A0A087X6N2_POEFO Loading...

Integrin, alpha V

AlphaFold DB , UniProt , Accession A0A087X6N2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,046 aa.

						>A0A087X6N2_POEFO|A0A087X6N2
MAGARTAVGLLVLVCVSVRRGASFNLDVDKPFVYTGPDGSYFGFSVDFFKSATNQNSDVLIGAPRANTSSSSTVVERGAVYSCPWKNAASCQQLLFDDKVDDRFKDGNQIEFKSKQWFGASVRSDGEHILACAPLYQWSTFGFSEREPVGTCYLKKGNTVVEYSPCRSSSHTPEGQGFCQAGFSADFVKKSNRVVVGGPGSFYWQGQLISDNVDEILKRFNNDYVTPYSTTLSTKSAGAQYDDSYLGRYSVTVGDFNEDGKEDYVTGVPRGDKALGYVNIFNGANMESMINFTGSQMAAYFGYSVAASDVNSDGFVDVLIGAPLFMDRGTDGKLREVGQVSVYLSRGGFSFQPPQLLTGAEVYARYGSSIAALGDLDRDGYKDVAISAPYGGPDHNGLVYIHNGHASGIDSTASQVLQGKWASSYMPASFGYSMTGSTDIDQNGYPDLVVGAFGADKAVLYRARPVISVNATLDINPQIINPEEKSCTIPQTNTQVSCFKVKYCLAAGGFGAPSSLSFRVDLTLDRLKQKEATKRALFLHSATYQYSKNMTVNSNRRLACEEQEVYLRDDREFRDKITPISVAMEYSLDYQLAADKTGLLPIINIWAPTNVTKQAHILLDCGEDNICKPDLKLSVESDRKKIYIGDDNALTLMVTAENRGEGAYEAELHVYPPQQADFTGVVRSQTLSRLSCAYKKENETKMVVCDLGNPMKKDTTILAELGFSVHQLSEEDTSIKFDLQIVSSNQFQNTSPRVSSVTQLDILAKASIRGSSSPSQVLLPIANWKPKNPPVLGDDIGPQILHVYELLNNGPSTFSKASLEVEWPYHFRNGSLLYITSFETEGPINCTTDVEINPLNVSNPLATQKNTSVVRDREAEGGNPRRLRKRDLEARETQNDLQLRVQDCNTAECLKLRCQVGRLERNKNAILFIYSRLDVNNFLRTENQNRSYVVRSTASFEVIEMPYKNLQTELPANSTTVSVSVTWVADTAQPVPAWVVALAVLAGLLLLALLIFIMYKLGFFKRVRPPQVDCTEKEQLQPEENGNTDA
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.3	Very low	31.4	Very low	248 Å²	248	142.6 Å²	142.6	100%	1.222	88%	0.881	S	S	*	*				0	134.2	0	-69.9	-178.5	-118.5	0	0	107.7
2	A	27.9	Very low	31.3	Very low	98 Å²	98	138.9 Å²	138.9	81%	0.81	86%	0.857	S	S	*	*			cis	179.3	136.4	-14	0	0	0	0	0	103.8
3	G	38.8	Very low	31.1	Very low	79 Å²	79	139.3 Å²	139.3	81%	0.814	85%	0.849	S	S	*	*			trans	84.3	133.5	153	0	0	0	0	0	118
4	A	34.4	Very low	30.8	Very low	96 Å²	96	137.6 Å²	137.6	79%	0.793	84%	0.838	S	S	*	*			trans	82	85	162.7	0	0	0	0	0	117.3
5	R	33.3	Very low	30.3	Very low	244 Å²	244	134.5 Å²	134.5	92%	0.921	82%	0.824	S	S	*	*			trans	-177.1	71.5	141.1	-101.4	168.3	-169.8	-156.8	3.9	111.6
6	T	31.1	Very low	29.9	Very low	150 Å²	150	132.9 Å²	132.9	92%	0.92	81%	0.814	S	S	*	*			trans	-162.9	80.2	159.9	37.2	0	0	0	0	109.4
7	A	28.6	Very low	29.5	Very low	102 Å²	102	131.4 Å²	131.4	84%	0.843	81%	0.809	S	S	*	*			trans	-148.1	52	167.7	0	0	0	0	0	109.7
8	V	32.1	Very low	29.3	Very low	154 Å²	154	130.4 Å²	130.4	93%	0.933	80%	0.803	S	S	*	*	S	Bend	trans	-141.3	105.3	166.1	-177.5	0	0	0	0	105.7
9	G	33.7	Very low	29.1	Very low	69 Å²	69	135.9 Å²	135.9	71%	0.711	81%	0.807	S	S	*	*	S	Bend	trans	133.7	53.9	177.1	0	0	0	0	0	114.7
10	L	28.2	Very low	29.1	Very low	156 Å²	156	140.7 Å²	140.7	82%	0.817	81%	0.811	S	S	*	*			trans	-159.3	52	150.1	-134.1	102.4	0	0	0	110.6	V12	L10-V12 HydrophobicContact CD2-CG2 3.86Å; L10-V12 HydrophobicContact CG-CG2 3.95Å; L10-V12 PolarHBondContact O-N 2.93Å; L10-V12 VanDerWaalsContact O-N 3.08Å
11	L	26.7	Very low	29.1	Very low	173 Å²	173	136.9 Å²	136.9	91%	0.906	80%	0.801	S	S	*	*			trans	-80.3	76.1	158.2	-124.2	125.2	0	0	0	106	L13	L11-L13 PolarHBondContact O-N 3.11Å; L11-L13 VanDerWaalsContact O-N 3.12Å
12	V	30.3	Very low	29.5	Very low	98 Å²	98	128 Å²	128	59%	0.594	77%	0.767	S	S	*	*			trans	-61.7	112.4	165.1	172.7	0	0	0	0	105.4	L10 V14	L10-V12 HydrophobicContact CD2-CG2 3.86Å; L10-V12 HydrophobicContact CG-CG2 3.95Å; L10-V12 PolarHBondContact O-N 2.93Å; L10-V12 VanDerWaalsContact O-N 3.08Å; V12-V14 HydrophobicContact CG1-CG2 4.32Å; V12-V14 PolarHBondContact O-N 3.13Å
13	L	28.8	Very low	30.4	Very low	144 Å²	144	125.4 Å²	125.4	75%	0.754	74%	0.743	S	S	*	*			trans	-54.7	90.5	162.1	-90.9	90.3	0	0	0	107.8	L11 C15	L11-L13 PolarHBondContact O-N 3.11Å; L11-L13 VanDerWaalsContact O-N 3.12Å; L13-C15 PolarHBondContact O-N 3.38Å
14	V	26.8	Very low	31.8	Very low	115 Å²	115	121.8 Å²	121.8	70%	0.697	71%	0.705	S	S	*	*			trans	-75.5	82.8	150.9	-177.6	0	0	0	0	104.4	V12 V16	V12-V14 HydrophobicContact CG1-CG2 4.32Å; V12-V14 PolarHBondContact O-N 3.13Å; V14-V16 HydrophobicContact CG1-CG2 3.94Å; V14-V16 PolarHBondContact O-N 2.92Å
15	C	23.6	Very low	34.2	Very low	92 Å²	92	117.2 Å²	117.2	62%	0.622	67%	0.667	S	S	*	*			trans	-61.2	85.6	156.8	-85.4	0	0	0	0	106.3	L13 S17	L13-C15 PolarHBondContact O-N 3.38Å; C15-S17 PolarHBondContact O-N 3.08Å
16	V	24	Very low	36.8	Very low	109 Å²	109	105.6 Å²	105.6	66%	0.661	62%	0.624	S	S	*	*			trans	-54.4	104.1	154.4	176.5	0	0	0	0	103.9	V14 V18	V14-V16 HydrophobicContact CG1-CG2 3.94Å; V14-V16 PolarHBondContact O-N 2.92Å; V16-V18 HydrophobicContact CG1-CG2 4.17Å; V16-V18 PolarHBondContact O-N 3.34Å
17	S	23.5	Very low	39.4	Very low	106 Å²	106	99 Å²	99	74%	0.741	58%	0.583	S	S	*	*			trans	-67.6	83.4	170.6	-54.7	0	0	0	0	104.9	C15 R19	C15-S17 PolarHBondContact O-N 3.08Å; S17-R19 PolarHBondContact O-N 2.82Å
18	V	25.1	Very low	42.2	Very low	114 Å²	114	95.8 Å²	95.8	69%	0.691	55%	0.552	S	S	*	*			trans	-58.8	95.7	160.1	177.5	0	0	0	0	103.4	V16 R20	V16-V18 HydrophobicContact CG1-CG2 4.17Å; V16-V18 PolarHBondContact O-N 3.34Å; V18-R20 PolarHBondContact O-N 3.05Å
19	R	25.9	Very low	44.6	Very low	235 Å²	235	94.7 Å²	94.7	89%	0.887	54%	0.541	S	S	*	.			trans	-54.1	98.7	159	-80.1	-175.7	175.3	-174.5	-1.4	103.7	S17 G21	S17-R19 PolarHBondContact O-N 2.82Å; R19-G21 PolarHBondContact O-N 3.29Å
20	R	28	Very low	46.9	Very low	232 Å²	232	98 Å²	98	88%	0.875	54%	0.536	S	S	*	.			trans	-47.8	117.1	160.3	-77	-178.1	173.1	179.1	-2.8	104.2	V18 A22	V18-R20 PolarHBondContact O-N 3.05Å; R20-A22 PolarHBondContact O-N 2.85Å
21	G	31	Very low	49.6	Very low	60 Å²	60	92 Å²	92	62%	0.619	51%	0.506	S	S	*	.			trans	-46.6	118.9	-174.1	0	0	0	0	0	108.7	R19 S23	R19-G21 PolarHBondContact O-N 3.29Å; G21-S23 PolarHBondContact O-N 2.79Å; G21-S23 VanDerWaalsContact O-N 3.08Å
22	A	37.1	Very low	52.5	Low	61 Å²	61	86.4 Å²	86.4	50%	0.504	48%	0.475	S	S	.	.			trans	-62.9	114.2	170.8	0	0	0	0	0	105.7	R20 F24	R20-A22 PolarHBondContact O-N 2.85Å; A22-F24 PolarHBondContact O-N 2.54Å
23	S	47.5	Very low	55.4	Low	44 Å²	44	84.1 Å²	84.1	31%	0.308	46%	0.461	S	S	.	.			trans	-72.8	112.1	168.1	60.5	0	0	0	0	106.4	G21 R464	G21-S23 PolarHBondContact O-N 2.79Å; G21-S23 VanDerWaalsContact O-N 3.08Å; S23-R464 PolarHBondContact OG-NH1 3.46Å
24	F	68	Low	58.3	Low	3 Å²	3	77.3 Å²	77.3	1%	0.013	43%	0.425	C	S	.	.			trans	-73.1	-58.9	178.9	176.7	-124.8	0	0	0	110.2	A22 D377 Q415 I602 I605 W606	A22-F24 PolarHBondContact O-N 2.54Å; F24-D377 HydrophobicContact CE1-CB 3.51Å; F24-D377 HydrophobicContact CZ-CB 3.63Å; F24-D377 WeakPolarHBondContact CZ-OD2 3.45Å; F24-Q415 HydrophobicContact CB-CB 3.91Å; F24-I602 WeakPolarHBondContact O-CG1 3.3Å; F24-I602 VanDerWaalsContact O-CG2 3.23Å; F24-I602 WeakPolarHBondContact O-CG2 3.11Å; F24-I605 HydrophobicContact CD2-CB 3.71Å; F24-I605 HydrophobicContact CD2-CD1 4.36Å; F24-I605 HydrophobicContact CD2-CG2 3.67Å; F24-I605 HydrophobicContact CE2-CB 3.73Å; F24-I605 HydrophobicContact CE2-CG2 3.34Å; F24-I605 HydrophobicContact CZ-CG2 4.33Å; F24-W606 HydrophobicContact CZ-CH2 4.06Å; F24-W606 HydrophobicContact CZ-CZ3 4.03Å
25	N	84.9	Confident	61.3	Low	0 Å²	0	75.2 Å²	75.2	0%	0	41%	0.413	C	S	.	.	S	Bend	trans	-149.5	-23	-179.8	56.5	-0.4	0	0	0	114	D27 L376 Q415 R464 V466 I602	N25-D27 PolarHBondContact O-N 3.46Å; N25-L376 VanDerWaalsContact ND2-C 3.27Å; N25-L376 WeakPolarHBondContact ND2-CD2 3.43Å; N25-L376 WeakPolarHBondContact ND2-CG 3.49Å; N25-L376 PolarHBondContact ND2-O 2.73Å; N25-L376 WeakPolarHBondContact OD1-CD2 3.38Å; N25-Q415 VanDerWaalsContact N-OE1 3.12Å; N25-R464 WeakPolarHBondContact O-CA 3.37Å; N25-R464 WeakPolarHBondContact O-CB 3.39Å; N25-R464 WeakPolarHBondContact O-CD 3.37Å; N25-R464 WeakPolarHBondContact O-CG 3.24Å; N25-R464 PolarHBondContact O-N 3.47Å; N25-V466 HydrophobicContact CB-CG2 4.02Å; N25-I602 HydrophobicContact CB-CG2 4.42Å
