å²	61	54.7 Å²	54.7	37%	0.37	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-41.4	173.8	-177.1	0	0	0	0	111.6	E1070 W1071 G1105	E1070-V1103 HydrophobicContact CB-CG2 4.36Å; E1070-V1103 HydrophobicContact CG-CG1 4.27Å; E1070-V1103 HydrophobicContact CG-CG2 4.14Å; E1070-V1103 WeakPolarHBondContact O-CG2 3.36Å; W1071-V1103 HydrophobicContact CB-CG2 4.42Å; W1071-V1103 HydrophobicContact CD2-CB 4.2Å; W1071-V1103 HydrophobicContact CD2-CG2 3.8Å; W1071-V1103 HydrophobicContact CE3-CB 4.37Å; W1071-V1103 HydrophobicContact CE3-CG2 4.17Å; W1071-V1103 HydrophobicContact CG-CG2 3.92Å; W1071-V1103 HydrophobicContact CH2-CB 4.46Å; W1071-V1103 HydrophobicContact CZ2-CB 4.25Å; W1071-V1103 HydrophobicContact CZ2-CG1 4.22Å; W1071-V1103 HydrophobicContact CZ3-CB 4.5Å; V1103-G1105 PolarHBondContact O-N 3.45Å
1104	C	76.7	Confident	87.9	Confident	57 Å²	57	52.6 Å²	52.6	39%	0.385	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	11.5	175.5	-54.5	0	0	0	0	114.4	S1102 V1106	S1102-C1104 PolarHBondContact O-N 2.94Å; C1104-V1106 PolarHBondContact O-N 3.39Å; C1104-V1106 VanDerWaalsContact O-N 3.08Å
1105	G	80.9	Confident	87.9	Confident	34 Å²	34	52.2 Å²	52.2	35%	0.351	27%	0.273	S	S	.	.	S	Bend	trans	75.4	-11.8	178.4	0	0	0	0	0	115.5	R1101 S1102 V1103 V1107	R1101-G1105 PolarHBondContact NH1-O 3.47Å; S1102-G1105 WeakPolarHBondContact O-CA 3.3Å; S1102-G1105 PolarHBondContact O-N 3.17Å; V1103-G1105 PolarHBondContact O-N 3.45Å; G1105-V1107 PolarHBondContact O-N 2.95Å
1106	V	82.2	Confident	87.5	Confident	57 Å²	57	52.6 Å²	52.6	35%	0.345	27%	0.274	S	S	.	.			trans	-66.5	123.7	179.7	-176.7	0	0	0	0	109.6	S1102 C1104 Y1147	S1102-V1106 PolarHBondContact N-O 3.32Å; S1102-V1106 WeakPolarHBondContact OG-CB 3.25Å; S1102-V1106 PolarHBondContact OG-N 3.14Å; S1102-V1106 PolarHBondContact OG-O 3.46Å; C1104-V1106 PolarHBondContact O-N 3.39Å; C1104-V1106 VanDerWaalsContact O-N 3.08Å; V1106-Y1147 HydrophobicContact CG1-CE1 4.31Å
1107	V	88.1	Confident	86.7	Confident	73 Å²	73	49.4 Å²	49.4	44%	0.442	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	117	167.2	178.5	0	0	0	0	107.6	N1099 V1100 R1101 G1105	N1099-V1107 HydrophobicContact CB-CG1 4.07Å; V1100-V1107 VanDerWaalsContact O-CA 3.31Å; V1100-V1107 WeakPolarHBondContact O-CA 3.49Å; R1101-V1107 HydrophobicContact CB-CG2 4.26Å; R1101-V1107 HydrophobicContact CG-CG2 4.41Å; G1105-V1107 PolarHBondContact O-N 2.95Å
1108	F	87.7	Confident	85.9	Confident	6 Å²	6	56.1 Å²	56.1	3%	0.026	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	148.8	-174.3	63.9	-81.4	0	0	0	112.3	L1073 I1078 A1097 N1099 V1100 C1111 Y1147 V1159	L1073-F1108 HydrophobicContact CD1-CZ 3.97Å; I1078-F1108 HydrophobicContact CD1-CE2 4.01Å; I1078-F1108 HydrophobicContact CD1-CZ 4.33Å; A1097-F1108 HydrophobicContact CB-CD2 3.45Å; A1097-F1108 VanDerWaalsContact CB-CD2 3.45Å; A1097-F1108 HydrophobicContact CB-CE2 3.31Å; A1097-F1108 HydrophobicContact CB-CG 4.44Å; A1097-F1108 HydrophobicContact CB-CZ 4.19Å; N1099-F1108 WeakPolarHBondContact CA-O 3.28Å; V1100-F1108 HydrophobicContact CB-CD1 4.39Å; V1100-F1108 HydrophobicContact CB-CE1 3.72Å; V1100-F1108 HydrophobicContact CB-CE2 4.37Å; V1100-F1108 HydrophobicContact CB-CZ 3.71Å; V1100-F1108 HydrophobicContact CG1-CE1 3.8Å; V1100-F1108 HydrophobicContact CG1-CZ 3.86Å; V1100-F1108 PolarHBondContact N-O 2.64Å; V1100-F1108 WeakPolarHBondContact O-CD1 3.26Å; V1100-F1108 WeakPolarHBondContact O-CE1 3.17Å; V1100-F1108 PolarHBondContact O-N 3.15Å; F1108-C1111 HydrophobicContact CD2-CB 4.11Å; F1108-C1111 HydrophobicContact CE2-CB 4.45Å; F1108-Y1147 HydrophobicContact CB-CD2 3.82Å; F1108-Y1147 HydrophobicContact CB-CE2 3.64Å; F1108-Y1147 HydrophobicContact CB-CG 4.41Å; F1108-Y1147 AromaticContact CD1-CD2 3.98Å; F1108-Y1147 HydrophobicContact CD1-CD2 3.98Å; F1108-Y1147 AromaticContact CD1-CG 3.92Å; F1108-Y1147 HydrophobicContact CD1-CG 3.92Å; F1108-Y1147 AromaticContact CD2-CD2 3.45Å; F1108-Y1147 HydrophobicContact CD2-CD2 3.45Å; F1108-Y1147 VanDerWaalsContact CD2-CD2 3.45Å; F1108-Y1147 HydrophobicContact CD2-CE2 4.01Å; F1108-Y1147 HydrophobicContact CD2-CG 4.16Å; F1108-Y1147 HydrophobicContact CE1-CD2 4.43Å; F1108-Y1147 HydrophobicContact CE1-CG 4.2Å; F1108-Y1147 AromaticContact CE2-CD2 3.93Å; F1108-Y1147 HydrophobicContact CE2-CD2 3.93Å; F1108-Y1147 HydrophobicContact CE2-CG 4.4Å; F1108-Y1147 AromaticContact CG-CD2 3.47Å; F1108-Y1147 HydrophobicContact CG-CD2 3.47Å; F1108-Y1147 VanDerWaalsContact CG-CD2 3.47Å; F1108-Y1147 AromaticContact CG-CE2 3.86Å; F1108-Y1147 HydrophobicContact CG-CE2 3.86Å; F1108-Y1147 AromaticContact CG-CG 3.91Å; F1108-Y1147 HydrophobicContact CG-CG 3.91Å; F1108-Y1147 HydrophobicContact CZ-CD2 4.4Å; F1108-Y1147 HydrophobicContact CZ-CG 4.43Å; F1108-V1159 HydrophobicContact CE2-CG1 3.68Å; F1108-V1159 HydrophobicContact CZ-CG1 4.2Å
1109	G	87.3	Confident	85	Confident	27 Å²	27	58.4 Å²	58.4	28%	0.278	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	-57.3	-178.9	0	0	0	0	0	111.4	R1096 A1097	R1096-G1109 CarbonylContact C-O 3.53Å; R1096-G1109 VanDerWaalsContact CA-O 3.29Å; R1096-G1109 WeakPolarHBondContact CA-O 3.47Å; A1097-G1109 PolarHBondContact N-O 2.92Å
1110	E	91.3	Very high	84.3	Confident	140 Å²	140	53.4 Å²	53.4	65%	0.654	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	139	167.5	-62.1	-169.4	147.1	0	0	110.4
1111	C	93.7	Very high	83.6	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	160.6	179.7	58.7	0	0	0	0	110.8	G1095 F1108 Y1147 V1159 M1160 M1162	G1095-C1111 PolarHBondContact N-O 2.64Å; G1095-C1111 PolarHBondContact O-N 2.71Å; G1095-C1111 PolarHBondContact O-SG 2.85Å; F1108-C1111 HydrophobicContact CD2-CB 4.11Å; F1108-C1111 HydrophobicContact CE2-CB 4.45Å; C1111-Y1147 HydrophobicContact CB-CD2 4.03Å; C1111-Y1147 HydrophobicContact CB-CE2 4.14Å; C1111-V1159 HydrophobicContact CB-CG1 3.87Å; C1111-M1160 CarbonylContact C-O 3.51Å; C1111-M1160 WeakPolarHBondContact CA-O 3.26Å; C1111-M1160 WeakPolarHBondContact CB-O 3.46Å; C1111-M1162 WeakPolarHBondContact O-CE 3.27Å
1112	A	93.2	Very high	82.6	Confident	6 Å²	6	53.7 Å²	53.7	5%	0.05	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	140.1	161.7	0	0	0	0	0	109	I1084 V1092 Y1093 M1160	I1084-A1112 HydrophobicContact CD1-CB 4.17Å; V1092-A1112 HydrophobicContact CG1-CB 4.14Å; Y1093-A1112 CarbonylContact O-C 3.16Å; Y1093-A1112 WeakPolarHBondContact O-CA 3.42Å; A1112-M1160 HydrophobicContact CB-CG 3.99Å; A1112-M1160 HydrophobicContact CB-SD 4.33Å; A1112-M1160 PolarHBondContact N-O 2.91Å; A1112-M1160 WeakPolarHBondContact O-CG 3.26Å; A1112-M1160 PolarHBondContact O-N 3.22Å
1113	V	93.7	Very high	81.5	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	105.7	-178.8	-172.2	0	0	0	0	109.1	I1078 L1080 V1092 Y1093 L1157 V1158 V1159	I1078-V1113 HydrophobicContact CG2-CG2 4.03Å; L1080-V1113 HydrophobicContact CD2-CB 3.77Å; L1080-V1113 HydrophobicContact CD2-CG1 3.74Å; L1080-V1113 HydrophobicContact CD2-CG2 4.05Å; V1092-V1113 WeakPolarHBondContact CA-O 2.91Å; Y1093-V1113 PolarHBondContact N-O 2.84Å; Y1093-V1113 PolarHBondContact O-N 3.34Å; V1113-L1157 HydrophobicContact CG1-CB 3.76Å; V1113-L1157 HydrophobicContact CG1-CD1 4.32Å; V1113-L1157 HydrophobicContact CG1-CD2 4.03Å; V1113-L1157 HydrophobicContact CG1-CG 4.25Å; V1113-V1158 CarbonylContact C-O 3.48Å; V1113-V1158 WeakPolarHBondContact CA-O 3.04Å; V1113-V1159 HydrophobicContact CG1-CG2 4.36Å; V1113-V1159 HydrophobicContact CG2-CG1 4.44Å; V1113-V1159 HydrophobicContact CG2-CG2 4.4Å
1114	K	91.5	Very high	80.9	Confident	24 Å²	24	61.6 Å²	61.6	10%	0.104	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	140.9	171.7	-164.4	-170.3	-175.6	-175.2	0	108.8	T1091 V1092 F1128 E1131 V1158	T1091-K1114 CarbonylContact O-C 3.57Å; T1091-K1114 WeakPolarHBondContact O-CA 3.45Å; V1092-K1114 HydrophobicContact CG2-CB 4.47Å; V1092-K1114 HydrophobicContact CG2-CG 4.18Å; K1114-F1128 HydrophobicContact CB-CE2 4.27Å; K1114-F1128 HydrophobicContact CD-CD2 4.48Å; K1114-F1128 HydrophobicContact CD-CE2 3.97Å; K1114-F1128 HydrophobicContact CG-CE2 3.93Å; K1114-F1128 WeakPolarHBondContact O-CZ 3.38Å; K1114-E1131 IonicContact NZ-OE1 3.29Å; K1114-E1131 PolarHBondContact NZ-OE1 3.38Å; K1114-E1131 IonicContact NZ-OE2 3.68Å; K1114-E1131 PolarHBondContact NZ-OE2 2.93Å; K1114-V1158 HydrophobicContact CB-CB 4.33Å; K1114-V1158 PolarHBondContact N-O 3.35Å; K1114-V1158 PolarHBondContact O-N 2.95Å