26	L	87.8	Confident	64.3	Low	0 Å²	0	71.5 Å²	71.5	0%	0	39%	0.39	C	S	.	.	B	Isolated β-bridge	trans	-74.5	130.8	175.4	-68.9	171.9	0	0	0	111.4	V28 L376 I401 Q415 L417 L448 A463	L26-V28 PolarHBondContact O-N 2.9Å; L26-L376 HydrophobicContact CD1-CD2 4.28Å; L26-L376 HydrophobicContact CD2-CD1 4.11Å; L26-L376 HydrophobicContact CD2-CD2 4.5Å; L26-L376 HydrophobicContact CG-CD2 4.11Å; L26-I401 HydrophobicContact CD1-CD1 3.88Å; L26-I401 HydrophobicContact CD1-CG1 4.09Å; L26-Q415 VanDerWaalsContact N-OE1 3.09Å; L26-Q415 PolarHBondContact O-NE2 2.91Å; L26-L417 HydrophobicContact CB-CD2 4.36Å; L26-L417 HydrophobicContact CD1-CD1 3.96Å; L26-L448 HydrophobicContact CD1-CB 4.33Å; L26-L448 HydrophobicContact CD1-CD2 3.81Å; L26-L448 HydrophobicContact CD2-CB 4.36Å; L26-A463 HydrophobicContact CD2-CB 4.24Å
27	D	86.9	Confident	67.3	Low	13 Å²	13	69.3 Å²	69.3	7%	0.07	38%	0.378	C	S	.	.			trans	-74.3	111.8	177.8	-175.4	-4.4	0	0	0	111.5	N25 D29 K30 Y461 R462 R464 L599	N25-D27 PolarHBondContact O-N 3.46Å; D27-D29 PolarHBondContact OD1-N 2.83Å; D27-K30 PolarHBondContact OD1-N 2.95Å; D27-Y461 WeakPolarHBondContact O-CD1 3.31Å; D27-R462 PolarHBondContact N-O 3.15Å; D27-R464 HydrophobicContact CB-CG 3.97Å; D27-L599 HydrophobicContact CB-CD1 3.93Å
28	V	87.1	Confident	70.3	Confident	33 Å²	33	71.6 Å²	71.6	20%	0.2	38%	0.382	C	S	.	.			trans	-99.1	-12	179.8	-167.7	0	0	0	0	112.4	L26 P31 L417 K420	L26-V28 PolarHBondContact O-N 2.9Å; V28-P31 WeakPolarHBondContact O-CD 3.31Å; V28-L417 HydrophobicContact CG2-CD2 3.59Å; V28-K420 PolarHBondContact O-NZ 3.09Å; V28-K420 VanDerWaalsContact O-NZ 3.12Å
29	D	82.1	Confident	73.1	Confident	131 Å²	131	68.3 Å²	68.3	70%	0.701	37%	0.371	S	S	*	.	S	Bend	trans	-80.6	-41.1	-175.8	-69.9	-27.7	0	0	0	110.8	D27 P31	D27-D29 PolarHBondContact OD1-N 2.83Å; D29-P31 VanDerWaalsContact C-CD 3.48Å
30	K	81.1	Confident	76.1	Confident	139 Å²	139	57.3 Å²	57.3	60%	0.604	33%	0.33	S	S	*	.	S	Bend	trans	-130	60.2	-179.7	-63.8	-179.6	-176.4	170.8	0	113.6	D27	D27-K30 PolarHBondContact OD1-N 2.95Å
31	P	86.3	Confident	79.1	Confident	29 Å²	29	47.6 Å²	47.6	19%	0.188	29%	0.294	C	S	.	.			trans	-71.3	150.5	173.5	31.9	-35.4	0	0	0	111.3	V28 D29 V459 Y461	V28-P31 WeakPolarHBondContact O-CD 3.31Å; D29-P31 VanDerWaalsContact C-CD 3.48Å; P31-V459 HydrophobicContact CB-CG1 3.7Å; P31-V459 HydrophobicContact CG-CG1 4.32Å; P31-Y461 HydrophobicContact CB-CD1 4.05Å; P31-Y461 HydrophobicContact CB-CE1 3.94Å; P31-Y461 HydrophobicContact CG-CE1 4.34Å
32	F	87.4	Confident	82	Confident	57 Å²	57	44.8 Å²	44.8	25%	0.25	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	123.5	171.8	-71	-82.5	0	0	0	109.5	Y34 V459 L460	F32-Y34 HydrophobicContact CB-CE2 4.44Å; F32-V459 CarbonylContact O-C 3.58Å; F32-V459 WeakPolarHBondContact O-CA 3.37Å; F32-L460 HydrophobicContact CB-CB 4.2Å; F32-L460 HydrophobicContact CB-CD2 4.45Å; F32-L460 HydrophobicContact CD2-CD2 4.25Å; F32-L460 PolarHBondContact N-O 3.46Å; F32-L460 VanDerWaalsContact N-O 3.08Å; F32-L460 PolarHBondContact O-N 2.75Å
33	V	89.9	Confident	84.6	Confident	50 Å²	50	41.9 Å²	41.9	30%	0.303	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	118.4	-177.6	-175.5	0	0	0	0	109.5	W421 K457 V459	V33-W421 HydrophobicContact CG1-CZ2 4.37Å; V33-W421 HydrophobicContact CG2-CZ2 3.92Å; V33-K457 HydrophobicContact CG1-CD 4.07Å; V33-K457 HydrophobicContact CG1-CG 4.45Å; V33-V459 HydrophobicContact CG2-CG1 4.4Å
34	Y	90.1	Very high	86.8	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	138.8	172.5	-52.3	-81.6	0	0	0	109.2	F32 V59 I61 C83 W85 A88 K457 A458 L460	F32-Y34 HydrophobicContact CB-CE2 4.44Å; Y34-V59 HydrophobicContact CE2-CG2 4.48Å; Y34-I61 HydrophobicContact CD2-CD1 4.19Å; Y34-I61 HydrophobicContact CG-CD1 4.1Å; Y34-C83 HydrophobicContact CD1-CB 3.66Å; Y34-C83 HydrophobicContact CE1-CB 3.71Å; Y34-C83 HydrophobicContact CG-CB 4.34Å; Y34-W85 WeakPolarHBondContact OH-CA 3.48Å; Y34-A88 HydrophobicContact CD1-CB 3.73Å; Y34-A88 HydrophobicContact CE1-CB 3.76Å; Y34-K457 VanDerWaalsContact O-CA 3.3Å; Y34-K457 WeakPolarHBondContact O-CA 3.49Å; Y34-A458 PolarHBondContact N-O 2.85Å; Y34-A458 PolarHBondContact O-N 2.78Å; Y34-L460 HydrophobicContact CE2-CB 3.93Å
35	T	90	Very high	88	Confident	72 Å²	72	41.4 Å²	41.4	44%	0.442	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	130.8	179.9	-61.1	0	0	0	0	109.4	K457	T35-K457 PolarHBondContact OG1-NZ 2.65Å
36	G	86.9	Confident	88.4	Confident	13 Å²	13	41.5 Å²	41.5	13%	0.134	24%	0.235	C	C	.	.			trans	-100.6	-175.2	174.1	0	0	0	0	0	113.1	D456	G36-D456 PolarHBondContact N-O 3.48Å
37	P	87.5	Confident	88.6	Confident	63 Å²	63	42.4 Å²	42.4	41%	0.409	24%	0.239	S	C	.	.			trans	-63.9	143	172.9	-19	31.6	0	0	0	112.1	G39 S40	P37-G39 PolarHBondContact O-N 3.09Å; P37-S40 VanDerWaalsContact O-CB 3.26Å; P37-S40 WeakPolarHBondContact O-CB 3.24Å; P37-S40 PolarHBondContact O-N 3.31Å; P37-S40 PolarHBondContact O-OG 2.93Å
38	D	85.8	Confident	88.8	Confident	155 Å²	155	42.3 Å²	42.3	83%	0.829	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	132.8	-179.3	-60.6	-35	0	0	0	111.9	S40	D38-S40 PolarHBondContact O-N 3.16Å
39	G	84.9	Confident	88.8	Confident	45 Å²	45	42.5 Å²	42.5	46%	0.464	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	76	6.1	179.3	0	0	0	0	0	114.9	P37 Y41 R65 D456	P37-G39 PolarHBondContact O-N 3.09Å; G39-Y41 VanDerWaalsContact C-N 3.3Å; G39-R65 WeakPolarHBondContact O-CB 3Å; G39-D456 PolarHBondContact N-OD2 3.44Å
40	S	87.5	Confident	88.5	Confident	3 Å²	3	41.5 Å²	41.5	2%	0.021	23%	0.226	C	C	.	.	S	Bend	trans	-81.5	-8.9	179.6	68.8	0	0	0	0	114.2	P37 D38 F42 A63 R65 A66 D456	P37-S40 VanDerWaalsContact O-CB 3.26Å; P37-S40 WeakPolarHBondContact O-CB 3.24Å; P37-S40 PolarHBondContact O-N 3.31Å; P37-S40 PolarHBondContact O-OG 2.93Å; D38-S40 PolarHBondContact O-N 3.16Å; S40-F42 VanDerWaalsContact C-N 3.31Å; S40-A63 CarbonylContact O-C 3.52Å; S40-A63 VanDerWaalsContact O-C 3.24Å; S40-A63 WeakPolarHBondContact O-CA 3.4Å; S40-R65 PolarHBondContact O-N 2.77Å; S40-A66 PolarHBondContact O-N 2.94Å; S40-D456 PolarHBondContact N-OD1 2.74Å; S40-D456 VanDerWaalsContact N-OD1 3.15Å
41	Y	91.7	Very high	87.9	Confident	28 Å²	28	36.2 Å²	36.2	11%	0.11	21%	0.206	C	C	.	.			trans	59.7	41.1	-170.4	-68.2	0.1	0	0	0	111.9	G39 G43 F44 P64 R65 W117 F453 D456	G39-Y41 VanDerWaalsContact C-N 3.3Å; Y41-G43 PolarHBondContact O-N 2.02Å; Y41-F44 WeakPolarHBondContact O-CB 3.36Å; Y41-F44 PolarHBondContact O-N 2.7Å; Y41-F44 VanDerWaalsContact O-N 3.15Å; Y41-P64 HydrophobicContact CD2-CG 4.42Å; Y41-P64 WeakPolarHBondContact O-CD 3.5Å; Y41-R65 HydrophobicContact CD2-CG 4.16Å; Y41-R65 HydrophobicContact CG-CG 4.41Å; Y41-R65 PolarHBondContact OH-NH1 2.88Å; Y41-W117 HydrophobicContact CE2-CH2 4.43Å; Y41-W117 HydrophobicContact CE2-CZ2 4.43Å; Y41-F453 HydrophobicContact CD1-CD2 4.19Å; Y41-F453 HydrophobicContact CD2-CD2 4.14Å; Y41-F453 HydrophobicContact CE2-CD2 4.48Å; Y41-F453 HydrophobicContact CE2-CE2 4.48Å; Y41-F453 AromaticContact CG-CD2 3.97Å; Y41-F453 HydrophobicContact CG-CD2 3.97Å; Y41-D456 VanDerWaalsContact CA-OD1 3.28Å; Y41-D456 WeakPolarHBondContact CA-OD1 3.01Å; Y41-D456 PolarHBondContact N-OD1 3.2Å
42	F	92.2	Very high	86.7	Confident	1 Å²	1	39.8 Å²	39.8	0%	0.004	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	121.4	178.7	-177.4	-89.6	0	0	0	110.6	S40 I61 A63 Y81 F453 D456 K457 A458	S40-F42 VanDerWaalsContact C-N 3.31Å; F42-I61 HydrophobicContact CD1-CG2 3.85Å; F42-I61 HydrophobicContact CD2-CG2 3.83Å; F42-I61 HydrophobicContact CE1-CB 4.32Å; F42-I61 HydrophobicContact CE1-CD1 3.62Å; F42-I61 HydrophobicContact CE1-CG2 3.69Å; F42-I61 HydrophobicContact CE2-CB 3.91Å; F42-I61 HydrophobicContact CE2-CD1 4.3Å; F42-I61 HydrophobicContact CE2-CG2 3.65Å; F42-I61 HydrophobicContact CG-CG2 3.94Å; F42-I61 HydrophobicContact CZ-CB 3.81Å; F42-I61 HydrophobicContact CZ-CD1 3.36Å; F42-I61 HydrophobicContact CZ-CG1 4.16Å; F42-I61 HydrophobicContact CZ-CG2 3.59Å; F42-A63 HydrophobicContact CB-CB 4.31Å; F42-A63 HydrophobicContact CD2-CB 4.22Å; F42-Y81 AromaticContact CD2-CD2 3.88Å; F42-Y81 HydrophobicContact CD2-CD2 3.88Å; F42-Y81 HydrophobicContact CD2-CE2 4.24Å; F42-Y81 HydrophobicContact CD2-CG 4.41Å; F42-Y81 AromaticContact CE2-CD2 3.78Å; F42-Y81 HydrophobicContact CE2-CD2 3.78Å; F42-Y81 HydrophobicContact CE2-CE2 4.46Å; F42-Y81 AromaticContact CE2-CG 3.85Å; F42-Y81 HydrophobicContact CE2-CG 3.85Å; F42-F453 WeakPolarHBondContact O-CA 3.33Å; F42-D456 HydrophobicContact CB-CB 4.07Å; F42-D456 WeakPolarHBondContact CD1-O 3.27Å; F42-D456 PolarHBondContact N-OD1 3.29Å; F42-D456 VanDerWaalsContact N-OD1 3.15Å; F42-D456 CarbonylContact O-C 3.59Å; F42-D456 VanDerWaalsContact O-C 3.26Å; F42-D456 WeakPolarHBondContact O-CA 3.46Å; F42-K457 PolarHBondContact O-N 2.74Å; F42-K457 VanDerWaalsContact O-N 3.1Å; F42-A458 HydrophobicContact CE1-CB 4.23Å
43	G	91	Very high	85.1	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	97.4	18.8	-173.4	0	0	0	0	0	113.8	Y41 I61 G62 S433 G451	Y41-G43 PolarHBondContact O-N 2.02Å; G43-I61 VanDerWaalsContact N-CG2 3.34Å; G43-G62 PolarHBondContact N-O 3.15Å; G43-G62 VanDerWaalsContact N-O 3.08Å; G43-S433 PolarHBondContact O-OG 3.21Å; G43-S433 VanDerWaalsContact O-OG 3.1Å; G43-G451 WeakPolarHBondContact O-CA 3.45Å
44	F	93.1	Very high	83.4	Confident	30 Å²	30	45.9 Å²	45.9	13%	0.132	28%	0.277	C	S	.	.	S	Bend	trans	-70.9	-35.3	171.9	-175.1	-89.8	0	0	0	112.4	Y41 G62 P64 W117 A120 Y432 S433 F453	Y41-F44 WeakPolarHBondContact O-CB 3.36Å; Y41-F44 PolarHBondContact O-N 2.7Å; Y41-F44 VanDerWaalsContact O-N 3.15Å; F44-G62 PolarHBondContact N-O 2.9Å; F44-P64 HydrophobicContact CB-CG 3.86Å; F44-P64 HydrophobicContact CD1-CG 4.18Å; F44-P64 HydrophobicContact CD2-CG 4.43Å; F44-P64 HydrophobicContact CG-CG 3.9Å; F44-W117 HydrophobicContact CE1-CZ3 4.4Å; F44-W117 AromaticContact CE2-CZ3 3.92Å; F44-W117 HydrophobicContact CE2-CZ3 3.92Å; F44-W117 HydrophobicContact CZ-CE3 4.48Å; F44-W117 AromaticContact CZ-CZ3 3.79Å; F44-W117 HydrophobicContact CZ-CZ3 3.79Å; F44-A120 HydrophobicContact CD1-CB 4.22Å; F44-A120 WeakPolarHBondContact CD1-O 3.39Å; F44-A120 HydrophobicContact CE1-CB 3.95Å; F44-A120 VanDerWaalsContact CE1-O 3.24Å; F44-A120 WeakPolarHBondContact CE1-O 3.44Å; F44-Y432 HydrophobicContact CD2-CD1 4.43Å; F44-Y432 HydrophobicContact CD2-CE1 4.07Å; F44-Y432 HydrophobicContact CE2-CD1 4.32Å; F44-Y432 AromaticContact CE2-CE1 3.53Å; F44-Y432 HydrophobicContact CE2-CE1 3.53Å; F44-Y432 AromaticContact CZ-CE1 3.9Å; F44-Y432 HydrophobicContact CZ-CE1 3.9Å; F44-S433 VanDerWaalsContact O-CB 3.24Å; F44-S433 WeakPolarHBondContact O-CB 3.07Å; F44-S433 PolarHBondContact O-OG 3.35Å; F44-F453 HydrophobicContact CB-CB 4.01Å; F44-F453 HydrophobicContact CD2-CB 4.42Å; F44-F453 HydrophobicContact CD2-CD1 4.26Å; F44-F453 HydrophobicContact CD2-CD2 4.35Å; F44-F453 HydrophobicContact CD2-CG 4.08Å
45	S	93.1	Very high	81.7	Confident	7 Å²	7	54.5 Å²	54.5	5%	0.049	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	141.4	169.6	64.2	0	0	0	0	109.4	G62 G119 A120 V122	S45-G62 PolarHBondContact O-N 2.89Å; S45-G119 PolarHBondContact OG-O 3.09Å; S45-G119 VanDerWaalsContact OG-O 3.12Å; S45-A120 WeakPolarHBondContact CB-O 3.17Å; S45-V122 WeakPolarHBondContact OG-CG2 3.27Å
46	V	93.5	Very high	80.4	Confident	3 Å²	3	54.7 Å²	54.7	2%	0.018	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	142	-179.4	-65.6	0	0	0	0	109.6	L60 I61 T435 V449 A458	V46-L60 WeakPolarHBondContact CA-O 3.36Å; V46-I61 HydrophobicContact CG1-CG1 4.46Å; V46-T435 HydrophobicContact CB-CG2 4.47Å; V46-T435 HydrophobicContact CG2-CG2 4.09Å; V46-V449 HydrophobicContact CB-CG1 3.81Å; V46-V449 HydrophobicContact CG1-CG1 3.99Å; V46-V449 HydrophobicContact CG2-CG1 4.05Å; V46-A458 HydrophobicContact CG1-CB 4.27Å
47	D	92.7	Very high	80	Confident	18 Å²	18	54.3 Å²	54.3	10%	0.096	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	163.7	171.2	-154.6	5.2	0	0	0	112.1	L60 R123 S124 T435	D47-L60 PolarHBondContact N-O 3.39Å; D47-L60 PolarHBondContact O-N 3.15Å; D47-R123 VanDerWaalsContact OD2-CA 3.24Å; D47-R123 WeakPolarHBondContact OD2-CA 3.33Å; D47-S124 PolarHBondContact OD2-N 2.83Å; D47-T435 PolarHBondContact OD1-OG1 2.97Å
48	F	90.4	Very high	79.9	Confident	12 Å²	12	53 Å²	53	5%	0.053	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	143.4	174.2	-67.8	-78.6	0	0	0	111.8	S124 T435 T438 I440 D447 V449 L460	F48-S124 WeakPolarHBondContact O-CB 3.41Å; F48-S124 PolarHBondContact O-OG 2.82Å; F48-S124 VanDerWaalsContact O-OG 3.07Å; F48-T435 HydrophobicContact CD2-CG2 3.62Å; F48-T435 HydrophobicContact CE2-CG2 3.61Å; F48-T435 HydrophobicContact CG-CG2 4.46Å; F48-T435 HydrophobicContact CZ-CG2 4.43Å; F48-T438 HydrophobicContact CB-CG2 4.11Å; F48-T438 HydrophobicContact CD1-CG2 4.34Å; F48-T438 HydrophobicContact CD2-CG2 4.45Å; F48-T438 HydrophobicContact CG-CG2 4.08Å; F48-I440 HydrophobicContact CD1-CD1 4.26Å; F48-I440 HydrophobicContact CE1-CD1 4.14Å; F48-D447 HydrophobicContact CZ-CB 4.5Å; F48-V449 HydrophobicContact CD1-CG2 4.39Å; F48-V449 HydrophobicContact CE1-CG2 3.57Å; F48-V449 HydrophobicContact CE2-CG2 4.29Å; F48-V449 HydrophobicContact CZ-CB 4.38Å; F48-V449 HydrophobicContact CZ-CG2 3.53Å; F48-L460 HydrophobicContact CE1-CD1 4.17Å; F48-L460 HydrophobicContact CZ-CD1 4.46Å
49	F	87	Confident	80.1	Confident	36 Å²	36	45.6 Å²	45.6	16%	0.158	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	114.8	173	179.8	-109.5	0	0	0	110.9	D58 L60 G126 I129	F49-D58 HydrophobicContact CD1-CB 4.35Å; F49-D58 PolarHBondContact N-O 3.31Å; F49-D58 PolarHBondContact O-N 3.31Å; F49-L60 HydrophobicContact CB-CD1 3.83Å; F49-L60 HydrophobicContact CB-CD2 4.06Å; F49-L60 HydrophobicContact CB-CG 3.67Å; F49-L60 HydrophobicContact CD2-CD1 4.44Å; F49-L60 HydrophobicContact CG-CD1 4.39Å; F49-L60 HydrophobicContact CG-CD2 4.49Å; F49-L60 HydrophobicContact CG-CG 4.49Å; F49-G126 WeakPolarHBondContact CE2-O 3.35Å; F49-I129 HydrophobicContact CD2-CD1 3.86Å; F49-I129 HydrophobicContact CD2-CG1 3.79Å; F49-I129 HydrophobicContact CE2-CD1 3.77Å; F49-I129 HydrophobicContact CE2-CG1 3.74Å; F49-I129 HydrophobicContact CG-CD1 4.36Å; F49-I129 HydrophobicContact CZ-CD1 4.2Å
50	K	77.5	Confident	80.4	Confident	111 Å²	111	43.5 Å²	43.5	48%	0.483	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	96.4	178.4	-170.5	174.7	-176.1	170.9	0	109.6	G126	K50-G126 CarbonylContact O-C 3.59Å; K50-G126 WeakPolarHBondContact O-CA 3.41Å; K50-G126 VanDerWaalsContact O-O 3.1Å
51	S	68.1	Low	80.8	Confident	27 Å²	27	43.3 Å²	43.3	19%	0.189	24%	0.237	C	C	.	.			trans	-70.5	136.4	178.1	-174.9	0	0	0	0	111.4	T53 N54	S51-T53 PolarHBondContact O-N 2.86Å; S51-T53 PolarHBondContact OG-N 2.9Å; S51-T53 PolarHBondContact OG-OG1 3.29Å; S51-T53 VanDerWaalsContact OG-OG1 3.08Å; S51-N54 VanDerWaalsContact O-O 3.08Å
52	A	60	Low	80.9	Confident	104 Å²	104	42 Å²	42	86%	0.86	23%	0.232	S	C	*	.	S	Bend	trans	-63.2	-19.5	173.9	0	0	0	0	0	113.9
53	T	54	Low	80.9	Confident	127 Å²	127	42 Å²	42	78%	0.779	23%	0.232	S	C	*	.	S	Bend	trans	-100.9	-20.4	-174.1	56	0	0	0	0	114.3	S51	S51-T53 PolarHBondContact O-N 2.86Å; S51-T53 PolarHBondContact OG-N 2.9Å; S51-T53 PolarHBondContact OG-OG1 3.29Å; S51-T53 VanDerWaalsContact OG-OG1 3.08Å
54	N	55.1	Low	81	Confident	109 Å²	109	42 Å²	42	58%	0.583	23%	0.232	S	C	*	.			trans	-114.8	129.8	179.5	-91.7	-20.5	0	0	0	110	S51 N56	S51-N54 VanDerWaalsContact O-O 3.08Å; N54-N56 PolarHBondContact O-N 2.99Å; N54-N56 VanDerWaalsContact O-N 3.07Å
55	Q	54.3	Low	80.8	Confident	181 Å²	181	44.3 Å²	44.3	85%	0.846	24%	0.24	S	C	*	.	S	Bend	trans	-68.5	0.5	172.9	-70.5	-176.7	-15.2	0	0	113.9