1115	T	90.9	Very high	80.8	Confident	5 Å²	5	63.1 Å²	63.1	3%	0.031	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	149.1	177.4	-166.6	0	0	0	0	112.2	G1090 T1091 Y1093 P1155 A1156	G1090-T1115 WeakPolarHBondContact CA-O 3.43Å; T1091-T1115 PolarHBondContact N-O 3.05Å; T1091-T1115 PolarHBondContact O-N 3.4Å; Y1093-T1115 HydrophobicContact CD2-CG2 3.95Å; Y1093-T1115 HydrophobicContact CE2-CG2 3.71Å; T1115-P1155 WeakPolarHBondContact OG1-CB 3.27Å; T1115-P1155 WeakPolarHBondContact OG1-CG 3.42Å; T1115-A1156 WeakPolarHBondContact CB-O 3.49Å; T1115-A1156 PolarHBondContact OG1-O 2.78Å
1116	V	83.9	Confident	80.3	Confident	14 Å²	14	66 Å²	66	9%	0.085	33%	0.332	C	S	.	.			trans	-76.4	164.1	172.7	-66.4	0	0	0	0	111.3	A1120 F1128 P1155	V1116-A1120 HydrophobicContact CB-CB 3.79Å; V1116-A1120 HydrophobicContact CG2-CB 4.03Å; V1116-F1128 HydrophobicContact CG1-CB 3.59Å; V1116-F1128 HydrophobicContact CG1-CD1 4.01Å; V1116-F1128 HydrophobicContact CG1-CD2 3.64Å; V1116-F1128 HydrophobicContact CG1-CE2 4.28Å; V1116-F1128 HydrophobicContact CG1-CG 3.48Å; V1116-F1128 VanDerWaalsContact CG1-CG 3.48Å; V1116-P1155 HydrophobicContact CG2-CB 4.1Å; V1116-P1155 WeakPolarHBondContact O-CB 3.37Å
1117	S	76.9	Confident	79.8	Confident	64 Å²	64	69.2 Å²	69.2	45%	0.448	34%	0.343	S	S	.	.			trans	-61.1	147.4	170.5	-172.9	0	0	0	0	111	K1119 A1120	S1117-K1119 PolarHBondContact O-N 3.31Å; S1117-K1119 PolarHBondContact OG-N 3.12Å; S1117-A1120 WeakPolarHBondContact O-CB 3.47Å; S1117-A1120 PolarHBondContact O-N 3.21Å
1118	E	72.8	Confident	79.5	Confident	147 Å²	147	66 Å²	66	69%	0.687	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-24	167.5	-60.7	176.4	156.2	0	0	112.8
1119	K	71.8	Confident	79.3	Confident	189 Å²	189	66.4 Å²	66.4	82%	0.822	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	9.4	-180	-61.8	172.2	-174	166.6	0	113.4	S1117	S1117-K1119 PolarHBondContact O-N 3.31Å; S1117-K1119 PolarHBondContact OG-N 3.12Å
1120	A	66.4	Low	78.8	Confident	21 Å²	21	68.4 Å²	68.4	17%	0.174	33%	0.329	C	S	.	.			trans	-64.4	143.6	176	0	0	0	0	0	110.7	V1116 S1117 D1124	V1116-A1120 HydrophobicContact CB-CB 3.79Å; V1116-A1120 HydrophobicContact CG2-CB 4.03Å; S1117-A1120 WeakPolarHBondContact O-CB 3.47Å; S1117-A1120 PolarHBondContact O-N 3.21Å; A1120-D1124 HydrophobicContact CB-CB 3.83Å
1121	S	69.3	Low	78.1	Confident	51 Å²	51	65.4 Å²	65.4	36%	0.357	32%	0.315	S	S	.	.			trans	-71.8	169.9	177.4	72.5	0	0	0	0	111.9	Y1123 D1124 R1125	S1121-Y1123 PolarHBondContact O-N 3.07Å; S1121-Y1123 PolarHBondContact OG-N 2.87Å; S1121-D1124 WeakPolarHBondContact CA-OD2 3.38Å; S1121-D1124 VanDerWaalsContact CB-OD2 3.23Å; S1121-D1124 WeakPolarHBondContact CB-OD2 3.42Å; S1121-D1124 PolarHBondContact N-OD2 2.78Å; S1121-D1124 PolarHBondContact O-N 2.98Å; S1121-D1124 PolarHBondContact OG-N 2.95Å; S1121-D1124 VanDerWaalsContact OG-N 3.1Å; S1121-D1124 PolarHBondContact OG-OD2 3.36Å; S1121-R1125 PolarHBondContact O-N 3.5Å
1122	I	65.4	Low	77.6	Confident	146 Å²	146	65.5 Å²	65.5	75%	0.749	32%	0.316	S	S	*	.	H	α-helix	trans	-60	-36.5	172.5	-63.4	171.4	0	0	0	110.4	R1125 W1126	I1122-R1125 PolarHBondContact O-N 3.33Å; I1122-W1126 VanDerWaalsContact O-CB 3.31Å; I1122-W1126 WeakPolarHBondContact O-CB 3.38Å; I1122-W1126 PolarHBondContact O-N 3.4Å
1123	Y	64.2	Low	77	Confident	148 Å²	148	67.4 Å²	67.4	58%	0.58	33%	0.329	S	S	*	.	H	α-helix	trans	-67.4	-40.8	175.7	-67.4	-78.3	0	0	0	112.8	S1121 W1126 H1127	S1121-Y1123 PolarHBondContact O-N 3.07Å; S1121-Y1123 PolarHBondContact OG-N 2.87Å; Y1123-W1126 PolarHBondContact O-N 2.95Å; Y1123-H1127 PolarHBondContact O-N 2.9Å
1124	D	70.3	Confident	76.3	Confident	85 Å²	85	70.8 Å²	70.8	46%	0.455	35%	0.349	S	S	.	.	H	α-helix	trans	-63	-42.9	175.2	-61.5	-57.8	0	0	0	111.1	A1120 S1121 W1126 F1128	A1120-D1124 HydrophobicContact CB-CB 3.83Å; S1121-D1124 WeakPolarHBondContact CA-OD2 3.38Å; S1121-D1124 VanDerWaalsContact CB-OD2 3.23Å; S1121-D1124 WeakPolarHBondContact CB-OD2 3.42Å; S1121-D1124 PolarHBondContact N-OD2 2.78Å; S1121-D1124 PolarHBondContact O-N 2.98Å; S1121-D1124 PolarHBondContact OG-N 2.95Å; S1121-D1124 VanDerWaalsContact OG-N 3.1Å; S1121-D1124 PolarHBondContact OG-OD2 3.36Å; D1124-W1126 VanDerWaalsContact C-N 3.34Å; D1124-F1128 WeakPolarHBondContact O-CB 3.4Å; D1124-F1128 PolarHBondContact O-N 2.83Å
1125	R	76.1	Confident	75.9	Confident	89 Å²	89	71 Å²	71	34%	0.336	35%	0.351	S	S	.	.	H	α-helix	trans	-63.3	-38.7	174	-177	-178.3	178	-160.6	-0	111.7	S1121 I1122 L1129 S1151	S1121-R1125 PolarHBondContact O-N 3.5Å; I1122-R1125 PolarHBondContact O-N 3.33Å; R1125-L1129 HydrophobicContact CG-CD1 4.13Å; R1125-L1129 WeakPolarHBondContact O-CG 3.34Å; R1125-L1129 PolarHBondContact O-N 2.96Å; R1125-S1151 PolarHBondContact NH2-O 3.4Å
1126	W	70	Confident	75.6	Confident	93 Å²	93	72.7 Å²	72.7	35%	0.352	36%	0.358	S	S	.	.	H	α-helix	trans	-67.4	-49.5	178.7	178.8	81	0	0	0	111.8	I1122 Y1123 D1124 F1128 L1129 I1130	I1122-W1126 VanDerWaalsContact O-CB 3.31Å; I1122-W1126 WeakPolarHBondContact O-CB 3.38Å; I1122-W1126 PolarHBondContact O-N 3.4Å; Y1123-W1126 PolarHBondContact O-N 2.95Å; D1124-W1126 VanDerWaalsContact C-N 3.34Å; W1126-F1128 VanDerWaalsContact C-N 3.3Å; W1126-F1128 PolarHBondContact O-N 2.89Å; W1126-L1129 PolarHBondContact O-N 2.76Å; W1126-I1130 HydrophobicContact CD2-CD1 3.71Å; W1126-I1130 VanDerWaalsContact CE2-CD1 3.45Å; W1126-I1130 HydrophobicContact CE3-CD1 3.89Å; W1126-I1130 HydrophobicContact CG-CD1 4.46Å; W1126-I1130 HydrophobicContact CH2-CD1 3.62Å; W1126-I1130 HydrophobicContact CZ2-CD1 3.43Å; W1126-I1130 VanDerWaalsContact CZ2-CD1 3.43Å; W1126-I1130 HydrophobicContact CZ3-CD1 3.84Å; W1126-I1130 PolarHBondContact O-N 2.67Å
1127	H	70.7	Confident	75.5	Confident	125 Å²	125	78.8 Å²	78.8	58%	0.579	38%	0.383	S	S	*	.	H	α-helix	trans	-58.5	-40.9	173.9	-101.7	-73.5	0	0	0	112.5	Y1123 I1130 E1131	Y1123-H1127 PolarHBondContact O-N 2.9Å; H1127-I1130 PolarHBondContact O-N 2.9Å; H1127-E1131 PolarHBondContact O-N 2.04Å
1128	F	82.4	Confident	75.7	Confident	7 Å²	7	80.6 Å²	80.6	3%	0.031	38%	0.383	C	S	.	.	H	α-helix	trans	-63.4	-38.9	176.3	172.6	-97.8	0	0	0	113.2	K1114 V1116 D1124 W1126 E1131 A1132 A1156 V1158	K1114-F1128 HydrophobicContact CB-CE2 4.27Å; K1114-F1128 HydrophobicContact CD-CD2 4.48Å; K1114-F1128 HydrophobicContact CD-CE2 3.97Å; K1114-F1128 HydrophobicContact CG-CE2 3.93Å; K1114-F1128 WeakPolarHBondContact O-CZ 3.38Å; V1116-F1128 HydrophobicContact CG1-CB 3.59Å; V1116-F1128 HydrophobicContact CG1-CD1 4.01Å; V1116-F1128 HydrophobicContact CG1-CD2 3.64Å; V1116-F1128 HydrophobicContact CG1-CE2 4.28Å; V1116-F1128 HydrophobicContact CG1-CG 3.48Å; V1116-F1128 VanDerWaalsContact CG1-CG 3.48Å; D1124-F1128 WeakPolarHBondContact O-CB 3.4Å; D1124-F1128 PolarHBondContact O-N 2.83Å; W1126-F1128 VanDerWaalsContact C-N 3.3Å; W1126-F1128 PolarHBondContact O-N 2.89Å; F1128-E1131 PolarHBondContact O-N 2.97Å; F1128-A1132 PolarHBondContact O-N 3.13Å; F1128-A1156 HydrophobicContact CD1-CB 4.16Å; F1128-A1156 HydrophobicContact CE1-CB 3.78Å; F1128-A1156 WeakPolarHBondContact CE1-O 3.24Å; F1128-V1158 HydrophobicContact CD1-CG2 4.47Å; F1128-V1158 HydrophobicContact CE1-CG2 3.69Å; F1128-V1158 HydrophobicContact CE2-CB 4.41Å; F1128-V1158 HydrophobicContact CE2-CG2 4.07Å; F1128-V1158 HydrophobicContact CZ-CB 3.92Å; F1128-V1158 HydrophobicContact CZ-CG2 3.46Å; F1128-V1158 VanDerWaalsContact CZ-CG2 3.46Å