56	N	63.2	Low	80.6	Confident	76 Å²	76	44 Å²	44	41%	0.406	24%	0.238	S	C	.	.			trans	-101.1	122.9	178.9	-70.5	-23.4	0	0	0	109.5	N54 K86	N54-N56 PolarHBondContact O-N 2.99Å; N54-N56 VanDerWaalsContact O-N 3.07Å; N56-K86 PolarHBondContact OD1-NZ 3.01Å; N56-K86 VanDerWaalsContact OD1-NZ 3.09Å
57	S	76.6	Confident	80.1	Confident	5 Å²	5	48.8 Å²	48.8	4%	0.035	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	134.2	169.9	-52.5	0	0	0	0	109.6	W85 I440	S57-W85 VanDerWaalsContact O-CD1 3.24Å; S57-I440 VanDerWaalsContact CB-CG1 3.49Å
58	D	86.9	Confident	79.1	Confident	35 Å²	35	49.2 Å²	49.2	19%	0.187	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	159.1	177.1	-70.4	-6.3	0	0	0	110.2	F49 S82 C83 P84	F49-D58 HydrophobicContact CD1-CB 4.35Å; F49-D58 PolarHBondContact N-O 3.31Å; F49-D58 PolarHBondContact O-N 3.31Å; D58-S82 WeakPolarHBondContact CB-OG 3.44Å; D58-S82 PolarHBondContact OD2-OG 2.85Å; D58-C83 WeakPolarHBondContact CA-O 3.36Å; D58-P84 WeakPolarHBondContact OD1-CA 3.17Å
59	V	89.6	Confident	77.7	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	125.9	171.4	-175.6	0	0	0	0	108.3	Y34 I61 C83 I440 V449	Y34-V59 HydrophobicContact CE2-CG2 4.48Å; V59-I61 HydrophobicContact CG1-CD1 4.34Å; V59-I61 HydrophobicContact CG1-CG1 4.02Å; V59-C83 PolarHBondContact N-O 2.86Å; V59-C83 PolarHBondContact O-N 2.93Å; V59-I440 HydrophobicContact CG2-CD1 3.71Å; V59-V449 HydrophobicContact CG1-CG1 3.95Å; V59-V449 HydrophobicContact CG1-CG2 3.97Å; V59-V449 HydrophobicContact CG2-CG2 4.24Å
60	L	91.9	Very high	76.4	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	130.8	174.1	-60.8	177.6	0	0	0	109.8	V46 D47 F49 Y81 L94 V122 I129	V46-L60 WeakPolarHBondContact CA-O 3.36Å; D47-L60 PolarHBondContact N-O 3.39Å; D47-L60 PolarHBondContact O-N 3.15Å; F49-L60 HydrophobicContact CB-CD1 3.83Å; F49-L60 HydrophobicContact CB-CD2 4.06Å; F49-L60 HydrophobicContact CB-CG 3.67Å; F49-L60 HydrophobicContact CD2-CD1 4.44Å; F49-L60 HydrophobicContact CG-CD1 4.39Å; F49-L60 HydrophobicContact CG-CD2 4.49Å; F49-L60 HydrophobicContact CG-CG 4.49Å; L60-Y81 CarbonylContact C-O 3.52Å; L60-Y81 WeakPolarHBondContact CA-O 3.48Å; L60-L94 HydrophobicContact CD2-CD1 3.91Å; L60-V122 HydrophobicContact CB-CG1 4Å; L60-V122 HydrophobicContact CD1-CG1 4.13Å; L60-I129 HydrophobicContact CD1-CD1 4.02Å; L60-I129 HydrophobicContact CD1-CG1 4.02Å; L60-I129 HydrophobicContact CD1-CG2 3.81Å; L60-I129 HydrophobicContact CD2-CD1 4.16Å
61	I	94.1	Very high	75.3	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	122.3	-178	-56.4	169.8	0	0	0	109.4	Y34 F42 G43 V46 V59 Y81 C83 A458	Y34-I61 HydrophobicContact CD2-CD1 4.19Å; Y34-I61 HydrophobicContact CG-CD1 4.1Å; F42-I61 HydrophobicContact CD1-CG2 3.85Å; F42-I61 HydrophobicContact CD2-CG2 3.83Å; F42-I61 HydrophobicContact CE1-CB 4.32Å; F42-I61 HydrophobicContact CE1-CD1 3.62Å; F42-I61 HydrophobicContact CE1-CG2 3.69Å; F42-I61 HydrophobicContact CE2-CB 3.91Å; F42-I61 HydrophobicContact CE2-CD1 4.3Å; F42-I61 HydrophobicContact CE2-CG2 3.65Å; F42-I61 HydrophobicContact CG-CG2 3.94Å; F42-I61 HydrophobicContact CZ-CB 3.81Å; F42-I61 HydrophobicContact CZ-CD1 3.36Å; F42-I61 HydrophobicContact CZ-CG1 4.16Å; F42-I61 HydrophobicContact CZ-CG2 3.59Å; G43-I61 VanDerWaalsContact N-CG2 3.34Å; V46-I61 HydrophobicContact CG1-CG1 4.46Å; V59-I61 HydrophobicContact CG1-CD1 4.34Å; V59-I61 HydrophobicContact CG1-CG1 4.02Å; I61-Y81 PolarHBondContact N-O 2.98Å; I61-Y81 PolarHBondContact O-N 3.04Å; I61-C83 HydrophobicContact CD1-CB 4.43Å; I61-A458 HydrophobicContact CD1-CB 3.56Å; I61-A458 HydrophobicContact CG1-CB 4.14Å; I61-A458 HydrophobicContact CG2-CB 4.38Å
62	G	93.8	Very high	75	Confident	0 Å²	0	57 Å²	57	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	138.4	174.7	0	0	0	0	0	112.1	G43 F44 S45 G119	G43-G62 PolarHBondContact N-O 3.15Å; G43-G62 VanDerWaalsContact N-O 3.08Å; F44-G62 PolarHBondContact N-O 2.9Å; S45-G62 PolarHBondContact O-N 2.89Å; G62-G119 VanDerWaalsContact CA-O 3.3Å; G62-G119 WeakPolarHBondContact CA-O 3.27Å
63	A	94	Very high	75.4	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	84.4	176.8	0	0	0	0	0	109.4	S40 F42 R65 A66 G78 A79 Y81	S40-A63 CarbonylContact O-C 3.52Å; S40-A63 VanDerWaalsContact O-C 3.24Å; S40-A63 WeakPolarHBondContact O-CA 3.4Å; F42-A63 HydrophobicContact CB-CB 4.31Å; F42-A63 HydrophobicContact CD2-CB 4.22Å; A63-R65 PolarHBondContact O-N 2.98Å; A63-R65 VanDerWaalsContact O-N 3.14Å; A63-A66 HydrophobicContact CB-CB 3.87Å; A63-A66 WeakPolarHBondContact O-CB 3.34Å; A63-A66 PolarHBondContact O-N 2.87Å; A63-A66 VanDerWaalsContact O-N 3.13Å; A63-G78 WeakPolarHBondContact O-CA 3.48Å; A63-A79 PolarHBondContact N-O 2.89Å; A63-A79 PolarHBondContact O-N 2.8Å; A63-Y81 HydrophobicContact CB-CD2 4.12Å; A63-Y81 HydrophobicContact CB-CE2 3.79Å
64	P	91.5	Very high	76.3	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-17.8	-168.7	24.3	-33.5	0	0	0	114.8	Y41 F44 G78 W117 F118 A120	Y41-P64 HydrophobicContact CD2-CG 4.42Å; Y41-P64 WeakPolarHBondContact O-CD 3.5Å; F44-P64 HydrophobicContact CB-CG 3.86Å; F44-P64 HydrophobicContact CD1-CG 4.18Å; F44-P64 HydrophobicContact CD2-CG 4.43Å; F44-P64 HydrophobicContact CG-CG 3.9Å; P64-G78 VanDerWaalsContact O-CA 3.28Å; P64-G78 WeakPolarHBondContact O-CA 3.44Å; P64-W117 HydrophobicContact CB-CB 4Å; P64-W117 HydrophobicContact CB-CD2 4.09Å; P64-W117 HydrophobicContact CB-CE3 4.11Å; P64-W117 HydrophobicContact CB-CG 4.05Å; P64-W117 HydrophobicContact CG-CE3 4.36Å; P64-W117 WeakPolarHBondContact O-CA 3.2Å; P64-F118 WeakPolarHBondContact CA-O 3.4Å; P64-A120 HydrophobicContact CB-CB 4.27Å
65	R	90.3	Very high	77.7	Confident	80 Å²	80	50.1 Å²	50.1	30%	0.302	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	10.4	177.7	-65.6	-172.8	174.5	-170.1	-2.6	113.4	G39 S40 Y41 A63	G39-R65 WeakPolarHBondContact O-CB 3Å; S40-R65 PolarHBondContact O-N 2.77Å; Y41-R65 HydrophobicContact CD2-CG 4.16Å; Y41-R65 HydrophobicContact CG-CG 4.41Å; Y41-R65 PolarHBondContact OH-NH1 2.88Å; A63-R65 PolarHBondContact O-N 2.98Å; A63-R65 VanDerWaalsContact O-N 3.14Å
66	A	87.3	Confident	79.1	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.008	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-62.4	138.9	175.7	0	0	0	0	0	111.5	S40 A63 G78 A79 Y81	S40-A66 PolarHBondContact O-N 2.94Å; A63-A66 HydrophobicContact CB-CB 3.87Å; A63-A66 WeakPolarHBondContact O-CB 3.34Å; A63-A66 PolarHBondContact O-N 2.87Å; A63-A66 VanDerWaalsContact O-N 3.13Å; A66-G78 WeakPolarHBondContact O-CA 3.48Å; A66-G78 PolarHBondContact O-N 3.03Å; A66-A79 HydrophobicContact CB-CB 3.76Å; A66-Y81 HydrophobicContact CB-CE2 4.4Å
67	N	84.9	Confident	80.1	Confident	102 Å²	102	41 Å²	41	55%	0.545	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-80.7	146.7	164.7	-74.8	-36.3	0	0	0	109.7	E76	N67-E76 PolarHBondContact OD1-N 2.81Å
68	T	70.8	Confident	80.7	Confident	27 Å²	27	40.9 Å²	40.9	17%	0.166	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-74.7	149.4	174	50.9	0	0	0	0	111.1	S70 R77	T68-S70 PolarHBondContact O-N 3.05Å; T68-R77 HydrophobicContact CG2-CB 4.05Å; T68-R77 HydrophobicContact CG2-CG 4.39Å
69	S	61.3	Low	80.8	Confident	115 Å²	115	39.3 Å²	39.3	80%	0.804	24%	0.238	S	C	*	.	S	Bend	trans	-65.9	-19.2	178	52.2	0	0	0	0	114.4
70	S	59.1	Low	80.9	Confident	61 Å²	61	39.3 Å²	39.3	43%	0.427	24%	0.238	S	C	.	.	S	Bend	trans	-86.8	142.6	174.8	55.7	0	0	0	0	112	T68 S72	T68-S70 PolarHBondContact O-N 3.05Å; S70-S72 VanDerWaalsContact C-N 3.26Å; S70-S72 PolarHBondContact O-N 3.31Å
71	S	55	Low	80.9	Confident	133 Å²	133	40.5 Å²	40.5	93%	0.93	24%	0.243	S	C	*	.			trans	-68.4	81	173.9	61.4	0	0	0	0	110.4
72	S	61	Low	80.7	Confident	41 Å²	41	41.1 Å²	41.1	29%	0.287	25%	0.247	S	C	.	.			trans	-105.2	159.5	177.4	83.6	0	0	0	0	110.9	S70 V74	S70-S72 VanDerWaalsContact C-N 3.26Å; S70-S72 PolarHBondContact O-N 3.31Å; S72-V74 PolarHBondContact O-N 3.27Å; S72-V74 PolarHBondContact OG-N 3Å; S72-V74 PolarHBondContact OG-O 2.77Å
73	T	68.4	Low	80.4	Confident	111 Å²	111	41.1 Å²	41.1	68%	0.681	25%	0.247	S	C	*	.	S	Bend	trans	-74.5	-5.6	172.7	48.3	0	0	0	0	113.2	V100	T73-V100 WeakPolarHBondContact OG1-CG1 2.99Å
74	V	74.1	Confident	80.1	Confident	5 Å²	5	42.6 Å²	42.6	3%	0.03	26%	0.256	C	S	.	.			trans	-91	115.2	-174.9	-178.4	0	0	0	0	109.6	S72 R77 K113	S72-V74 PolarHBondContact O-N 3.27Å; S72-V74 PolarHBondContact OG-N 3Å; S72-V74 PolarHBondContact OG-O 2.77Å; V74-R77 HydrophobicContact CG1-CB 3.99Å; V74-R77 HydrophobicContact CG1-CG 4.37Å; V74-K113 HydrophobicContact CG1-CB 3.84Å
75	V	83.1	Confident	79.4	Confident	79 Å²	79	44.5 Å²	44.5	48%	0.479	26%	0.263	S	S	.	.	S	Bend	trans	-92.4	137	-178	-179.9	0	0	0	0	110	R77 S114 K115	V75-R77 VanDerWaalsContact C-N 3.32Å; V75-R77 PolarHBondContact O-N 3.37Å; V75-S114 PolarHBondContact N-OG 2.81Å; V75-S114 WeakPolarHBondContact O-CA 3.38Å; V75-K115 PolarHBondContact O-N 2.86Å; V75-K115 VanDerWaalsContact O-N 3.09Å
76	E	83.8	Confident	78.6	Confident	57 Å²	57	47 Å²	47	27%	0.266	28%	0.276	S	S	.	.	S	Bend	trans	49.8	51	178.1	-66.8	171.8	-165.7	0	0	111.8	N67 G78 K115	N67-E76 PolarHBondContact OD1-N 2.81Å; E76-G78 PolarHBondContact O-N 3.11Å; E76-K115 HydrophobicContact CB-CG 4.17Å; E76-K115 WeakPolarHBondContact O-CA 3.46Å; E76-K115 PolarHBondContact O-N 2.85Å
77	R	84.9	Confident	78	Confident	10 Å²	10	51 Å²	51	4%	0.038	30%	0.298	C	S	.	.			trans	-57.7	-37	176.7	-176.3	179.6	-71.9	-138.7	-15.2	111.2	T68 V74 V75 D97 K99 Q116 F118	T68-R77 HydrophobicContact CG2-CB 4.05Å; T68-R77 HydrophobicContact CG2-CG 4.39Å; V74-R77 HydrophobicContact CG1-CB 3.99Å; V74-R77 HydrophobicContact CG1-CG 4.37Å; V75-R77 VanDerWaalsContact C-N 3.32Å; V75-R77 PolarHBondContact O-N 3.37Å; R77-D97 PolarHBondContact NH1-O 3.3Å; R77-D97 IonicContact NH1-OD2 3.76Å; R77-D97 PolarHBondContact NH1-OD2 3.33Å; R77-K99 PolarHBondContact NH1-O 2.83Å; R77-K99 VanDerWaalsContact NH1-O 3.12Å; R77-K99 PolarHBondContact NH2-O 3.16Å; R77-Q116 VanDerWaalsContact CG-NE2 3.29Å; R77-Q116 VanDerWaalsContact O-CG 3.25Å; R77-Q116 WeakPolarHBondContact O-CG 3.42Å; R77-Q116 PolarHBondContact O-NE2 2.8Å; R77-F118 WeakPolarHBondContact O-CB 3.34Å; R77-F118 PolarHBondContact O-N 3.28Å
78	G	88.4	Confident	77	Confident	2 Å²	2	47.5 Å²	47.5	2%	0.021	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	88.9	157.5	-166.3	0	0	0	0	0	111.9	A63 P64 A66 E76 F118	A63-G78 WeakPolarHBondContact O-CA 3.48Å; P64-G78 VanDerWaalsContact O-CA 3.28Å; P64-G78 WeakPolarHBondContact O-CA 3.44Å; A66-G78 WeakPolarHBondContact O-CA 3.48Å; A66-G78 PolarHBondContact O-N 3.03Å; E76-G78 PolarHBondContact O-N 3.11Å; G78-F118 CarbonylContact C-O 3.57Å; G78-F118 VanDerWaalsContact CA-O 3.24Å; G78-F118 WeakPolarHBondContact CA-O 3.27Å
79	A	89.8	Confident	76.7	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.008	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	161.7	-178.5	0	0	0	0	0	112.2	A63 A66 Y81 Q93 F118	A63-A79 PolarHBondContact N-O 2.89Å; A63-A79 PolarHBondContact O-N 2.8Å; A66-A79 HydrophobicContact CB-CB 3.76Å; A79-Y81 HydrophobicContact CB-CE2 4.01Å; A79-Q93 HydrophobicContact CB-CG 4.03Å; A79-Q93 VanDerWaalsContact CB-NE2 3.31Å; A79-F118 PolarHBondContact N-O 2.81Å; A79-F118 VanDerWaalsContact N-O 3.15Å
80	V	91.8	Very high	77.3	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	135.4	170.5	-178.2	0	0	0	0	108.7	L94 F96 F118 V122 A131	V80-L94 HydrophobicContact CG1-CD1 4.43Å; V80-L94 PolarHBondContact O-N 3.44Å; V80-F96 HydrophobicContact CB-CE2 4.05Å; V80-F96 HydrophobicContact CG2-CE2 4.37Å; V80-F118 HydrophobicContact CG2-CE1 4.15Å; V80-F118 HydrophobicContact CG2-CZ 4.27Å; V80-V122 HydrophobicContact CG1-CG1 4.18Å; V80-V122 HydrophobicContact CG1-CG2 4.1Å; V80-V122 HydrophobicContact CG2-CG2 3.7Å; V80-A131 HydrophobicContact CG2-CB 3.74Å
81	Y	90.8	Very high	78.5	Confident	26 Å²	26	45.8 Å²	45.8	10%	0.102	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	140	-179.9	-67	-95.8	0	0	0	110.3	F42 L60 I61 A63 A66 A79 Q92 Q93	F42-Y81 AromaticContact CD2-CD2 3.88Å; F42-Y81 HydrophobicContact CD2-CD2 3.88Å; F42-Y81 HydrophobicContact CD2-CE2 4.24Å; F42-Y81 HydrophobicContact CD2-CG 4.41Å; F42-Y81 AromaticContact CE2-CD2 3.78Å; F42-Y81 HydrophobicContact CE2-CD2 3.78Å; F42-Y81 HydrophobicContact CE2-CE2 4.46Å; F42-Y81 AromaticContact CE2-CG 3.85Å; F42-Y81 HydrophobicContact CE2-CG 3.85Å; L60-Y81 CarbonylContact C-O 3.52Å; L60-Y81 WeakPolarHBondContact CA-O 3.48Å; I61-Y81 PolarHBondContact N-O 2.98Å; I61-Y81 PolarHBondContact O-N 3.04Å; A63-Y81 HydrophobicContact CB-CD2 4.12Å; A63-Y81 HydrophobicContact CB-CE2 3.79Å; A66-Y81 HydrophobicContact CB-CE2 4.4Å; A79-Y81 HydrophobicContact CB-CE2 4.01Å; Y81-Q92 CarbonylContact C-O 3.45Å; Y81-Q92 WeakPolarHBondContact CA-O 3.43Å; Y81-Q93 HydrophobicContact CD1-CB 4.08Å; Y81-Q93 HydrophobicContact CE1-CB 3.85Å; Y81-Q93 HydrophobicContact CE1-CG 4.42Å
82	S	90.1	Very high	80	Confident	12 Å²	12	46.2 Å²	46.2	8%	0.084	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	122.2	166.2	-162.1	0	0	0	0	108.8	D58 C91 Q92	D58-S82 WeakPolarHBondContact CB-OG 3.44Å; D58-S82 PolarHBondContact OD2-OG 2.85Å; S82-C91 WeakPolarHBondContact O-CA 3.36Å; S82-Q92 PolarHBondContact N-O 3.3Å; S82-Q92 PolarHBondContact O-N 2.75Å
83	C	89.1	Confident	81.2	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	117	-177.6	-64	0	0	0	0	110.2	Y34 D58 V59 I61 C91	Y34-C83 HydrophobicContact CD1-CB 3.66Å; Y34-C83 HydrophobicContact CE1-CB 3.71Å; Y34-C83 HydrophobicContact CG-CB 4.34Å; D58-C83 WeakPolarHBondContact CA-O 3.36Å; V59-C83 PolarHBondContact N-O 2.86Å; V59-C83 PolarHBondContact O-N 2.93Å; I61-C83 HydrophobicContact CD1-CB 4.43Å; C83-C91 HydrophobicContact CB-CB 4.19Å; C83-C91 WeakPolarHBondContact CB-SG 3.41Å; C83-C91 WeakPolarHBondContact SG-CB 3.46Å; C83-C91 CovalentContact SG-SG 2.04Å; C83-C91 PolarHBondContact SG-SG 2.77Å
84	P	86.4	Confident	82.1	Confident	32 Å²	32	43.4 Å²	43.4	21%	0.208	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	136.8	177.1	30.3	-33.5	0	0	0	110.6	D58 K86 N87 S90	D58-P84 WeakPolarHBondContact OD1-CA 3.17Å; P84-K86 VanDerWaalsContact C-N 3.3Å; P84-K86 PolarHBondContact O-N 3.23Å; P84-N87 CarbonylContact O-C 3.36Å; P84-N87 PolarHBondContact O-N 2.92Å; P84-S90 VanDerWaalsContact CD-O 3.25Å; P84-S90 WeakPolarHBondContact CD-O 3.37Å; P84-S90 WeakPolarHBondContact CG-OG 3.39Å
85	W	77.9	Confident	82.6	Confident	39 Å²	39	48.3 Å²	48.3	15%	0.148	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-33	-173.6	77.7	-103.5	0	0	0	114.1	Y34 S57 N87 I440 L460	Y34-W85 WeakPolarHBondContact OH-CA 3.48Å; S57-W85 VanDerWaalsContact O-CD1 3.24Å; W85-N87 VanDerWaalsContact C-N 3.26Å; W85-N87 PolarHBondContact O-N 2.04Å; W85-I440 HydrophobicContact CB-CD1 3.63Å; W85-I440 HydrophobicContact CB-CG1 4.17Å; W85-I440 HydrophobicContact CG-CD1 4.28Å; W85-I440 HydrophobicContact CG-CG1 4.29Å; W85-L460 HydrophobicContact CB-CD2 4.42Å
86	K	73.8	Confident	82.5	Confident	132 Å²	132	45.5 Å²	45.5	57%	0.574	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71	-20.1	-177.7	-65.5	177.4	-178.7	159.9	0	113.1	N56 P84	N56-K86 PolarHBondContact OD1-NZ 3.01Å; N56-K86 VanDerWaalsContact OD1-NZ 3.09Å; P84-K86 VanDerWaalsContact C-N 3.3Å; P84-K86 PolarHBondContact O-N 3.23Å
87	N	74.1	Confident	82.1	Confident	86 Å²	86	44.2 Å²	44.2	46%	0.46	24%	0.242	S	C	.	.			trans	-146.7	93.2	-176.9	-170.5	6.9	0	0	0	111.4	P84 W85 A89 S90	P84-N87 CarbonylContact O-C 3.36Å; P84-N87 PolarHBondContact O-N 2.92Å; W85-N87 VanDerWaalsContact C-N 3.26Å; W85-N87 PolarHBondContact O-N 2.04Å; N87-A89 PolarHBondContact O-N 2.92Å; N87-A89 VanDerWaalsContact O-N 3.09Å; N87-A89 PolarHBondContact OD1-N 3.14Å; N87-S90 WeakPolarHBondContact CB-OG 3.44Å; N87-S90 PolarHBondContact O-N 3.04Å; N87-S90 VanDerWaalsContact O-N 3.11Å; N87-S90 PolarHBondContact O-OG 3.22Å