1129	L	83.9	Confident	76	Confident	14 Å²	14	79 Å²	79	7%	0.073	38%	0.379	C	S	.	.	H	α-helix	trans	-75.5	-26.7	175.1	-70.1	171.2	0	0	0	112.6	Y1066 R1125 W1126 A1132 S1133 V1149	Y1066-L1129 HydrophobicContact CD1-CD1 4.44Å; Y1066-L1129 HydrophobicContact CD2-CB 3.93Å; Y1066-L1129 HydrophobicContact CD2-CD2 4.24Å; Y1066-L1129 HydrophobicContact CD2-CG 4.49Å; Y1066-L1129 HydrophobicContact CE2-CD2 4.37Å; Y1066-L1129 HydrophobicContact CG-CB 4.16Å; Y1066-L1129 HydrophobicContact CG-CD1 4.12Å; Y1066-L1129 HydrophobicContact CG-CD2 4.34Å; Y1066-L1129 HydrophobicContact CG-CG 4.44Å; R1125-L1129 HydrophobicContact CG-CD1 4.13Å; R1125-L1129 WeakPolarHBondContact O-CG 3.34Å; R1125-L1129 PolarHBondContact O-N 2.96Å; W1126-L1129 PolarHBondContact O-N 2.76Å; L1129-A1132 PolarHBondContact O-N 3.02Å; L1129-S1133 PolarHBondContact O-N 3.45Å; L1129-S1133 PolarHBondContact O-OG 3.3Å; L1129-S1133 VanDerWaalsContact O-OG 3.1Å; L1129-V1149 HydrophobicContact CD2-CG1 3.8Å
1130	I	76.1	Confident	76.3	Confident	68 Å²	68	72.4 Å²	72.4	35%	0.349	36%	0.355	S	S	.	.	H	α-helix	trans	-66.8	-43.2	169.2	-74.8	173.8	0	0	0	111.1	W1126 H1127 A1132 S1133 V1134	W1126-I1130 HydrophobicContact CD2-CD1 3.71Å; W1126-I1130 VanDerWaalsContact CE2-CD1 3.45Å; W1126-I1130 HydrophobicContact CE3-CD1 3.89Å; W1126-I1130 HydrophobicContact CG-CD1 4.46Å; W1126-I1130 HydrophobicContact CH2-CD1 3.62Å; W1126-I1130 HydrophobicContact CZ2-CD1 3.43Å; W1126-I1130 VanDerWaalsContact CZ2-CD1 3.43Å; W1126-I1130 HydrophobicContact CZ3-CD1 3.84Å; W1126-I1130 PolarHBondContact O-N 2.67Å; H1127-I1130 PolarHBondContact O-N 2.9Å; I1130-A1132 VanDerWaalsContact C-N 3.27Å; I1130-A1132 PolarHBondContact O-N 3.23Å; I1130-S1133 CarbonylContact O-C 3.23Å; I1130-S1133 PolarHBondContact O-N 2.94Å; I1130-S1133 VanDerWaalsContact O-N 3.11Å; I1130-V1134 WeakPolarHBondContact O-CG2 3.34Å; I1130-V1134 PolarHBondContact O-N 3.36Å
1131	E	77.2	Confident	76.9	Confident	78 Å²	78	76 Å²	76	36%	0.364	39%	0.385	S	S	.	.	H	α-helix	trans	-56.4	-43.7	174.2	-171.5	-174.1	168	0	0	111.1	K1114 H1127 F1128 V1134 M1135	K1114-E1131 IonicContact NZ-OE1 3.29Å; K1114-E1131 PolarHBondContact NZ-OE1 3.38Å; K1114-E1131 IonicContact NZ-OE2 3.68Å; K1114-E1131 PolarHBondContact NZ-OE2 2.93Å; H1127-E1131 PolarHBondContact O-N 2.04Å; F1128-E1131 PolarHBondContact O-N 2.97Å; E1131-V1134 PolarHBondContact O-N 3.29Å; E1131-M1135 WeakPolarHBondContact O-CG 3.4Å; E1131-M1135 PolarHBondContact O-N 3.17Å
1132	A	82.7	Confident	77.5	Confident	1 Å²	1	82.8 Å²	82.8	1%	0.008	41%	0.408	C	S	.	.	H	α-helix	trans	-61.8	-43.3	174	0	0	0	0	0	112.9	F1128 L1129 I1130 V1134 M1135 K1136 V1149 V1158	F1128-A1132 PolarHBondContact O-N 3.13Å; L1129-A1132 PolarHBondContact O-N 3.02Å; I1130-A1132 VanDerWaalsContact C-N 3.27Å; I1130-A1132 PolarHBondContact O-N 3.23Å; A1132-V1134 VanDerWaalsContact C-N 3.3Å; A1132-V1134 PolarHBondContact O-N 2.82Å; A1132-M1135 WeakPolarHBondContact O-CB 3.06Å; A1132-M1135 PolarHBondContact O-N 3.13Å; A1132-M1135 VanDerWaalsContact O-N 3.16Å; A1132-K1136 PolarHBondContact O-N 3.09Å; A1132-V1149 HydrophobicContact CB-CG2 3.87Å; A1132-V1158 HydrophobicContact CB-CG2 3.62Å
1133	S	80.5	Confident	78.3	Confident	46 Å²	46	79.4 Å²	79.4	32%	0.322	39%	0.391	S	S	.	.	H	α-helix	trans	-67.2	-27.4	176.5	-66.6	0	0	0	0	113.7	L1129 I1130	L1129-S1133 PolarHBondContact O-N 3.45Å; L1129-S1133 PolarHBondContact O-OG 3.3Å; L1129-S1133 VanDerWaalsContact O-OG 3.1Å; I1130-S1133 CarbonylContact O-C 3.23Å; I1130-S1133 PolarHBondContact O-N 2.94Å; I1130-S1133 VanDerWaalsContact O-N 3.11Å
1134	V	79.4	Confident	79.3	Confident	71 Å²	71	74.5 Å²	74.5	43%	0.43	38%	0.376	S	S	.	.	H	α-helix	trans	-72.2	-42.3	169.3	168.6	0	0	0	0	110.3	I1130 E1131 A1132 K1136 K1137 F1138	I1130-V1134 WeakPolarHBondContact O-CG2 3.34Å; I1130-V1134 PolarHBondContact O-N 3.36Å; E1131-V1134 PolarHBondContact O-N 3.29Å; A1132-V1134 VanDerWaalsContact C-N 3.3Å; A1132-V1134 PolarHBondContact O-N 2.82Å; V1134-K1136 VanDerWaalsContact C-N 3.27Å; V1134-K1136 PolarHBondContact O-N 3.17Å; V1134-K1137 WeakPolarHBondContact O-CB 3.01Å; V1134-K1137 PolarHBondContact O-N 3.48Å; V1134-K1137 VanDerWaalsContact O-N 3.15Å; V1134-F1138 HydrophobicContact CG1-CE2 3.92Å; V1134-F1138 WeakPolarHBondContact O-CD2 3.15Å; V1134-F1138 WeakPolarHBondContact O-CE2 3.47Å
1135	M	83.5	Confident	80.2	Confident	29 Å²	29	73.2 Å²	73.2	14%	0.143	37%	0.367	C	S	.	.	H	α-helix	trans	-59.1	-32.7	177.5	-76.7	-166.5	74.9	0	0	114	E1131 A1132 K1137 F1138 V1144 L1146 V1158 M1160	E1131-M1135 WeakPolarHBondContact O-CG 3.4Å; E1131-M1135 PolarHBondContact O-N 3.17Å; A1132-M1135 WeakPolarHBondContact O-CB 3.06Å; A1132-M1135 PolarHBondContact O-N 3.13Å; A1132-M1135 VanDerWaalsContact O-N 3.16Å; M1135-K1137 PolarHBondContact O-N 3.02Å; M1135-F1138 PolarHBondContact O-N 3.37Å; M1135-F1138 VanDerWaalsContact O-N 3.15Å; M1135-V1144 VanDerWaalsContact CE-O 3.25Å; M1135-V1144 WeakPolarHBondContact CE-O 3.41Å; M1135-L1146 HydrophobicContact CB-CB 4.34Å; M1135-L1146 HydrophobicContact CB-CD2 4.1Å; M1135-L1146 HydrophobicContact CE-CB 4.21Å; M1135-V1158 HydrophobicContact SD-CG1 4.47Å; M1135-M1160 HydrophobicContact CE-CE 3.65Å; M1135-M1160 HydrophobicContact SD-CE 3.84Å
1136	K	85	Confident	80.9	Confident	40 Å²	40	69.3 Å²	69.3	17%	0.174	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-19.1	175.6	-67.7	177.7	-177.3	-178.1	0	114.3	Y1066 D1069 W1071 A1132 V1134 L1146	Y1066-K1136 PolarHBondContact OH-NZ 3.03Å; D1069-K1136 IonicContact OD1-NZ 3.6Å; D1069-K1136 PolarHBondContact OD1-NZ 3.26Å; D1069-K1136 IonicContact OD2-NZ 2.84Å; D1069-K1136 PolarHBondContact OD2-NZ 3.18Å; W1071-K1136 HydrophobicContact CB-CD 4.47Å; W1071-K1136 HydrophobicContact CD2-CD 4.28Å; W1071-K1136 HydrophobicContact CD2-CG 3.9Å; W1071-K1136 HydrophobicContact CE3-CG 4.43Å; W1071-K1136 HydrophobicContact CG-CD 3.9Å; W1071-K1136 HydrophobicContact CG-CG 4.06Å; W1071-K1136 HydrophobicContact CZ2-CB 4.35Å; W1071-K1136 HydrophobicContact CZ2-CG 4.39Å; A1132-K1136 PolarHBondContact O-N 3.09Å; V1134-K1136 VanDerWaalsContact C-N 3.27Å; V1134-K1136 PolarHBondContact O-N 3.17Å; K1136-L1146 HydrophobicContact CG-CD2 3.74Å
1137	K	81.8	Confident	82	Confident	142 Å²	142	66.1 Å²	66.1	62%	0.617	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-0.3	-177.7	-60.2	-179.4	-178.7	176.1	0	114.5	V1134 M1135	V1134-K1137 WeakPolarHBondContact O-CB 3.01Å; V1134-K1137 PolarHBondContact O-N 3.48Å; V1134-K1137 VanDerWaalsContact O-N 3.15Å; M1135-K1137 PolarHBondContact O-N 3.02Å
1138	F	79.3	Confident	83	Confident	102 Å²	102	60.1 Å²	60.1	45%	0.447	31%	0.313	S	S	.	.			trans	-122	112.1	-174.5	-57.5	-82.4	0	0	0	112.8	V1134 M1135 I1143	V1134-F1138 HydrophobicContact CG1-CE2 3.92Å; V1134-F1138 WeakPolarHBondContact O-CD2 3.15Å; V1134-F1138 WeakPolarHBondContact O-CE2 3.47Å; M1135-F1138 PolarHBondContact O-N 3.37Å; M1135-F1138 VanDerWaalsContact O-N 3.15Å; F1138-I1143 HydrophobicContact CB-CD1 4.11Å; F1138-I1143 HydrophobicContact CB-CG2 4.36Å; F1138-I1143 HydrophobicContact CD1-CD1 3.49Å; F1138-I1143 VanDerWaalsContact CD1-CD1 3.49Å; F1138-I1143 HydrophobicContact CE1-CD1 4.07Å; F1138-I1143 HydrophobicContact CG-CD1 3.89Å
1139	D	79.8	Confident	83.5	Confident	113 Å²	113	59.8 Å²	59.8	60%	0.604	31%	0.311	S	S	*	.			trans	-118.1	104.1	160.7	-174.2	19.8	0	0	0	109.7	K1145	D1139-K1145 VanDerWaalsContact OD1-CE 3.31Å; D1139-K1145 WeakPolarHBondContact OD1-CE 3.35Å; D1139-K1145 IonicContact OD1-NZ 2.8Å; D1139-K1145 PolarHBondContact OD1-NZ 3.01Å
1140	T	79.3	Confident	83.9	Confident	51 Å²	51	59.2 Å²	59.2	31%	0.313	31%	0.308	S	S	.	.	S	Bend	trans	-160.2	157.2	-178.2	-179.8	0	0	0	0	110.9	F1142 I1143	T1140-F1142 PolarHBondContact O-N 3.31Å; T1140-I1143 HydrophobicContact CG2-CB 3.73Å; T1140-I1143 HydrophobicContact CG2-CD1 3.76Å; T1140-I1143 HydrophobicContact CG2-CG1 3.67Å
1141	A	78.9	Confident	84.4	Confident	96 Å²	96	56.3 Å²	56.3	79%	0.793	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-3.3	177.9	0	0	0	0	0	114.1