88	A	64.4	Low	81.3	Confident	28 Å²	28	48.9 Å²	48.9	23%	0.231	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-19.8	-179.3	0	0	0	0	0	114.3	Y34	Y34-A88 HydrophobicContact CD1-CB 3.73Å; Y34-A88 HydrophobicContact CE1-CB 3.76Å
89	A	64	Low	80.5	Confident	95 Å²	95	54.5 Å²	54.5	79%	0.785	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-11.5	178.9	0	0	0	0	0	113.9	N87	N87-A89 PolarHBondContact O-N 2.92Å; N87-A89 VanDerWaalsContact O-N 3.09Å; N87-A89 PolarHBondContact OD1-N 3.14Å
90	S	73.3	Confident	79.5	Confident	40 Å²	40	58.1 Å²	58.1	28%	0.28	31%	0.314	S	S	.	.			trans	-104.9	40.3	-176.8	60.9	0	0	0	0	113.3	P84 N87 Q92	P84-S90 VanDerWaalsContact CD-O 3.25Å; P84-S90 WeakPolarHBondContact CD-O 3.37Å; P84-S90 WeakPolarHBondContact CG-OG 3.39Å; N87-S90 WeakPolarHBondContact CB-OG 3.44Å; N87-S90 PolarHBondContact O-N 3.04Å; N87-S90 VanDerWaalsContact O-N 3.11Å; N87-S90 PolarHBondContact O-OG 3.22Å; S90-Q92 PolarHBondContact O-N 3.2Å
91	C	83.6	Confident	78.4	Confident	33 Å²	33	59.1 Å²	59.1	22%	0.223	32%	0.319	C	S	.	.			trans	-65.2	124.6	169.8	-70.9	0	0	0	0	110.4	S82 C83	S82-C91 WeakPolarHBondContact O-CA 3.36Å; C83-C91 HydrophobicContact CB-CB 4.19Å; C83-C91 WeakPolarHBondContact CB-SG 3.41Å; C83-C91 WeakPolarHBondContact SG-CB 3.46Å; C83-C91 CovalentContact SG-SG 2.04Å; C83-C91 PolarHBondContact SG-SG 2.77Å
92	Q	87.1	Confident	77.2	Confident	141 Å²	141	60.6 Å²	60.6	66%	0.659	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.9	134.2	-179.8	-65.7	-174	-8.5	0	0	110.7	Y81 S82 S90 L94	Y81-Q92 CarbonylContact C-O 3.45Å; Y81-Q92 WeakPolarHBondContact CA-O 3.43Å; S82-Q92 PolarHBondContact N-O 3.3Å; S82-Q92 PolarHBondContact O-N 2.75Å; S90-Q92 PolarHBondContact O-N 3.2Å; Q92-L94 PolarHBondContact O-N 3.01Å
93	Q	87.6	Confident	76	Confident	59 Å²	59	68.1 Å²	68.1	28%	0.276	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	126.9	173	-174.7	178.7	-1.9	0	0	109.9	A79 Y81	A79-Q93 HydrophobicContact CB-CG 4.03Å; A79-Q93 VanDerWaalsContact CB-NE2 3.31Å; Y81-Q93 HydrophobicContact CD1-CB 4.08Å; Y81-Q93 HydrophobicContact CE1-CB 3.85Å; Y81-Q93 HydrophobicContact CE1-CG 4.42Å
94	L	85.4	Confident	74.6	Confident	35 Å²	35	69.6 Å²	69.6	18%	0.183	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	126.4	173.8	-66.9	178.5	0	0	0	109.9	L60 V80 Q92 F96 I129	L60-L94 HydrophobicContact CD2-CD1 3.91Å; V80-L94 HydrophobicContact CG1-CD1 4.43Å; V80-L94 PolarHBondContact O-N 3.44Å; Q92-L94 PolarHBondContact O-N 3.01Å; L94-F96 HydrophobicContact CB-CD2 4.17Å; L94-F96 HydrophobicContact CB-CE2 3.66Å; L94-F96 HydrophobicContact CD1-CE2 4.3Å; L94-F96 WeakPolarHBondContact O-CD2 3.23Å; L94-I129 HydrophobicContact CD1-CD1 3.94Å
95	L	84.4	Confident	73.3	Confident	107 Å²	107	78.5 Å²	78.5	56%	0.56	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-82.3	120	174.5	-162.5	69	0	0	0	109.9	D98 K155	L95-D98 HydrophobicContact CD1-CB 4.24Å; L95-K155 PolarHBondContact O-NZ 2.76Å
96	F	81.3	Confident	72.2	Confident	20 Å²	20	83.5 Å²	83.5	9%	0.088	43%	0.427	C	S	.	.	S	Bend	trans	-110.2	-58.6	173.4	-73.4	-96.8	0	0	0	110.5	V80 L94 F118 I129 A131 K155 V160	V80-F96 HydrophobicContact CB-CE2 4.05Å; V80-F96 HydrophobicContact CG2-CE2 4.37Å; L94-F96 HydrophobicContact CB-CD2 4.17Å; L94-F96 HydrophobicContact CB-CE2 3.66Å; L94-F96 HydrophobicContact CD1-CE2 4.3Å; L94-F96 WeakPolarHBondContact O-CD2 3.23Å; F96-F118 HydrophobicContact CB-CE1 4.27Å; F96-F118 HydrophobicContact CB-CZ 3.88Å; F96-F118 HydrophobicContact CD1-CZ 4.18Å; F96-F118 AromaticContact CD2-CE1 3.83Å; F96-F118 HydrophobicContact CD2-CE1 3.83Å; F96-F118 AromaticContact CD2-CZ 3.57Å; F96-F118 HydrophobicContact CD2-CZ 3.57Å; F96-F118 HydrophobicContact CE2-CE1 4.45Å; F96-F118 HydrophobicContact CE2-CZ 4.08Å; F96-F118 HydrophobicContact CG-CE1 4.2Å; F96-F118 AromaticContact CG-CZ 3.63Å; F96-F118 HydrophobicContact CG-CZ 3.63Å; F96-I129 HydrophobicContact CZ-CG2 4.01Å; F96-A131 HydrophobicContact CE1-CB 4.33Å; F96-A131 HydrophobicContact CZ-CB 4.12Å; F96-K155 HydrophobicContact CD1-CB 4.04Å; F96-K155 HydrophobicContact CD1-CD 4.35Å; F96-K155 HydrophobicContact CE1-CB 3.49Å; F96-K155 VanDerWaalsContact CE1-CB 3.49Å; F96-K155 HydrophobicContact CE1-CD 3.92Å; F96-K155 HydrophobicContact CE1-CG 4.34Å; F96-K155 HydrophobicContact CZ-CB 4.25Å; F96-K155 HydrophobicContact CZ-CD 4.03Å; F96-V160 HydrophobicContact CB-CG1 4.33Å; F96-V160 HydrophobicContact CD1-CG1 4.08Å
97	D	75.5	Confident	71.5	Confident	30 Å²	30	79.2 Å²	79.2	16%	0.16	42%	0.42	C	S	.	.			trans	-136.3	128.5	176.7	-179.2	31.6	0	0	0	111	R77 K99 K113 Y153	R77-D97 PolarHBondContact NH1-O 3.3Å; R77-D97 IonicContact NH1-OD2 3.76Å; R77-D97 PolarHBondContact NH1-OD2 3.33Å; D97-K99 VanDerWaalsContact OD1-CB 3.25Å; D97-K99 WeakPolarHBondContact OD1-CB 3.16Å; D97-K99 WeakPolarHBondContact OD1-CG 3.33Å; D97-K99 PolarHBondContact OD1-N 3.34Å; D97-K113 WeakPolarHBondContact OD2-CE 3.31Å; D97-K113 IonicContact OD2-NZ 3.37Å; D97-K113 PolarHBondContact OD2-NZ 3.27Å; D97-Y153 HydrophobicContact CB-CE1 4.24Å
98	D	69.5	Low	71	Confident	108 Å²	108	80.5 Å²	80.5	58%	0.578	43%	0.427	S	S	*	.			trans	-110.1	-1.5	174.8	65.7	-15.4	0	0	0	113.2	L95	L95-D98 HydrophobicContact CD1-CB 4.24Å
99	K	71.1	Confident	71.2	Confident	120 Å²	120	81.9 Å²	81.9	52%	0.522	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-71	146.2	-178.6	-63	177.6	-178	176.7	0	111.9	R77 D97	R77-K99 PolarHBondContact NH1-O 2.83Å; R77-K99 VanDerWaalsContact NH1-O 3.12Å; R77-K99 PolarHBondContact NH2-O 3.16Å; D97-K99 VanDerWaalsContact OD1-CB 3.25Å; D97-K99 WeakPolarHBondContact OD1-CB 3.16Å; D97-K99 WeakPolarHBondContact OD1-CG 3.33Å; D97-K99 PolarHBondContact OD1-N 3.34Å
100	V	68.8	Low	71.8	Confident	77 Å²	77	77.5 Å²	77.5	47%	0.467	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-76.3	168.1	170.8	-158.3	0	0	0	0	109.2	T73 D102	T73-V100 WeakPolarHBondContact OG1-CG1 2.99Å; V100-D102 PolarHBondContact O-N 2.96Å
101	D	68.4	Low	72	Confident	21 Å²	21	75.8 Å²	75.8	11%	0.112	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-55.8	122.2	177.7	-60.9	-45.8	0	0	0	112.5	Q109 E111 K113	D101-Q109 HydrophobicContact CB-CG 4.07Å; D101-Q109 PolarHBondContact OD2-NE2 2.98Å; D101-E111 VanDerWaalsContact CA-OE1 3.32Å; D101-E111 WeakPolarHBondContact CA-OE1 3.35Å; D101-E111 HydrophobicContact CB-CG 4.17Å; D101-E111 WeakPolarHBondContact CB-O 3.47Å; D101-K113 VanDerWaalsContact OD1-CB 3.31Å; D101-K113 WeakPolarHBondContact OD1-CB 3.04Å; D101-K113 WeakPolarHBondContact OD1-CG 3.48Å; D101-K113 PolarHBondContact OD1-N 2.88Å
102	D	65.3	Low	71.9	Confident	58 Å²	58	75.2 Å²	75.2	31%	0.31	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-61.5	143.6	173.9	-75.9	-28.9	0	0	0	112.1	V100 I110 E111	V100-D102 PolarHBondContact O-N 2.96Å; D102-I110 PolarHBondContact O-N 2.88Å; D102-E111 HydrophobicContact CB-CG 3.9Å; D102-E111 PolarHBondContact N-OE1 2.64Å
103	R	65.1	Low	71.7	Confident	170 Å²	170	68.8 Å²	68.8	64%	0.642	34%	0.343	S	S	*	.	B	Isolated β-bridge	trans	-124	145.1	-178.9	-59.1	-173.1	-178.5	-155.2	1.2	110.9	N108 I110	R103-N108 CarbonylContact C-O 3.45Å; R103-N108 VanDerWaalsContact CA-O 3.3Å; R103-N108 WeakPolarHBondContact CA-O 3.38Å; R103-I110 VanDerWaalsContact C-CD1 3.43Å