1142	F	80.8	Confident	84.5	Confident	194 Å²	194	59.3 Å²	59.3	85%	0.851	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	-0.5	-176.8	-55.7	-66	0	0	0	114.1	T1140	T1140-F1142 PolarHBondContact O-N 3.31Å
1143	I	81.5	Confident	84.2	Confident	75 Å²	75	61.4 Å²	61.4	39%	0.385	33%	0.33	S	S	.	.	S	Bend	trans	-131.7	138.4	-179.8	-60.9	176.6	0	0	0	107.4	F1138 T1140 K1145	F1138-I1143 HydrophobicContact CB-CD1 4.11Å; F1138-I1143 HydrophobicContact CB-CG2 4.36Å; F1138-I1143 HydrophobicContact CD1-CD1 3.49Å; F1138-I1143 VanDerWaalsContact CD1-CD1 3.49Å; F1138-I1143 HydrophobicContact CE1-CD1 4.07Å; F1138-I1143 HydrophobicContact CG-CD1 3.89Å; T1140-I1143 HydrophobicContact CG2-CB 3.73Å; T1140-I1143 HydrophobicContact CG2-CD1 3.76Å; T1140-I1143 HydrophobicContact CG2-CG1 3.67Å; I1143-K1145 PolarHBondContact O-N 2.87Å
1144	V	86.3	Confident	83.9	Confident	45 Å²	45	65.1 Å²	65.1	27%	0.273	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-61.4	122.6	179.7	-176.6	0	0	0	0	109.4	M1135 M1160 E1161 M1163	M1135-V1144 VanDerWaalsContact CE-O 3.25Å; M1135-V1144 WeakPolarHBondContact CE-O 3.41Å; V1144-M1160 HydrophobicContact CG1-CB 4.23Å; V1144-M1160 HydrophobicContact CG1-CE 4.29Å; V1144-M1160 HydrophobicContact CG1-SD 4.19Å; V1144-E1161 HydrophobicContact CG1-CB 3.91Å; V1144-M1163 HydrophobicContact CG1-CG 4.21Å; V1144-M1163 HydrophobicContact CG2-CG 3.8Å; V1144-M1163 HydrophobicContact CG2-SD 4.14Å
1145	K	88.1	Confident	84.1	Confident	59 Å²	59	62.9 Å²	62.9	26%	0.257	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-70.4	139.8	-174.5	-62.9	-162.4	-178.6	-153.2	0	112.7	D1139 I1143 Y1147 M1160 E1161	D1139-K1145 VanDerWaalsContact OD1-CE 3.31Å; D1139-K1145 WeakPolarHBondContact OD1-CE 3.35Å; D1139-K1145 IonicContact OD1-NZ 2.8Å; D1139-K1145 PolarHBondContact OD1-NZ 3.01Å; I1143-K1145 PolarHBondContact O-N 2.87Å; K1145-Y1147 HydrophobicContact CB-CE1 4.4Å; K1145-M1160 CarbonylContact O-C 3.5Å; K1145-M1160 VanDerWaalsContact O-CA 3.23Å; K1145-M1160 WeakPolarHBondContact O-CA 3.12Å; K1145-M1160 VanDerWaalsContact O-CB 3.31Å; K1145-M1160 WeakPolarHBondContact O-CB 3.03Å; K1145-E1161 HydrophobicContact CB-CB 4.34Å; K1145-E1161 PolarHBondContact N-OE2 2.89Å; K1145-E1161 PolarHBondContact O-N 3.32Å
1146	L	91.6	Very high	84.3	Confident	6 Å²	6	61.5 Å²	61.5	3%	0.031	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	134.3	166.1	-175.3	68	0	0	0	109	W1071 M1135 K1136 V1158	W1071-L1146 HydrophobicContact CD2-CD2 4.32Å; W1071-L1146 HydrophobicContact CE3-CD2 3.59Å; W1071-L1146 HydrophobicContact CE3-CG 3.94Å; W1071-L1146 HydrophobicContact CZ3-CB 4.01Å; W1071-L1146 HydrophobicContact CZ3-CD2 3.74Å; W1071-L1146 HydrophobicContact CZ3-CG 3.88Å; M1135-L1146 HydrophobicContact CB-CB 4.34Å; M1135-L1146 HydrophobicContact CB-CD2 4.1Å; M1135-L1146 HydrophobicContact CE-CB 4.21Å; K1136-L1146 HydrophobicContact CG-CD2 3.74Å; L1146-V1158 HydrophobicContact CD1-CG1 3.71Å
1147	Y	92.3	Very high	84.6	Confident	26 Å²	26	59.8 Å²	59.8	10%	0.102	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-26.5	171.5	-63.9	-25.6	0	0	0	112.4	S1102 V1106 F1108 C1111 K1145 V1159 E1161	S1102-Y1147 WeakPolarHBondContact CB-O 3.45Å; V1106-Y1147 HydrophobicContact CG1-CE1 4.31Å; F1108-Y1147 HydrophobicContact CB-CD2 3.82Å; F1108-Y1147 HydrophobicContact CB-CE2 3.64Å; F1108-Y1147 HydrophobicContact CB-CG 4.41Å; F1108-Y1147 AromaticContact CD1-CD2 3.98Å; F1108-Y1147 HydrophobicContact CD1-CD2 3.98Å; F1108-Y1147 AromaticContact CD1-CG 3.92Å; F1108-Y1147 HydrophobicContact CD1-CG 3.92Å; F1108-Y1147 AromaticContact CD2-CD2 3.45Å; F1108-Y1147 HydrophobicContact CD2-CD2 3.45Å; F1108-Y1147 VanDerWaalsContact CD2-CD2 3.45Å; F1108-Y1147 HydrophobicContact CD2-CE2 4.01Å; F1108-Y1147 HydrophobicContact CD2-CG 4.16Å; F1108-Y1147 HydrophobicContact CE1-CD2 4.43Å; F1108-Y1147 HydrophobicContact CE1-CG 4.2Å; F1108-Y1147 AromaticContact CE2-CD2 3.93Å; F1108-Y1147 HydrophobicContact CE2-CD2 3.93Å; F1108-Y1147 HydrophobicContact CE2-CG 4.4Å; F1108-Y1147 AromaticContact CG-CD2 3.47Å; F1108-Y1147 HydrophobicContact CG-CD2 3.47Å; F1108-Y1147 VanDerWaalsContact CG-CD2 3.47Å; F1108-Y1147 AromaticContact CG-CE2 3.86Å; F1108-Y1147 HydrophobicContact CG-CE2 3.86Å; F1108-Y1147 AromaticContact CG-CG 3.91Å; F1108-Y1147 HydrophobicContact CG-CG 3.91Å; F1108-Y1147 HydrophobicContact CZ-CD2 4.4Å; F1108-Y1147 HydrophobicContact CZ-CG 4.43Å; C1111-Y1147 HydrophobicContact CB-CD2 4.03Å; C1111-Y1147 HydrophobicContact CB-CE2 4.14Å; K1145-Y1147 HydrophobicContact CB-CE1 4.4Å; Y1147-V1159 HydrophobicContact CD2-CG1 4.43Å; Y1147-V1159 PolarHBondContact N-O 3.25Å; Y1147-E1161 HydrophobicContact CE1-CB 4.33Å; Y1147-E1161 HydrophobicContact CE2-CB 4.46Å
1148	G	92.2	Very high	85.1	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.1	-175	172.7	0	0	0	0	0	113.2	W1071 V1159	W1071-G1148 CarbonylContact O-C 3.18Å; W1071-G1148 WeakPolarHBondContact O-CA 3.49Å; G1148-V1159 PolarHBondContact N-O 3.07Å; G1148-V1159 PolarHBondContact O-N 2.86Å
1149	V	93	Very high	85.8	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	143	-174	-176.1	0	0	0	0	109.3	Y1066 W1071 E1072 L1073 L1129 A1132 L1157	Y1066-V1149 HydrophobicContact CE2-CG1 4.49Å; W1071-V1149 PolarHBondContact O-N 2.84Å; E1072-V1149 CarbonylContact C-O 3.45Å; E1072-V1149 WeakPolarHBondContact CA-O 3.28Å; L1073-V1149 PolarHBondContact N-O 2.9Å; L1129-V1149 HydrophobicContact CD2-CG1 3.8Å; A1132-V1149 HydrophobicContact CB-CG2 3.87Å; V1149-L1157 CarbonylContact C-O 3.41Å; V1149-L1157 WeakPolarHBondContact CA-O 3.36Å
1150	V	91.8	Very high	86.4	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.006	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	93	166.4	-170.4	0	0	0	0	107.4	E1072 L1073 R1075 A1156 L1157	E1072-V1150 WeakPolarHBondContact OE1-CA 3.32Å; L1073-V1150 HydrophobicContact CB-CG2 4.05Å; L1073-V1150 WeakPolarHBondContact O-CG2 2.97Å; R1075-V1150 HydrophobicContact CB-CG1 3.77Å; R1075-V1150 HydrophobicContact CG-CG1 4.27Å; V1150-A1156 CarbonylContact O-C 3.56Å; V1150-A1156 WeakPolarHBondContact O-CA 3.18Å; V1150-L1157 HydrophobicContact CB-CB 3.85Å; V1150-L1157 HydrophobicContact CB-CD1 4.14Å; V1150-L1157 HydrophobicContact CB-CG 4.07Å; V1150-L1157 HydrophobicContact CG2-CB 4.02Å; V1150-L1157 HydrophobicContact CG2-CD1 4Å; V1150-L1157 HydrophobicContact CG2-CG 4.37Å; V1150-L1157 PolarHBondContact N-O 3.4Å; V1150-L1157 PolarHBondContact O-N 2.98Å
1151	S	87.4	Confident	86.9	Confident	8 Å²	8	45.2 Å²	45.2	6%	0.056	24%	0.244	C	C	.	.			trans	-83.8	-26.3	176.6	72.2	0	0	0	0	112.2	Y1066 E1072 R1125	Y1066-S1151 VanDerWaalsContact CE1-CB 3.4Å; Y1066-S1151 WeakPolarHBondContact CE1-OG 3.31Å; E1072-S1151 PolarHBondContact OE1-N 2.92Å; E1072-S1151 PolarHBondContact OE1-OG 3.38Å; E1072-S1151 WeakPolarHBondContact OE2-CB 3.36Å; E1072-S1151 PolarHBondContact OE2-N 2.68Å; E1072-S1151 PolarHBondContact OE2-OG 2.95Å; R1125-S1151 PolarHBondContact NH2-O 3.4Å
1152	E	80.3	Confident	87.5	Confident	140 Å²	140	43.4 Å²	43.4	65%	0.654	22%	0.22	S	C	*	.	S	Bend	trans	-74.7	132.8	175.8	-67.5	-160.8	158.8	0	0	113.2	E1072 R1075	E1072-E1152 PolarHBondContact OE1-N 3Å; R1075-E1152 VanDerWaalsContact CZ-O 3.26Å; R1075-E1152 PolarHBondContact NE-O 2.76Å; R1075-E1152 PolarHBondContact NH2-O 2.72Å
1153	G	75.7	Confident	87.8	Confident	46 Å²	46	39.2 Å²	39.2	47%	0.474	20%	0.204	S	C	.	.	S	Bend	trans	78	178.2	-173.8	0	0	0	0	0	114	R1075	R1075-G1153 PolarHBondContact NH2-O 3.15Å
1154	Q	73.2	Confident	87.8	Confident	123 Å²	123	40.2 Å²	40.2	58%	0.575	22%	0.224	S	C	*	.	S	Bend	trans	-133.6	138.9	-176	-163.8	168.6	-2.6	0	0	110.2
1155	P	84	Confident	87.6	Confident	24 Å²	24	42.5 Å²	42.5	16%	0.156	24%	0.241	C	C	.	.	S	Bend	cis	-72.9	154.6	-6.3	35	-37.2	0	0	0	112	R1075 T1115 V1116	R1075-P1155 VanDerWaalsContact CZ-O 3.3Å; R1075-P1155 PolarHBondContact NH1-O 3.02Å; R1075-P1155 PolarHBondContact NH2-O 2.89Å; T1115-P1155 WeakPolarHBondContact OG1-CB 3.27Å; T1115-P1155 WeakPolarHBondContact OG1-CG 3.42Å; V1116-P1155 HydrophobicContact CG2-CB 4.1Å; V1116-P1155 WeakPolarHBondContact O-CB 3.37Å
1156	A	87.5	Confident	87.2	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.254	C	S	.	.			trans	-69.7	148.4	175.8	0	0	0	0	0	110.8	T1115 F1128 V1150	T1115-A1156 WeakPolarHBondContact CB-O 3.49Å; T1115-A1156 PolarHBondContact OG1-O 2.78Å; F1128-A1156 HydrophobicContact CD1-CB 4.16Å; F1128-A1156 HydrophobicContact CE1-CB 3.78Å; F1128-A1156 WeakPolarHBondContact CE1-O 3.24Å; V1150-A1156 CarbonylContact O-C 3.56Å; V1150-A1156 WeakPolarHBondContact O-CA 3.18Å
1157	L	92.3	Very high	86.6	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.021	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	141	-175.5	-47.3	178.3	0	0	0	110.9	I1078 V1113 V1149 V1150	I1078-L1157 HydrophobicContact CG2-CD1 4.43Å; V1113-L1157 HydrophobicContact CG1-CB 3.76Å; V1113-L1157 HydrophobicContact CG1-CD1 4.32Å; V1113-L1157 HydrophobicContact CG1-CD2 4.03Å; V1113-L1157 HydrophobicContact CG1-CG 4.25Å; V1149-L1157 CarbonylContact C-O 3.41Å; V1149-L1157 WeakPolarHBondContact CA-O 3.36Å; V1150-L1157 HydrophobicContact CB-CB 3.85Å; V1150-L1157 HydrophobicContact CB-CD1 4.14Å; V1150-L1157 HydrophobicContact CB-CG 4.07Å; V1150-L1157 HydrophobicContact CG2-CB 4.02Å; V1150-L1157 HydrophobicContact CG2-CD1 4Å; V1150-L1157 HydrophobicContact CG2-CG 4.37Å; V1150-L1157 PolarHBondContact N-O 3.4Å; V1150-L1157 PolarHBondContact O-N 2.98Å
1158	V	92.4	Very high	85.9	Confident	5 Å²	5	50.6 Å²	50.6	3%	0.03	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	115.1	168.8	168.7	0	0	0	0	107.3	V1113 K1114 F1128 A1132 M1135 L1146	V1113-V1158 CarbonylContact C-O 3.48Å; V1113-V1158 WeakPolarHBondContact CA-O 3.04Å; K1114-V1158 HydrophobicContact CB-CB 4.33Å; K1114-V1158 PolarHBondContact N-O 3.35Å; K1114-V1158 PolarHBondContact O-N 2.95Å; F1128-V1158 HydrophobicContact CD1-CG2 4.47Å; F1128-V1158 HydrophobicContact CE1-CG2 3.69Å; F1128-V1158 HydrophobicContact CE2-CB 4.41Å; F1128-V1158 HydrophobicContact CE2-CG2 4.07Å; F1128-V1158 HydrophobicContact CZ-CB 3.92Å; F1128-V1158 HydrophobicContact CZ-CG2 3.46Å; F1128-V1158 VanDerWaalsContact CZ-CG2 3.46Å; A1132-V1158 HydrophobicContact CB-CG2 3.62Å; M1135-V1158 HydrophobicContact SD-CG1 4.47Å; L1146-V1158 HydrophobicContact CD1-CG1 3.71Å
1159	V	93.6	Very high	85	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	124.8	-169.8	-173.1	0	0	0	0	109	L1073 I1078 F1108 C1111 V1113 Y1147 G1148	L1073-V1159 HydrophobicContact CD1-CB 4.08Å; L1073-V1159 HydrophobicContact CD1-CG1 4.46Å; L1073-V1159 HydrophobicContact CD1-CG2 4.02Å; I1078-V1159 HydrophobicContact CD1-CG1 4.21Å; I1078-V1159 HydrophobicContact CD1-CG2 4.3Å; I1078-V1159 HydrophobicContact CG1-CG2 4.27Å; I1078-V1159 HydrophobicContact CG2-CG2 4.45Å; F1108-V1159 HydrophobicContact CE2-CG1 3.68Å; F1108-V1159 HydrophobicContact CZ-CG1 4.2Å; C1111-V1159 HydrophobicContact CB-CG1 3.87Å; V1113-V1159 HydrophobicContact CG1-CG2 4.36Å; V1113-V1159 HydrophobicContact CG2-CG1 4.44Å; V1113-V1159 HydrophobicContact CG2-CG2 4.4Å; Y1147-V1159 HydrophobicContact CD2-CG1 4.43Å; Y1147-V1159 PolarHBondContact N-O 3.25Å; G1148-V1159 PolarHBondContact N-O 3.07Å; G1148-V1159 PolarHBondContact O-N 2.86Å
1160	M	91.7	Very high	84.2	Confident	31 Å²	31	59.6 Å²	59.6	15%	0.153	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	169.9	-168.9	49.5	161	42.3	0	0	112.6	C1111 A1112 M1135 V1144 K1145	C1111-M1160 CarbonylContact C-O 3.51Å; C1111-M1160 WeakPolarHBondContact CA-O 3.26Å; C1111-M1160 WeakPolarHBondContact CB-O 3.46Å; A1112-M1160 HydrophobicContact CB-CG 3.99Å; A1112-M1160 HydrophobicContact CB-SD 4.33Å; A1112-M1160 PolarHBondContact N-O 2.91Å; A1112-M1160 WeakPolarHBondContact O-CG 3.26Å; A1112-M1160 PolarHBondContact O-N 3.22Å; M1135-M1160 HydrophobicContact CE-CE 3.65Å; M1135-M1160 HydrophobicContact SD-CE 3.84Å; V1144-M1160 HydrophobicContact CG1-CB 4.23Å; V1144-M1160 HydrophobicContact CG1-CE 4.29Å; V1144-M1160 HydrophobicContact CG1-SD 4.19Å; K1145-M1160 CarbonylContact O-C 3.5Å; K1145-M1160 VanDerWaalsContact O-CA 3.23Å; K1145-M1160 WeakPolarHBondContact O-CA 3.12Å; K1145-M1160 VanDerWaalsContact O-CB 3.31Å; K1145-M1160 WeakPolarHBondContact O-CB 3.03Å
1161	E	91.3	Very high	83.6	Confident	66 Å²	66	63.6 Å²	63.6	31%	0.308	36%	0.358	S	S	.	.			trans	-59.6	140.6	177.4	178.6	172.2	-149.4	0	0	113.8	V1144 K1145 Y1147 M1163	V1144-E1161 HydrophobicContact CG1-CB 3.91Å; K1145-E1161 HydrophobicContact CB-CB 4.34Å; K1145-E1161 PolarHBondContact N-OE2 2.89Å; K1145-E1161 PolarHBondContact O-N 3.32Å; Y1147-E1161 HydrophobicContact CE1-CB 4.33Å; Y1147-E1161 HydrophobicContact CE2-CB 4.46Å; E1161-M1163 PolarHBondContact O-N 3.41Å
1162	M	90.2	Very high	83	Confident	58 Å²	58	67.4 Å²	67.4	29%	0.286	38%	0.378	S	S	.	.			trans	-85	108	-176.6	174.6	56.7	87.1	0	0	112.4	I1084 A1094 C1111 A1164	I1084-M1162 HydrophobicContact CD1-CE 4.11Å; I1084-M1162 HydrophobicContact CD1-SD 4.17Å; A1094-M1162 HydrophobicContact CB-CE 3.61Å; C1111-M1162 WeakPolarHBondContact O-CE 3.27Å; M1162-A1164 PolarHBondContact O-N 3.45Å; M1162-A1164 VanDerWaalsContact O-N 3.15Å
1163	M	87.9	Confident	82.8	Confident	106 Å²	106	67.2 Å²	67.2	52%	0.522	37%	0.371	S	S	.	.			trans	-87.1	78.1	179.2	-61.7	-58	-72.8	0	0	112.3	V1144 E1161 C1165 G1166	V1144-M1163 HydrophobicContact CG1-CG 4.21Å; V1144-M1163 HydrophobicContact CG2-CG 3.8Å; V1144-M1163 HydrophobicContact CG2-SD 4.14Å; E1161-M1163 PolarHBondContact O-N 3.41Å; M1163-C1165 PolarHBondContact O-N 2.89Å; M1163-G1166 PolarHBondContact O-N 3.47Å
1164	A	80.7	Confident	82.8	Confident	96 Å²	96	67.5 Å²	67.5	79%	0.793	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-19.1	-172.1	0	0	0	0	0	116.6	M1162 G1166	M1162-A1164 PolarHBondContact O-N 3.45Å; M1162-A1164 VanDerWaalsContact O-N 3.15Å; A1164-G1166 VanDerWaalsContact C-N 3.32Å
1165	C	82.7	Confident	82.9	Confident	94 Å²	94	68.9 Å²	68.9	64%	0.635	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	1.3	174.6	-74	0	0	0	0	114.3	M1163 Y1171	M1163-C1165 PolarHBondContact O-N 2.89Å; C1165-Y1171 HydrophobicContact CB-CD2 3.97Å; C1165-Y1171 HydrophobicContact CB-CE2 3.99Å
1166	G	79.5	Confident	81.9	Confident	51 Å²	51	71.5 Å²	71.5	53%	0.526	39%	0.387	S	S	.	.			trans	73.6	-163.2	-175	0	0	0	0	0	113.3	M1163 A1164	M1163-G1166 PolarHBondContact O-N 3.47Å; A1164-G1166 VanDerWaalsContact C-N 3.32Å
1167	N	78.2	Confident	80.5	Confident	84 Å²	84	77.4 Å²	77.4	45%	0.449	42%	0.418	S	S	.	.			trans	-76.8	145.6	-176.1	79.2	75.8	0	0	0	112.5	K1169 D1170 Y1171	N1167-K1169 VanDerWaalsContact C-N 3.27Å; N1167-K1169 PolarHBondContact O-N 3.15Å; N1167-K1169 WeakPolarHBondContact OD1-CB 3.4Å; N1167-K1169 PolarHBondContact OD1-N 3Å; N1167-K1169 VanDerWaalsContact OD1-N 3.14Å; N1167-D1170 PolarHBondContact ND2-OD2 3.04Å; N1167-D1170 PolarHBondContact O-N 3.47Å; N1167-D1170 PolarHBondContact OD1-N 3.45Å; N1167-D1170 PolarHBondContact OD1-OD2 3.22Å; N1167-Y1171 WeakPolarHBondContact O-CB 3.33Å; N1167-Y1171 PolarHBondContact O-N 3.27Å
1168	L	77.5	Confident	78.8	Confident	126 Å²	126	85.1 Å²	85.1	66%	0.66	45%	0.451	S	S	*	.	H	α-helix	trans	-58.3	-36	-176.1	-179.3	62.2	0	0	0	113.3	L1172	L1168-L1172 HydrophobicContact CD1-CD1 3.95Å; L1168-L1172 HydrophobicContact CD1-CG 3.93Å; L1168-L1172 HydrophobicContact CG-CD1 3.87Å; L1168-L1172 HydrophobicContact CG-CG 4.26Å; L1168-L1172 VanDerWaalsContact O-CB 3.27Å; L1168-L1172 WeakPolarHBondContact O-CB 3.43Å; L1168-L1172 WeakPolarHBondContact O-CG 3.47Å; L1168-L1172 PolarHBondContact O-N 2.79Å
1169	K	74.7	Confident	77.1	Confident	117 Å²	117	87.4 Å²	87.4	51%	0.509	47%	0.47	S	S	.	.	H	α-helix	trans	-63.7	-46.9	-178.4	162	-173.6	171.8	-168.6	0	111.3	N1167 R1173	N1167-K1169 VanDerWaalsContact C-N 3.27Å; N1167-K1169 PolarHBondContact O-N 3.15Å; N1167-K1169 WeakPolarHBondContact OD1-CB 3.4Å; N1167-K1169 PolarHBondContact OD1-N 3Å; N1167-K1169 VanDerWaalsContact OD1-N 3.14Å; K1169-R1173 WeakPolarHBondContact O-CB 3.33Å; K1169-R1173 WeakPolarHBondContact O-CD 3.3Å; K1169-R1173 WeakPolarHBondContact O-CG 3.32Å; K1169-R1173 PolarHBondContact O-N 3.09Å