104	F	59.5	Low	71.5	Confident	31 Å²	31	68.1 Å²	68.1	14%	0.136	35%	0.345	C	S	.	.			trans	-59.8	158.8	169.9	-73.9	-60	0	0	0	109.6	D106 G107 N108 I110 F141	F104-D106 PolarHBondContact O-N 3.11Å; F104-G107 PolarHBondContact O-N 3.39Å; F104-N108 HydrophobicContact CD2-CB 4.04Å; F104-N108 PolarHBondContact N-O 3.09Å; F104-I110 HydrophobicContact CB-CD1 4.37Å; F104-I110 HydrophobicContact CB-CG1 4.27Å; F104-I110 HydrophobicContact CD1-CD1 3.48Å; F104-I110 VanDerWaalsContact CD1-CD1 3.48Å; F104-I110 HydrophobicContact CD1-CG1 3.68Å; F104-I110 HydrophobicContact CD2-CD1 4.32Å; F104-I110 HydrophobicContact CD2-CG1 3.58Å; F104-I110 HydrophobicContact CE1-CD1 3.64Å; F104-I110 HydrophobicContact CE1-CG1 3.73Å; F104-I110 HydrophobicContact CE1-CG2 4.09Å; F104-I110 HydrophobicContact CE2-CB 4.28Å; F104-I110 HydrophobicContact CE2-CG1 3.7Å; F104-I110 HydrophobicContact CE2-CG2 4.22Å; F104-I110 HydrophobicContact CG-CD1 3.82Å; F104-I110 HydrophobicContact CG-CG1 3.57Å; F104-I110 HydrophobicContact CZ-CB 4.28Å; F104-I110 HydrophobicContact CZ-CD1 4.21Å; F104-I110 HydrophobicContact CZ-CG1 3.78Å; F104-I110 HydrophobicContact CZ-CG2 3.78Å; F104-F141 AromaticContact CD1-CD1 3.8Å; F104-F141 HydrophobicContact CD1-CD1 3.8Å; F104-F141 AromaticContact CD1-CE1 3.42Å; F104-F141 HydrophobicContact CD1-CE1 3.42Å; F104-F141 VanDerWaalsContact CD1-CE1 3.42Å; F104-F141 AromaticContact CD1-CZ 3.92Å; F104-F141 HydrophobicContact CD1-CZ 3.92Å; F104-F141 AromaticContact CE1-CD1 3.24Å; F104-F141 HydrophobicContact CE1-CD1 3.24Å; F104-F141 AromaticContact CE1-CD2 3.8Å; F104-F141 HydrophobicContact CE1-CD2 3.8Å; F104-F141 AromaticContact CE1-CE1 3.09Å; F104-F141 HydrophobicContact CE1-CE1 3.09Å; F104-F141 AromaticContact CE1-CE2 3.66Å; F104-F141 HydrophobicContact CE1-CE2 3.66Å; F104-F141 AromaticContact CE1-CG 3.62Å; F104-F141 HydrophobicContact CE1-CG 3.62Å; F104-F141 AromaticContact CE1-CZ 3.33Å; F104-F141 HydrophobicContact CE1-CZ 3.33Å; F104-F141 AromaticContact CZ-CD1 3.85Å; F104-F141 HydrophobicContact CZ-CD1 3.85Å; F104-F141 HydrophobicContact CZ-CD2 4.1Å; F104-F141 HydrophobicContact CZ-CE1 4.13Å; F104-F141 HydrophobicContact CZ-CE2 4.35Å; F104-F141 AromaticContact CZ-CG 3.86Å; F104-F141 HydrophobicContact CZ-CG 3.86Å; F104-F141 HydrophobicContact CZ-CZ 4.38Å
105	K	58.4	Low	71.6	Confident	218 Å²	218	72.3 Å²	72.3	95%	0.948	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-22.4	172.7	-67.6	-177.3	179.6	177.2	0	112.6
106	D	56.3	Low	71.8	Confident	144 Å²	144	67.3 Å²	67.3	77%	0.77	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	2.6	177.9	-54.1	-35.8	0	0	0	114.2	F104	F104-D106 PolarHBondContact O-N 3.11Å
107	G	59.2	Low	72.3	Confident	42 Å²	42	69.1 Å²	69.1	43%	0.433	34%	0.342	S	S	.	.	S	Bend	trans	89	-7.9	175.9	0	0	0	0	0	116.1	F104	F104-G107 PolarHBondContact O-N 3.39Å
108	N	64.1	Low	73.1	Confident	113 Å²	113	68.2 Å²	68.2	60%	0.604	34%	0.337	S	S	*	.			trans	-73.4	137.6	174.7	-72.4	-18.9	0	0	0	111.5	R103 F104	R103-N108 CarbonylContact C-O 3.45Å; R103-N108 VanDerWaalsContact CA-O 3.3Å; R103-N108 WeakPolarHBondContact CA-O 3.38Å; F104-N108 HydrophobicContact CD2-CB 4.04Å; F104-N108 PolarHBondContact N-O 3.09Å
109	Q	67.7	Low	74.1	Confident	57 Å²	57	63.1 Å²	63.1	27%	0.266	31%	0.309	S	S	.	.	B	Isolated β-bridge	trans	-72.4	130.6	179.6	-177.4	169.3	-9.5	0	0	111.4	D101 E111 F112	D101-Q109 HydrophobicContact CB-CG 4.07Å; D101-Q109 PolarHBondContact OD2-NE2 2.98Å; Q109-E111 WeakPolarHBondContact CG-O 3.46Å; Q109-E111 PolarHBondContact NE2-O 2.84Å; Q109-F112 HydrophobicContact CB-CE1 4.13Å; Q109-F112 HydrophobicContact CB-CZ 4.24Å; Q109-F112 VanDerWaalsContact CD-CE1 3.47Å; Q109-F112 HydrophobicContact CG-CD1 4.1Å; Q109-F112 HydrophobicContact CG-CE1 3.75Å; Q109-F112 HydrophobicContact CG-CZ 4.1Å
110	I	75.8	Confident	75	Confident	3 Å²	3	57.9 Å²	57.9	2%	0.015	29%	0.289	C	S	.	.			trans	-95	-44.4	-175.6	-48.9	177.5	0	0	0	110.8	D102 R103 F104 W138 S139	D102-I110 PolarHBondContact O-N 2.88Å; R103-I110 VanDerWaalsContact C-CD1 3.43Å; F104-I110 HydrophobicContact CB-CD1 4.37Å; F104-I110 HydrophobicContact CB-CG1 4.27Å; F104-I110 HydrophobicContact CD1-CD1 3.48Å; F104-I110 VanDerWaalsContact CD1-CD1 3.48Å; F104-I110 HydrophobicContact CD1-CG1 3.68Å; F104-I110 HydrophobicContact CD2-CD1 4.32Å; F104-I110 HydrophobicContact CD2-CG1 3.58Å; F104-I110 HydrophobicContact CE1-CD1 3.64Å; F104-I110 HydrophobicContact CE1-CG1 3.73Å; F104-I110 HydrophobicContact CE1-CG2 4.09Å; F104-I110 HydrophobicContact CE2-CB 4.28Å; F104-I110 HydrophobicContact CE2-CG1 3.7Å; F104-I110 HydrophobicContact CE2-CG2 4.22Å; F104-I110 HydrophobicContact CG-CD1 3.82Å; F104-I110 HydrophobicContact CG-CG1 3.57Å; F104-I110 HydrophobicContact CZ-CB 4.28Å; F104-I110 HydrophobicContact CZ-CD1 4.21Å; F104-I110 HydrophobicContact CZ-CG1 3.78Å; F104-I110 HydrophobicContact CZ-CG2 3.78Å; I110-W138 HydrophobicContact CB-CZ3 4.42Å; I110-W138 HydrophobicContact CG2-CD2 4.32Å; I110-W138 HydrophobicContact CG2-CE3 3.92Å; I110-W138 HydrophobicContact CG2-CH2 3.21Å; I110-W138 HydrophobicContact CG2-CZ2 3.64Å; I110-W138 HydrophobicContact CG2-CZ3 3.37Å; I110-S139 PolarHBondContact O-N 2.85Å
111	E	77.4	Confident	76.1	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.019	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	147.2	-177.6	58.8	174	-164.6	0	0	110.9	D101 D102 Q109 K113 Y136 W138	D101-E111 VanDerWaalsContact CA-OE1 3.32Å; D101-E111 WeakPolarHBondContact CA-OE1 3.35Å; D101-E111 HydrophobicContact CB-CG 4.17Å; D101-E111 WeakPolarHBondContact CB-O 3.47Å; D102-E111 HydrophobicContact CB-CG 3.9Å; D102-E111 PolarHBondContact N-OE1 2.64Å; Q109-E111 WeakPolarHBondContact CG-O 3.46Å; Q109-E111 PolarHBondContact NE2-O 2.84Å; E111-K113 VanDerWaalsContact CD-NZ 3.31Å; E111-K113 WeakPolarHBondContact OE1-CE 3.01Å; E111-K113 IonicContact OE1-NZ 3.43Å; E111-K113 PolarHBondContact OE1-NZ 2.83Å; E111-K113 WeakPolarHBondContact OE2-CE 3.04Å; E111-K113 IonicContact OE2-NZ 2.64Å; E111-K113 PolarHBondContact OE2-NZ 3.24Å; E111-Y136 HydrophobicContact CB-CE2 3.89Å; E111-Y136 WeakPolarHBondContact CB-OH 3.45Å; E111-Y136 PolarHBondContact OE2-OH 2.92Å; E111-W138 HydrophobicContact CB-CE3 4.48Å
112	F	82.3	Confident	77.3	Confident	21 Å²	21	53.7 Å²	53.7	9%	0.092	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	101.8	173.1	-51.5	-94	0	0	0	109.5	Q109 Q137 R146	Q109-F112 HydrophobicContact CB-CE1 4.13Å; Q109-F112 HydrophobicContact CB-CZ 4.24Å; Q109-F112 VanDerWaalsContact CD-CE1 3.47Å; Q109-F112 HydrophobicContact CG-CD1 4.1Å; Q109-F112 HydrophobicContact CG-CE1 3.75Å; Q109-F112 HydrophobicContact CG-CZ 4.1Å; F112-Q137 HydrophobicContact CB-CB 4.15Å; F112-Q137 HydrophobicContact CD2-CB 4.13Å; F112-Q137 PolarHBondContact N-O 2.99Å; F112-R146 HydrophobicContact CD2-CG 4.33Å; F112-R146 VanDerWaalsContact CE1-CZ 3.47Å; F112-R146 VanDerWaalsContact CE1-NH2 3.34Å; F112-R146 HydrophobicContact CE2-CG 3.84Å; F112-R146 HydrophobicContact CZ-CG 4.27Å
113	K	82.3	Confident	78.6	Confident	6 Å²	6	54.8 Å²	54.8	3%	0.026	26%	0.264	C	S	.	.			trans	-86.2	-7.7	179.8	-66.2	172.9	168.1	160.9	0	113.5	V74 D97 D101 E111 K115 Q116 Y136	V74-K113 HydrophobicContact CG1-CB 3.84Å; D97-K113 WeakPolarHBondContact OD2-CE 3.31Å; D97-K113 IonicContact OD2-NZ 3.37Å; D97-K113 PolarHBondContact OD2-NZ 3.27Å; D101-K113 VanDerWaalsContact OD1-CB 3.31Å; D101-K113 WeakPolarHBondContact OD1-CB 3.04Å; D101-K113 WeakPolarHBondContact OD1-CG 3.48Å; D101-K113 PolarHBondContact OD1-N 2.88Å; E111-K113 VanDerWaalsContact CD-NZ 3.31Å; E111-K113 WeakPolarHBondContact OE1-CE 3.01Å; E111-K113 IonicContact OE1-NZ 3.43Å; E111-K113 PolarHBondContact OE1-NZ 2.83Å; E111-K113 WeakPolarHBondContact OE2-CE 3.04Å; E111-K113 IonicContact OE2-NZ 2.64Å; E111-K113 PolarHBondContact OE2-NZ 3.24Å; K113-K115 PolarHBondContact O-N 3.35Å; K113-Q116 WeakPolarHBondContact O-CG 3.44Å; K113-Y136 HydrophobicContact CG-CD2 4.4Å; K113-Y136 HydrophobicContact CG-CE2 4.15Å