1170	D	76.3	Confident	75.2	Confident	71 Å²	71	90 Å²	90	38%	0.38	49%	0.493	S	S	.	.	H	α-helix	trans	-80.5	-30.9	-178.9	-62.4	-41.5	0	0	0	112.3	N1167 R1173 A1174	N1167-D1170 PolarHBondContact ND2-OD2 3.04Å; N1167-D1170 PolarHBondContact O-N 3.47Å; N1167-D1170 PolarHBondContact OD1-N 3.45Å; N1167-D1170 PolarHBondContact OD1-OD2 3.22Å; D1170-R1173 PolarHBondContact O-N 2.8Å; D1170-R1173 WeakPolarHBondContact OD1-CD 3.49Å; D1170-R1173 IonicContact OD1-CZ 2.94Å; D1170-R1173 IonicContact OD1-NE 3.46Å; D1170-R1173 IonicContact OD1-NH1 2.66Å; D1170-R1173 PolarHBondContact OD1-NH1 3.22Å; D1170-A1174 WeakPolarHBondContact O-CB 3.45Å; D1170-A1174 PolarHBondContact O-N 3.25Å
1171	Y	78.8	Confident	73.6	Confident	86 Å²	86	96 Å²	96	34%	0.337	52%	0.518	S	S	.	.	H	α-helix	trans	-58.4	-45.7	167	-176.4	-92.5	0	0	0	112.3	C1165 N1167 R1175	C1165-Y1171 HydrophobicContact CB-CD2 3.97Å; C1165-Y1171 HydrophobicContact CB-CE2 3.99Å; N1167-Y1171 WeakPolarHBondContact O-CB 3.33Å; N1167-Y1171 PolarHBondContact O-N 3.27Å; Y1171-R1175 PolarHBondContact O-N 3.22Å; Y1171-R1175 PolarHBondContact OH-NH1 3.38Å; Y1171-R1175 PolarHBondContact OH-NH2 3.16Å
1172	L	75.5	Confident	72.1	Confident	88 Å²	88	102.3 Å²	102.3	46%	0.461	54%	0.538	S	S	.	.	H	α-helix	trans	-67.4	-41.5	174.7	-73.9	175.4	0	0	0	111.8	L1168 A1174 R1175 C1176	L1168-L1172 HydrophobicContact CD1-CD1 3.95Å; L1168-L1172 HydrophobicContact CD1-CG 3.93Å; L1168-L1172 HydrophobicContact CG-CD1 3.87Å; L1168-L1172 HydrophobicContact CG-CG 4.26Å; L1168-L1172 VanDerWaalsContact O-CB 3.27Å; L1168-L1172 WeakPolarHBondContact O-CB 3.43Å; L1168-L1172 WeakPolarHBondContact O-CG 3.47Å; L1168-L1172 PolarHBondContact O-N 2.79Å; L1172-A1174 PolarHBondContact O-N 2.8Å; L1172-R1175 CarbonylContact O-C 3.42Å; L1172-R1175 PolarHBondContact O-N 3.11Å; L1172-C1176 WeakPolarHBondContact O-CB 3.23Å; L1172-C1176 PolarHBondContact O-N 3.12Å; L1172-C1176 PolarHBondContact O-SG 3.1Å
1173	R	75.8	Confident	70.5	Confident	135 Å²	135	105 Å²	105	51%	0.509	55%	0.551	S	S	.	*	H	α-helix	trans	-60.8	-44.4	176.8	-78.3	160.3	153.3	-161.4	-14.7	112.7	K1169 D1170 R1175 C1176 L1177	K1169-R1173 WeakPolarHBondContact O-CB 3.33Å; K1169-R1173 WeakPolarHBondContact O-CD 3.3Å; K1169-R1173 WeakPolarHBondContact O-CG 3.32Å; K1169-R1173 PolarHBondContact O-N 3.09Å; D1170-R1173 PolarHBondContact O-N 2.8Å; D1170-R1173 WeakPolarHBondContact OD1-CD 3.49Å; D1170-R1173 IonicContact OD1-CZ 2.94Å; D1170-R1173 IonicContact OD1-NE 3.46Å; D1170-R1173 IonicContact OD1-NH1 2.66Å; D1170-R1173 PolarHBondContact OD1-NH1 3.22Å; R1173-R1175 VanDerWaalsContact C-N 3.27Å; R1173-R1175 PolarHBondContact O-N 3.2Å; R1173-C1176 PolarHBondContact O-N 2.99Å; R1173-C1176 VanDerWaalsContact O-N 3.17Å; R1173-L1177 WeakPolarHBondContact O-CG 3.13Å; R1173-L1177 PolarHBondContact O-N 2.78Å
1174	A	74.8	Confident	69.1	Low	52 Å²	52	103.1 Å²	103.1	43%	0.43	55%	0.547	S	S	.	.	H	α-helix	trans	-55.6	-44.9	175.1	0	0	0	0	0	110.9	D1170 L1172 F1178	D1170-A1174 WeakPolarHBondContact O-CB 3.45Å; D1170-A1174 PolarHBondContact O-N 3.25Å; L1172-A1174 PolarHBondContact O-N 2.8Å; A1174-F1178 VanDerWaalsContact O-CD2 3.3Å; A1174-F1178 WeakPolarHBondContact O-CD2 3.48Å
1175	R	75.2	Confident	68.4	Low	153 Å²	153	102.5 Å²	102.5	58%	0.577	53%	0.534	S	S	*	.	H	α-helix	trans	-70.8	-35	176.3	-70.9	-178.7	165.8	-163.1	-4.2	113.6	Y1171 L1172 R1173 F1178 A1179	Y1171-R1175 PolarHBondContact O-N 3.22Å; Y1171-R1175 PolarHBondContact OH-NH1 3.38Å; Y1171-R1175 PolarHBondContact OH-NH2 3.16Å; L1172-R1175 CarbonylContact O-C 3.42Å; L1172-R1175 PolarHBondContact O-N 3.11Å; R1173-R1175 VanDerWaalsContact C-N 3.27Å; R1173-R1175 PolarHBondContact O-N 3.2Å; R1175-F1178 PolarHBondContact O-N 3.17Å; R1175-A1179 PolarHBondContact O-N 3.43Å
1176	C	63.3	Low	67.6	Low	79 Å²	79	101.7 Å²	101.7	53%	0.534	53%	0.526	S	S	.	.	H	α-helix	trans	-66.7	-34.2	175.7	-68.6	0	0	0	0	112.4	L1172 R1173 F1178 A1179 A1180	L1172-C1176 WeakPolarHBondContact O-CB 3.23Å; L1172-C1176 PolarHBondContact O-N 3.12Å; L1172-C1176 PolarHBondContact O-SG 3.1Å; R1173-C1176 PolarHBondContact O-N 2.99Å; R1173-C1176 VanDerWaalsContact O-N 3.17Å; C1176-F1178 VanDerWaalsContact C-N 3.32Å; C1176-F1178 PolarHBondContact O-N 2.91Å; C1176-A1179 PolarHBondContact O-N 3.1Å; C1176-A1180 WeakPolarHBondContact O-CB 3.5Å; C1176-A1180 PolarHBondContact O-N 3.33Å
1177	L	58.3	Low	66.8	Low	124 Å²	124	106.9 Å²	106.9	65%	0.649	53%	0.529	S	S	*	.	H	α-helix	trans	-65.5	-34.8	173.8	-73.1	169.1	0	0	0	112.3	R1173 K1181	R1173-L1177 WeakPolarHBondContact O-CG 3.13Å; R1173-L1177 PolarHBondContact O-N 2.78Å; L1177-K1181 WeakPolarHBondContact O-CB 3.29Å; L1177-K1181 PolarHBondContact O-N 3.26Å; L1177-K1181 VanDerWaalsContact O-N 3.13Å
1178	F	57.1	Low	66.2	Low	165 Å²	165	109.7 Å²	109.7	72%	0.724	54%	0.538	S	S	*	.	H	α-helix	trans	-68	-38.8	169.5	-79	-74.7	0	0	0	112.3	A1174 R1175 C1176 R1182	A1174-F1178 VanDerWaalsContact O-CD2 3.3Å; A1174-F1178 WeakPolarHBondContact O-CD2 3.48Å; R1175-F1178 PolarHBondContact O-N 3.17Å; C1176-F1178 VanDerWaalsContact C-N 3.32Å; C1176-F1178 PolarHBondContact O-N 2.91Å; F1178-R1182 WeakPolarHBondContact O-CB 3.36Å; F1178-R1182 PolarHBondContact O-N 3.39Å; F1178-R1182 VanDerWaalsContact O-N 3.15Å
1179	A	55.8	Low	65.6	Low	53 Å²	53	110.4 Å²	110.4	44%	0.438	54%	0.536	S	S	.	.	H	α-helix	trans	-64.9	-49.6	175.9	0	0	0	0	0	112.4	R1175 C1176 K1181 R1182 E1183	R1175-A1179 PolarHBondContact O-N 3.43Å; C1176-A1179 PolarHBondContact O-N 3.1Å; A1179-K1181 PolarHBondContact O-N 2.79Å; A1179-R1182 CarbonylContact O-C 3.45Å; A1179-R1182 WeakPolarHBondContact O-CA 3.36Å; A1179-R1182 VanDerWaalsContact O-CB 3.26Å; A1179-R1182 WeakPolarHBondContact O-CB 3.29Å; A1179-R1182 PolarHBondContact O-N 3.27Å; A1179-E1183 PolarHBondContact O-N 3.38Å
1180	A	54.8	Low	65	Low	56 Å²	56	108.9 Å²	108.9	46%	0.463	53%	0.532	S	S	.	.	H	α-helix	trans	-64.4	-38.3	-179.6	0	0	0	0	0	112.6	C1176 R1182 E1183 S1184	C1176-A1180 WeakPolarHBondContact O-CB 3.5Å; C1176-A1180 PolarHBondContact O-N 3.33Å; A1180-R1182 VanDerWaalsContact C-N 3.3Å; A1180-R1182 PolarHBondContact O-N 3.4Å; A1180-E1183 PolarHBondContact O-N 2.69Å; A1180-S1184 WeakPolarHBondContact O-CB 3.48Å; A1180-S1184 PolarHBondContact O-N 3.45Å; A1180-S1184 PolarHBondContact O-OG 2.96Å
1181	K	57.8	Low	64.2	Low	156 Å²	156	111.2 Å²	111.2	68%	0.678	54%	0.541	S	S	*	.	H	α-helix	trans	-59	-43.3	169.2	-92	-176.1	171.1	178.6	0	111.2	L1177 A1179 S1184 V1185	L1177-K1181 WeakPolarHBondContact O-CB 3.29Å; L1177-K1181 PolarHBondContact O-N 3.26Å; L1177-K1181 VanDerWaalsContact O-N 3.13Å; A1179-K1181 PolarHBondContact O-N 2.79Å; K1181-S1184 PolarHBondContact O-N 3.12Å; K1181-S1184 PolarHBondContact O-OG 2.89Å; K1181-V1185 WeakPolarHBondContact O-CG2 3.37Å; K1181-V1185 PolarHBondContact O-N 2.96Å; K1181-V1185 VanDerWaalsContact O-N 3.09Å
1182	R	58.3	Low	63.5	Low	198 Å²	198	112.8 Å²	112.8	75%	0.747	55%	0.552	S	S	*	*	H	α-helix	trans	-63.1	-45.3	178.4	-150.9	175	-169.5	-177.6	1.9	111.8	F1178 A1179 A1180 V1185 V1186	F1178-R1182 WeakPolarHBondContact O-CB 3.36Å; F1178-R1182 PolarHBondContact O-N 3.39Å; F1178-R1182 VanDerWaalsContact O-N 3.15Å; A1179-R1182 CarbonylContact O-C 3.45Å; A1179-R1182 WeakPolarHBondContact O-CA 3.36Å; A1179-R1182 VanDerWaalsContact O-CB 3.26Å; A1179-R1182 WeakPolarHBondContact O-CB 3.29Å; A1179-R1182 PolarHBondContact O-N 3.27Å; A1180-R1182 VanDerWaalsContact C-N 3.3Å; A1180-R1182 PolarHBondContact O-N 3.4Å; R1182-V1185 PolarHBondContact O-N 3.2Å; R1182-V1186 WeakPolarHBondContact O-CB 3.33Å; R1182-V1186 VanDerWaalsContact O-CG2 3.29Å; R1182-V1186 WeakPolarHBondContact O-CG2 3.4Å; R1182-V1186 PolarHBondContact O-N 3.1Å
1183	E	58.6	Low	62.7	Low	116 Å²	116	114.1 Å²	114.1	54%	0.542	56%	0.556	S	S	.	*	H	α-helix	trans	-62.7	-40.8	173.7	-77.8	-165.6	105.2	0	0	112.9	A1179 A1180 V1185 V1186 R1187	A1179-E1183 PolarHBondContact O-N 3.38Å; A1180-E1183 PolarHBondContact O-N 2.69Å; E1183-V1185 VanDerWaalsContact C-N 3.31Å; E1183-V1185 PolarHBondContact O-N 2.65Å; E1183-V1186 PolarHBondContact O-N 3.1Å; E1183-R1187 WeakPolarHBondContact O-CG 3.3Å; E1183-R1187 PolarHBondContact O-N 3.03Å
1184	S	58.2	Low	61.6	Low	65 Å²	65	114 Å²	114	46%	0.455	57%	0.565	S	S	.	*	H	α-helix	trans	-64.4	-34.9	178.5	73.5	0	0	0	0	113.1	A1180 K1181 K1188	A1180-S1184 WeakPolarHBondContact O-CB 3.48Å; A1180-S1184 PolarHBondContact O-N 3.45Å; A1180-S1184 PolarHBondContact O-OG 2.96Å; K1181-S1184 PolarHBondContact O-N 3.12Å; K1181-S1184 PolarHBondContact O-OG 2.89Å; S1184-K1188 PolarHBondContact O-N 3.15Å; S1184-K1188 VanDerWaalsContact O-N 3.17Å
1185	V	64.9	Low	60.7	Low	84 Å²	84	122.3 Å²	122.3	51%	0.509	59%	0.585	S	S	.	*	H	α-helix	trans	-73.4	-40.8	174.6	172.4	0	0	0	0	110.7	K1181 R1182 E1183 K1188 F1189	K1181-V1185 WeakPolarHBondContact O-CG2 3.37Å; K1181-V1185 PolarHBondContact O-N 2.96Å; K1181-V1185 VanDerWaalsContact O-N 3.09Å; R1182-V1185 PolarHBondContact O-N 3.2Å; E1183-V1185 VanDerWaalsContact C-N 3.31Å; E1183-V1185 PolarHBondContact O-N 2.65Å; V1185-K1188 PolarHBondContact O-N 2.9Å; V1185-F1189 HydrophobicContact CG1-CD2 4.27Å; V1185-F1189 PolarHBondContact O-N 3.12Å
1186	V	66.7	Low	59.4	Low	76 Å²	76	122.5 Å²	122.5	46%	0.461	59%	0.59	S	S	.	*	H	α-helix	trans	-65.4	-42.8	176.2	168.8	0	0	0	0	111.7	R1182 E1183 F1189 L1190	R1182-V1186 WeakPolarHBondContact O-CB 3.33Å; R1182-V1186 VanDerWaalsContact O-CG2 3.29Å; R1182-V1186 WeakPolarHBondContact O-CG2 3.4Å; R1182-V1186 PolarHBondContact O-N 3.1Å; E1183-V1186 PolarHBondContact O-N 3.1Å; V1186-F1189 PolarHBondContact O-N 3.09Å; V1186-L1190 HydrophobicContact CG1-CD1 3.78Å; V1186-L1190 HydrophobicContact CG1-CG 4.34Å; V1186-L1190 WeakPolarHBondContact O-CB 3.49Å; V1186-L1190 VanDerWaalsContact O-CG 3.31Å; V1186-L1190 WeakPolarHBondContact O-CG 3.5Å; V1186-L1190 PolarHBondContact O-N 2.82Å
1187	R	61.9	Low	58.3	Low	160 Å²	160	124.4 Å²	124.4	60%	0.604	60%	0.6	S	S	*	*	H	α-helix	trans	-61.8	-44.3	174.4	-73.9	-167.9	-171.5	-166.3	4.1	111.8	E1183 F1189 L1190 E1191	E1183-R1187 WeakPolarHBondContact O-CG 3.3Å; E1183-R1187 PolarHBondContact O-N 3.03Å; R1187-F1189 VanDerWaalsContact C-N 3.35Å; R1187-F1189 PolarHBondContact O-N 2.68Å; R1187-L1190 PolarHBondContact O-N 3.45Å; R1187-E1191 WeakPolarHBondContact O-CB 3.31Å; R1187-E1191 VanDerWaalsContact O-CG 3.31Å; R1187-E1191 WeakPolarHBondContact O-CG 3.49Å; R1187-E1191 PolarHBondContact O-N 3.24Å
1188	K	65.7	Low	57.3	Low	144 Å²	144	124 Å²	124	63%	0.626	61%	0.607	S	S	*	*	H	α-helix	trans	-60.5	-41.5	174.2	-80.6	-166.9	170.2	-165.6	0	113	S1184 V1185 E1191 E1192	S1184-K1188 PolarHBondContact O-N 3.15Å; S1184-K1188 VanDerWaalsContact O-N 3.17Å; V1185-K1188 PolarHBondContact O-N 2.9Å; K1188-E1191 PolarHBondContact O-N 2.9Å; K1188-E1192 WeakPolarHBondContact O-CB 3.31Å; K1188-E1192 WeakPolarHBondContact O-CG 3.37Å; K1188-E1192 PolarHBondContact O-N 3.44Å
1189	F	65.1	Low	56.6	Low	141 Å²	141	121.2 Å²	121.2	62%	0.618	61%	0.606	S	S	*	*	H	α-helix	trans	-61.2	-47.4	173.9	-105.6	-92	0	0	0	111.8	V1185 V1186 R1187 E1191 E1192 E1193	V1185-F1189 HydrophobicContact CG1-CD2 4.27Å; V1185-F1189 PolarHBondContact O-N 3.12Å; V1186-F1189 PolarHBondContact O-N 3.09Å; R1187-F1189 VanDerWaalsContact C-N 3.35Å; R1187-F1189 PolarHBondContact O-N 2.68Å; F1189-E1191 VanDerWaalsContact C-N 3.35Å; F1189-E1191 PolarHBondContact O-N 2.98Å; F1189-E1192 PolarHBondContact O-N 3.43Å; F1189-E1193 PolarHBondContact O-N 3.28Å
1190	L	62	Low	55.7	Low	84 Å²	84	130.6 Å²	130.6	44%	0.44	63%	0.63	S	S	.	*	H	α-helix	trans	-67.1	-32.6	179.2	-68	170.5	0	0	0	112.8	V1186 R1187 N1194	V1186-L1190 HydrophobicContact CG1-CD1 3.78Å; V1186-L1190 HydrophobicContact CG1-CG 4.34Å; V1186-L1190 WeakPolarHBondContact O-CB 3.49Å; V1186-L1190 VanDerWaalsContact O-CG 3.31Å; V1186-L1190 WeakPolarHBondContact O-CG 3.5Å; V1186-L1190 PolarHBondContact O-N 2.82Å; R1187-L1190 PolarHBondContact O-N 3.45Å; L1190-N1194 VanDerWaalsContact O-CB 3.3Å; L1190-N1194 WeakPolarHBondContact O-CB 3.45Å; L1190-N1194 PolarHBondContact O-N 2.78Å; L1190-N1194 PolarHBondContact O-ND2 3.09Å
1191	E	60.3	Low	54.7	Low	121 Å²	121	136.1 Å²	136.1	57%	0.565	65%	0.65	S	S	*	*	H	α-helix	trans	-73.4	-31.2	174.4	-74.3	169.5	-174.9	0	0	112.3	R1187 K1188 F1189 R1195	R1187-E1191 WeakPolarHBondContact O-CB 3.31Å; R1187-E1191 VanDerWaalsContact O-CG 3.31Å; R1187-E1191 WeakPolarHBondContact O-CG 3.49Å; R1187-E1191 PolarHBondContact O-N 3.24Å; K1188-E1191 PolarHBondContact O-N 2.9Å; F1189-E1191 VanDerWaalsContact C-N 3.35Å; F1189-E1191 PolarHBondContact O-N 2.98Å; E1191-R1195 WeakPolarHBondContact O-CG 3.42Å
1192	E	63	Low	53.7	Low	119 Å²	119	134.4 Å²	134.4	56%	0.556	66%	0.658	S	S	*	*	H	α-helix	trans	-79.6	-32.8	172.7	-74.5	-168	-166.6	0	0	113.5	K1188 F1189 K1196	K1188-E1192 WeakPolarHBondContact O-CB 3.31Å; K1188-E1192 WeakPolarHBondContact O-CG 3.37Å; K1188-E1192 PolarHBondContact O-N 3.44Å; F1189-E1192 PolarHBondContact O-N 3.43Å; E1192-K1196 WeakPolarHBondContact O-CD 3.45Å; E1192-K1196 WeakPolarHBondContact O-CG 3.3Å
1193	E	58.5	Low	52.4	Low	116 Å²	116	136.4 Å²	136.4	54%	0.542	67%	0.666	S	S	.	*	H	α-helix	trans	-69.3	-45.7	172.1	-76.9	-170.5	117.7	0	0	111.5	F1189 R1195 K1196 T1197	F1189-E1193 PolarHBondContact O-N 3.28Å; E1193-R1195 PolarHBondContact O-N 2.99Å; E1193-R1195 VanDerWaalsContact O-N 3.09Å; E1193-K1196 PolarHBondContact O-N 2.84Å; E1193-T1197 PolarHBondContact O-OG1 3.25Å
1194	N	54.2	Low	51.4	Low	132 Å²	132	136.1 Å²	136.1	71%	0.706	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-11.2	178.1	-77.9	-61.6	0	0	0	114	L1190	L1190-N1194 VanDerWaalsContact O-CB 3.3Å; L1190-N1194 WeakPolarHBondContact O-CB 3.45Å; L1190-N1194 PolarHBondContact O-N 2.78Å; L1190-N1194 PolarHBondContact O-ND2 3.09Å
1195	R	54.5	Low	50.2	Low	226 Å²	226	138.4 Å²	138.4	85%	0.853	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	0.4	168.3	-74.1	-175.3	-178.9	-163.9	2.1	114.1	E1191 E1193	E1191-R1195 WeakPolarHBondContact O-CG 3.42Å; E1193-R1195 PolarHBondContact O-N 2.99Å; E1193-R1195 VanDerWaalsContact O-N 3.09Å
1196	K	48.7	Very low	48.8	Very low	158 Å²	158	140.1 Å²	140.1	69%	0.687	70%	0.7	S	S	*	*	S	Bend	trans	-127.3	12.6	-168.4	-74.2	177	-177.5	160.9	0	116	E1192 E1193	E1192-K1196 WeakPolarHBondContact O-CD 3.45Å; E1192-K1196 WeakPolarHBondContact O-CG 3.3Å; E1193-K1196 PolarHBondContact O-N 2.84Å
1197	T	41.4	Very low	47.3	Very low	119 Å²	119	142.5 Å²	142.5	73%	0.73	72%	0.717	S	S	*	*			trans	-146.9	108.3	177.7	24.5	0	0	0	0	115.1	E1193	E1193-T1197 PolarHBondContact O-OG1 3.25Å
1198	S	36.3	Very low	45.9	Very low	114 Å²	114	142.1 Å²	142.1	80%	0.797	73%	0.726	S	S	*	*			trans	178.1	141	134.4	-166.6	0	0	0	0	110.7
1199	P	41.4	Very low	44	Very low	108 Å²	108	140.1 Å²	140.1	70%	0.701	73%	0.729	S	S	*	*			cis	-130.9	149.2	-42.8	36.6	-23.1	0	0	0	112.3
1200	R	37.6	Very low	42.4	Very low	250 Å²	250	141.3 Å²	141.3	94%	0.943	73%	0.734	S	S	*	*			trans	-141.6	149	160	-76.3	-162.3	177.1	-167.5	-0.3	111.6
1201	L	33.7	Very low	41.2	Very low	171 Å²	171	142.9 Å²	142.9	90%	0.895	74%	0.743	S	S	*	*			trans	-87.8	134.9	-171.2	-68.1	67.2	0	0	0	112.2
1202	S	37	Very low	40	Very low	121 Å²	121	143.9 Å²	143.9	85%	0.846	75%	0.752	S	S	*	*				-172.6	150	128.4	53	0	0	0	0	112.8
1203	R	31.5	Very low	38.5	Very low	239 Å²	239	148.2 Å²	148.2	90%	0.902	76%	0.764	S	S	*	*			trans	-87.6	170.7	163.2	-69.4	178.9	173	177.4	-2.3	108.4
1204	P	36.5	Very low	37.3	Very low	111 Å²	111	150 Å²	150	72%	0.721	78%	0.783	S	S	*	*			cis	-145	-172.7	17.9	41.3	-20.1	0	0	0	117.8
1205	S	32.9	Very low	36.3	Very low	113 Å²	113	147.4 Å²	147.4	79%	0.79	78%	0.779	S	S	*	*			trans	75	150.6	149.9	53.5	0	0	0	0	121.1
1206	V	36.5	Very low	35.3	Very low	119 Å²	119	143.2 Å²	143.2	72%	0.721	77%	0.773	S	S	*	*			trans	-112.8	156.2	-173	-158.2	0	0	0	0	109	L1208	V1206-L1208 HydrophobicContact CG1-CD1 4.16Å
1207	P	35.6	Very low	34.7	Very low	126 Å²	126	141.9 Å²	141.9	82%	0.818	78%	0.781	S	S	*	*				-141.3	152.9	110.7	34.8	-20.9	0	0	0	115
1208	L	32	Very low	34.3	Very low	152 Å²	152	144.1 Å²	144.1	80%	0.796	78%	0.78	S	S	*	*			trans	-79.3	173.6	166.1	-76.9	91.5	0	0	0	111.3	V1206	V1206-L1208 HydrophobicContact CG1-CD1 4.16Å
1209	C	25.8	Very low	34.2	Very low	102 Å²	102	143.6 Å²	143.6	69%	0.689	78%	0.783	S	S	*	*			trans	102	146.4	168.6	-59.3	0	0	0	0	115.3
1210	K	31.6	Very low	33.7	Very low	166 Å²	166	145.3 Å²	145.3	72%	0.722	79%	0.786	S	S	*	*			cis	-161.2	155.4	-9.3	-114.7	162.9	-169.6	161.4	0	110.9
1211	N	36	Very low	33.6	Very low	117 Å²	117	138.5 Å²	138.5	63%	0.626	78%	0.783	S	S	*	*			trans	37	120.8	145.2	-55.6	-9.7	0	0	0	121.4
1212	N	36.1	Very low	33.2	Very low	142 Å²	142	133 Å²	133	76%	0.759	77%	0.768	S	S	*	*				-171.3	123.6	96.7	-90.6	-29.1	0	0	0	109.8
1213	R	30.6	Very low	33	Very low	211 Å²	211	137 Å²	137	80%	0.796	77%	0.773	S	S	*	*				75.3	91.3	70.6	-75.1	-167.9	-179.5	-164.4	2.7	114.8
1214	V	33.6	Very low	32.8	Very low	154 Å²	154	128.7 Å²	128.7	93%	0.933	76%	0.762	S	S	*	*				-134.6	150.4	126.3	-176.7	0	0	0	0	106
1215	A	32.9	Very low	32.3	Very low	77 Å²	77	136.1 Å²	136.1	64%	0.636	78%	0.776	S	S	*	*			trans	-145.4	143.5	-161.2	0	0	0	0	0	115.6
1216	L	34.7	Very low	32	Very low	137 Å²	137	139.8 Å²	139.8	72%	0.717	78%	0.783	S	S	*	*			trans	71	162.5	139.5	-74.7	172.5	0	0	0	117.5	K1218	L1216-K1218 HydrophobicContact CD2-CD 4.44Å; L1216-K1218 HydrophobicContact CD2-CG 3.76Å
1217	P	34.6	Very low	31.4	Very low	131 Å²	131	142.9 Å²	142.9	85%	0.851	79%	0.786	S	S	*	*			cis	-111.7	172.2	18.2	37	-23.4	0	0	0	118
1218	K	32.8	Very low	31.1	Very low	165 Å²	165	145.5 Å²	145.5	72%	0.717	79%	0.793	S	S	*	*			trans	-100.8	160.7	176.3	-63.6	173.9	179.5	-178.5	0	111.3	L1216	L1216-K1218 HydrophobicContact CD2-CD 4.44Å; L1216-K1218 HydrophobicContact CD2-CG 3.76Å
1219	A	34.7	Very low	30.9	Very low	104 Å²	104	143.4 Å²	143.4	86%	0.86	79%	0.786	S	S	*	*			trans	-132.2	153	136.1	0	0	0	0	0	108.6
1220	N	31.9	Very low	31.3	Very low	143 Å²	143	142.6 Å²	142.6	77%	0.765	78%	0.782	S	S	*	*			trans	-113.6	132	-172.2	-64.3	-27.6	0	0	0	112.6
1221	A	34	Very low	31.4	Very low	107 Å²	107	139.6 Å²	139.6	88%	0.884	78%	0.779	S	S	*	*			trans	-175.8	150.1	144.6	0	0	0	0	0	107
1222	G	26.8	Very low	31	Very low	57 Å²	57	139.6 Å²	139.6	59%	0.588	78%	0.779	S	S	*	*			cis	152.9	129.5	2.8	0	0	0	0	0	107.4
1223	H	31.5	Very low	30.4	Very low	204 Å²	204	143.4 Å²	143.4	94%	0.944	78%	0.783	S	S	*	*			trans	65.3	153.6	-165.8	-43.3	-79.3	0	0	0	114
1224	G	27.2	Very low	30.2	Very low	65 Å²	65	139 Å²	139	67%	0.67	78%	0.775	S	S	*	*			cis	168.7	84	-8	0	0	0	0	0	111.7	M1226	G1224-M1226 PolarHBondContact O-N 2.86Å
1225	W	27	Very low	29.8	Very low	267 Å²	267	139.4 Å²	139.4	100%	1.011	77%	0.767	S	S	*	*			trans	-73.6	110.6	172.9	-74.4	69.5	0	0	0	109.4
1226	M	25.5	Very low	29.4	Very low	189 Å²	189	144.1 Å²	144.1	93%	0.931	78%	0.78	S	S	*	*			trans	-132.7	146.5	171.3	-112	177.4	173.5	0	0	111.5	G1224	G1224-M1226 PolarHBondContact O-N 2.86Å
1227	K	24.7	Very low	29	Very low	184 Å²	184	148.5 Å²	148.5	80%	0.8	79%	0.787	S	S	*	*			trans	-69.9	148.1	-177.8	-57.7	166.9	178	176.7	0	110.2	T1229	K1227-T1229 HydrophobicContact CB-CG2 4.36Å; K1227-T1229 HydrophobicContact CD-CG2 4.38Å
1228	L	30.1	Very low	28.7	Very low	182 Å²	182	147.6 Å²	147.6	95%	0.953	78%	0.781	S	S	*	*			trans	-110.1	114.7	144.2	-82.5	168.5	0	0	0	107.8
1229	T	26.7	Very low	28.4	Very low	107 Å²	107	144.7 Å²	144.7	66%	0.656	78%	0.781	S	S	*	*			trans	-93.9	164.8	171.1	46.7	0	0	0	0	109.8	K1227	K1227-T1229 HydrophobicContact CB-CG2 4.36Å; K1227-T1229 HydrophobicContact CD-CG2 4.38Å
1230	S	34.3	Very low	28	Very low	86 Å²	86	147.1 Å²	147.1	60%	0.601	78%	0.78	S	S	*	*			trans	-52.8	146.9	158.4	-159	0	0	0	0	110.4	D1232	S1230-D1232 PolarHBondContact OG-N 3.44Å
1231	P	33.5	Very low	27.9	Very low	103 Å²	103	146.3 Å²	146.3	67%	0.669	78%	0.78	S	S	*	*				-117.6	140.3	108.1	35.1	-32.9	0	0	0	110.3
1232	D	27	Very low	27.6	Very low	116 Å²	116	148 Å²	148	62%	0.62	77%	0.774	S	S	*	*				67.7	146.7	51	-62.4	-42.1	0	0	0	113.9	S1230	S1230-D1232 PolarHBondContact OG-N 3.44Å
1233	W	25.1	Very low	27.7	Very low	222 Å²	222	150.5 Å²	150.5	84%	0.841	78%	0.783	S	S	*	*			trans	75.4	138	173.1	-44.5	109.6	0	0	0	115.5
1234	L	25.6	Very low	27.8	Very low	119 Å²	119	146.7 Å²	146.7	62%	0.623	78%	0.776	S	S	*	*			cis	-151.3	156.2	-3.4	-110.3	161.7	0	0	0	111.7
1235	E	24.5	Very low	27.8	Very low	163 Å²	163	153.1 Å²	153.1	76%	0.762	79%	0.789	S	S	*	*			trans	10.2	134.2	155.5	-72.2	156.3	-169.9	0	0	121.9
1236	L	26.2	Very low	27.9	Very low	175 Å²	175	143.8 Å²	143.8	92%	0.916	78%	0.776	S	S	*	*				-156.7	87.9	116.5	-105.7	175	0	0	0	112.2
1237	R	25.1	Very low	28.2	Very low	230 Å²	230	142.5 Å²	142.5	87%	0.868	77%	0.772	S	S	*	*			trans	-109.5	167.9	144.8	-73.1	-168.3	-171.1	-173.3	4.1	106
1238	P	29.7	Very low	28.3	Very low	111 Å²	111	137.6 Å²	137.6	72%	0.721	78%	0.775	S	S	*	*			cis	-129.1	-168.3	8.9	39	-20.1	0	0	0	114.4
1239	S	26.1	Very low	28.5	Very low	104 Å²	104	133.4 Å²	133.4	73%	0.727	77%	0.766	S	S	*	*			trans	-57.3	158.6	158.8	50.3	0	0	0	0	113.8
1240	D	26.4	Very low	28.6	Very low	155 Å²	155	135.7 Å²	135.7	83%	0.829	77%	0.773	S	S	*	*			trans	-149.4	162.1	157.7	-106.1	-34.3	0	0	0	111.3
1241	V	28.3	Very low	28.7	Very low	126 Å²	126	139.7 Å²	139.7	76%	0.764	79%	0.787	S	S	*	*			trans	69.5	76	173.5	-158.2	0	0	0	0	117.3
1242	D	28.4	Very low	28.5	Very low	143 Å²	143	141.5 Å²	141.5	77%	0.765	79%	0.791	S	S	*	*				25.7	143.3	116.9	-60.3	-61.1	0	0	0	122
1243	S	28.8	Very low	28.9	Very low	110 Å²	110	145.3 Å²	145.3	77%	0.769	81%	0.805	S	S	*	*			trans	-70.9	160	159.7	-56.9	0	0	0	0	111.9
1244	P	33.4	Very low	29.4	Very low	123 Å²	123	143.4 Å²	143.4	80%	0.799	81%	0.806	S	S	*	*			trans	-118	134.4	135.7	33.6	-29.9	0	0	0	112.1
1245	E	26.8	Very low	29.9	Very low	200 Å²	200	142.7 Å²	142.7	94%	0.935	81%	0.811	S	S	*	*			trans	-65.2	147.2	170	-59.9	172.2	116.5	0	0	110.8
1246	G	29.4	Very low	30.5	Very low	72 Å²	72	142.2 Å²	142.2	74%	0.742	81%	0.813	S	S	*	*			trans	-143.8	28.6	-158.7	0	0	0	0	0	117.9
1247	N	31.4	Very low	30.9	Very low	161 Å²	161	138.2 Å²	138.2	86%	0.861	80%	0.8	S	S	*	*			trans	50.6	100.4	164.6	-64.5	-35.1	0	0	0	118.1
1248	G	28.6	Very low	31.2	Very low	82 Å²	82	136.5 Å²	136.5	85%	0.845	80%	0.799	S	S	*	*			trans	-72.7	-172.9	171	0	0	0	0	0	115.8
1249	A	32.7	Very low	31.5	Very low	93 Å²	93	142 Å²	142	77%	0.769	82%	0.822	S	S	*	*			trans	-153	117.8	161.4	0	0	0	0	0	111.6
1250	L	30.5	Very low	31.7	Very low	156 Å²	156	143.9 Å²	143.9	82%	0.817	83%	0.827	S	S	*	*			trans	29.7	117	138.1	-63.1	159.9	0	0	0	118.8
1251	L	34.7	Very low	32	Very low	169 Å²	169	143.3 Å²	143.3	89%	0.885	83%	0.827	S	S	*	*				-162.4	150.3	91.2	-99.3	168	0	0	0	111.6
1252	N	30	Very low	32.2	Very low	142 Å²	142	144.2 Å²	144.2	76%	0.759	83%	0.831	S	S	*	*			trans	-86	152.1	176.4	-61.7	-32.4	0	0	0	110.1
1253	E	35.6	Very low	32.4	Very low	195 Å²	195	144.3 Å²	144.3	91%	0.911	83%	0.834	S	S	*	*				-162.8	162.1	97.2	-106.5	175.1	-171.8	0	0	113.6
1254	Q	35.3	Very low	32.7	Very low	182 Å²	182	146.4 Å²	146.4	85%	0.85	84%	0.839	S	S	*	*			trans	-91	143.5	-160.4	-59.7	161.9	-27.1	0	0	111.8
1255	S	36.6	Very low	32.6	Very low	104 Å²	104	148 Å²	148	73%	0.727	84%	0.841	S	S	*	*				164.9	133.7	99.5	48.7	0	0	0	0	113.9
1256	N	36.4	Very low	33	Very low	153 Å²	153	144.3 Å²	144.3	82%	0.818	84%	0.835	S	S	*	*				31.3	140.8	124.6	-58.1	0.9	0	0	0	119.4
1257	S	34.9	Very low	33.3	Very low	92 Å²	92	149.8 Å²	149.8	64%	0.643	84%	0.842	S	S	*	*			cis	-173.2	139.8	10.2	35.7	0	0	0	0	112.7
1258	F	31.7	Very low	33.5	Very low	193 Å²	193	148.9 Å²	148.9	85%	0.846	84%	0.84	S	S	*	*			trans	63	148.8	149.2	-70.3	-128	0	0	0	117.3
1259	D	34.5	Very low	33.9	Very low	226 Å²	226	155 Å²	155	100%	1.209	84%	0.84	S	S	*	*			cis	-101.5	0	-5.5	-74.4	-56.3	0	0	0	111.6

Retrieved 1,259 of 1,259 residues in 1857.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).