114	S	84.4	Confident	79.7	Confident	46 Å²	46	47.3 Å²	47.3	32%	0.322	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	129.2	178.7	-65.6	0	0	0	0	110.4	V75 Q116	V75-S114 PolarHBondContact N-OG 2.81Å; V75-S114 WeakPolarHBondContact O-CA 3.38Å; S114-Q116 PolarHBondContact O-N 3.32Å
115	K	87.7	Confident	80.9	Confident	122 Å²	122	48.1 Å²	48.1	53%	0.53	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	27.4	-177.5	-55.4	-176.4	173.7	-176.7	0	114.6	V75 E76 K113 W117	V75-K115 PolarHBondContact O-N 2.86Å; V75-K115 VanDerWaalsContact O-N 3.09Å; E76-K115 HydrophobicContact CB-CG 4.17Å; E76-K115 WeakPolarHBondContact O-CA 3.46Å; E76-K115 PolarHBondContact O-N 2.85Å; K113-K115 PolarHBondContact O-N 3.35Å; K115-W117 PolarHBondContact O-N 3.27Å
116	Q	87.3	Confident	81.8	Confident	3 Å²	3	38.4 Å²	38.4	1%	0.014	21%	0.206	C	C	.	.			trans	-71.8	-9.2	179.6	68.4	-178.9	-7.8	0	0	114.3	R77 K113 S114 F118 A133 L135	R77-Q116 VanDerWaalsContact CG-NE2 3.29Å; R77-Q116 VanDerWaalsContact O-CG 3.25Å; R77-Q116 WeakPolarHBondContact O-CG 3.42Å; R77-Q116 PolarHBondContact O-NE2 2.8Å; K113-Q116 WeakPolarHBondContact O-CG 3.44Å; S114-Q116 PolarHBondContact O-N 3.32Å; Q116-F118 HydrophobicContact CG-CB 4.17Å; Q116-A133 HydrophobicContact CB-CB 4.12Å; Q116-A133 HydrophobicContact CG-CB 3.88Å; Q116-A133 CarbonylContact O-C 3.45Å; Q116-A133 WeakPolarHBondContact O-CA 3.33Å; Q116-A133 WeakPolarHBondContact O-CB 3.38Å; Q116-L135 PolarHBondContact O-N 3.01Å; Q116-L135 VanDerWaalsContact O-N 3.07Å
117	W	92.3	Very high	83.1	Confident	57 Å²	57	36.6 Å²	36.6	22%	0.216	19%	0.193	C	C	.	.			trans	61.3	46.1	-178.3	-81.3	43.7	0	0	0	113.5	Y41 F44 P64 K115 G119 A120 P134 L135	Y41-W117 HydrophobicContact CE2-CH2 4.43Å; Y41-W117 HydrophobicContact CE2-CZ2 4.43Å; F44-W117 HydrophobicContact CE1-CZ3 4.4Å; F44-W117 AromaticContact CE2-CZ3 3.92Å; F44-W117 HydrophobicContact CE2-CZ3 3.92Å; F44-W117 HydrophobicContact CZ-CE3 4.48Å; F44-W117 AromaticContact CZ-CZ3 3.79Å; F44-W117 HydrophobicContact CZ-CZ3 3.79Å; P64-W117 HydrophobicContact CB-CB 4Å; P64-W117 HydrophobicContact CB-CD2 4.09Å; P64-W117 HydrophobicContact CB-CE3 4.11Å; P64-W117 HydrophobicContact CB-CG 4.05Å; P64-W117 HydrophobicContact CG-CE3 4.36Å; P64-W117 WeakPolarHBondContact O-CA 3.2Å; K115-W117 PolarHBondContact O-N 3.27Å; W117-G119 PolarHBondContact O-N 2.79Å; W117-A120 HydrophobicContact CB-CB 4.27Å; W117-A120 HydrophobicContact CE3-CB 4.15Å; W117-A120 VanDerWaalsContact O-CB 3.29Å; W117-A120 WeakPolarHBondContact O-CB 3.5Å; W117-A120 PolarHBondContact O-N 3.44Å; W117-P134 WeakPolarHBondContact O-CD 3.45Å; W117-L135 HydrophobicContact CB-CD1 4.32Å; W117-L135 HydrophobicContact CD2-CD1 4.06Å; W117-L135 HydrophobicContact CG-CD1 3.78Å; W117-L135 HydrophobicContact CG-CG 4.49Å
118	F	91.9	Very high	84.4	Confident	12 Å²	12	34.9 Å²	34.9	5%	0.053	17%	0.173	C	C	.	.	B	Isolated β-bridge	trans	-67.6	126	176.3	178.7	-113.1	0	0	0	111.5	P64 R77 G78 A79 V80 F96 Q116 A131 C132 A133 Y153	P64-F118 WeakPolarHBondContact CA-O 3.4Å; R77-F118 WeakPolarHBondContact O-CB 3.34Å; R77-F118 PolarHBondContact O-N 3.28Å; G78-F118 CarbonylContact C-O 3.57Å; G78-F118 VanDerWaalsContact CA-O 3.24Å; G78-F118 WeakPolarHBondContact CA-O 3.27Å; A79-F118 PolarHBondContact N-O 2.81Å; A79-F118 VanDerWaalsContact N-O 3.15Å; V80-F118 HydrophobicContact CG2-CE1 4.15Å; V80-F118 HydrophobicContact CG2-CZ 4.27Å; F96-F118 HydrophobicContact CB-CE1 4.27Å; F96-F118 HydrophobicContact CB-CZ 3.88Å; F96-F118 HydrophobicContact CD1-CZ 4.18Å; F96-F118 AromaticContact CD2-CE1 3.83Å; F96-F118 HydrophobicContact CD2-CE1 3.83Å; F96-F118 AromaticContact CD2-CZ 3.57Å; F96-F118 HydrophobicContact CD2-CZ 3.57Å; F96-F118 HydrophobicContact CE2-CE1 4.45Å; F96-F118 HydrophobicContact CE2-CZ 4.08Å; F96-F118 HydrophobicContact CG-CE1 4.2Å; F96-F118 AromaticContact CG-CZ 3.63Å; F96-F118 HydrophobicContact CG-CZ 3.63Å; Q116-F118 HydrophobicContact CG-CB 4.17Å; F118-A131 HydrophobicContact CE2-CB 3.58Å; F118-A131 HydrophobicContact CZ-CB 3.67Å; F118-C132 WeakPolarHBondContact CA-O 3.25Å; F118-A133 HydrophobicContact CB-CB 4Å; F118-A133 HydrophobicContact CD2-CB 4.18Å; F118-Y153 AromaticContact CD2-CD2 3.9Å; F118-Y153 HydrophobicContact CD2-CD2 3.9Å; F118-Y153 HydrophobicContact CD2-CE2 4.27Å; F118-Y153 AromaticContact CE2-CD2 3.48Å; F118-Y153 HydrophobicContact CE2-CD2 3.48Å; F118-Y153 VanDerWaalsContact CE2-CD2 3.48Å; F118-Y153 HydrophobicContact CE2-CE2 4.25Å; F118-Y153 HydrophobicContact CE2-CG 4.27Å; F118-Y153 HydrophobicContact CZ-CD2 4.26Å
119	G	90.2	Very high	85.7	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.8	18.5	-172.1	0	0	0	0	0	113.3	S45 G62 W117 S121 C132	S45-G119 PolarHBondContact OG-O 3.09Å; S45-G119 VanDerWaalsContact OG-O 3.12Å; G62-G119 VanDerWaalsContact CA-O 3.3Å; G62-G119 WeakPolarHBondContact CA-O 3.27Å; W117-G119 PolarHBondContact O-N 2.79Å; G119-S121 VanDerWaalsContact C-N 3.34Å; G119-C132 PolarHBondContact N-O 3Å
120	A	91.7	Very high	86.9	Confident	11 Å²	11	27.3 Å²	27.3	9%	0.091	13%	0.134	C	C	.	.	S	Bend	trans	-71.1	-31	168.4	0	0	0	0	0	112.3	F44 S45 P64 W117 P134	F44-A120 HydrophobicContact CD1-CB 4.22Å; F44-A120 WeakPolarHBondContact CD1-O 3.39Å; F44-A120 HydrophobicContact CE1-CB 3.95Å; F44-A120 VanDerWaalsContact CE1-O 3.24Å; F44-A120 WeakPolarHBondContact CE1-O 3.44Å; S45-A120 WeakPolarHBondContact CB-O 3.17Å; P64-A120 HydrophobicContact CB-CB 4.27Å; W117-A120 HydrophobicContact CB-CB 4.27Å; W117-A120 HydrophobicContact CE3-CB 4.15Å; W117-A120 VanDerWaalsContact O-CB 3.29Å; W117-A120 WeakPolarHBondContact O-CB 3.5Å; W117-A120 PolarHBondContact O-N 3.44Å; A120-P134 HydrophobicContact CB-CG 3.97Å
121	S	92	Very high	87.7	Confident	9 Å²	9	27.1 Å²	27.1	6%	0.063	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	134.6	169	64.4	0	0	0	0	108.7	G119 A131 C132 G182	G119-S121 VanDerWaalsContact C-N 3.34Å; S121-A131 WeakPolarHBondContact O-CA 3.18Å; S121-C132 PolarHBondContact O-N 2.9Å; S121-C132 VanDerWaalsContact OG-CB 3.31Å; S121-C132 WeakPolarHBondContact OG-CB 3.5Å; S121-G182 PolarHBondContact OG-O 2.92Å
122	V	92.8	Very high	88.5	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	128.7	179.6	178.6	0	0	0	0	107.8	S45 L60 V80 L130 A131	S45-V122 WeakPolarHBondContact OG-CG2 3.27Å; L60-V122 HydrophobicContact CB-CG1 4Å; L60-V122 HydrophobicContact CD1-CG1 4.13Å; V80-V122 HydrophobicContact CG1-CG1 4.18Å; V80-V122 HydrophobicContact CG1-CG2 4.1Å; V80-V122 HydrophobicContact CG2-CG2 3.7Å; V122-L130 WeakPolarHBondContact CA-O 3.42Å; V122-A131 HydrophobicContact CG2-CB 4.36Å
123	R	91.5	Very high	89	Confident	81 Å²	81	26 Å²	26	31%	0.306	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	149.9	175.9	-70.2	-67.7	178	-102.2	8.4	111.5	D47 L130 A185 F187	D47-R123 VanDerWaalsContact OD2-CA 3.24Å; D47-R123 WeakPolarHBondContact OD2-CA 3.33Å; R123-L130 PolarHBondContact N-O 2.82Å; R123-L130 PolarHBondContact O-N 3.35Å; R123-A185 VanDerWaalsContact CG-O 3.27Å; R123-A185 WeakPolarHBondContact CG-O 3.17Å; R123-A185 PolarHBondContact NE-O 2.99Å; R123-F187 HydrophobicContact CB-CD2 3.84Å; R123-F187 HydrophobicContact CB-CE2 3.91Å
124	S	89.6	Confident	89.4	Confident	13 Å²	13	26 Å²	26	9%	0.091	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	138	178.4	154.1	0	0	0	0	111.4	D47 F48 G126 H128	D47-S124 PolarHBondContact OD2-N 2.83Å; F48-S124 WeakPolarHBondContact O-CB 3.41Å; F48-S124 PolarHBondContact O-OG 2.82Å; F48-S124 VanDerWaalsContact O-OG 3.07Å; S124-G126 PolarHBondContact OG-N 3.18Å; S124-H128 WeakPolarHBondContact CA-O 3.08Å
125	D	84.7	Confident	89.8	Confident	49 Å²	49	26.7 Å²	26.7	26%	0.262	13%	0.129	S	C	.	.			trans	-100.2	1.2	170.8	70.3	5	0	0	0	112.8	E127 H128 F187	D125-E127 PolarHBondContact OD1-N 3.36Å; D125-H128 PolarHBondContact N-O 2.94Å; D125-H128 WeakPolarHBondContact OD1-CB 3.49Å; D125-H128 IonicContact OD1-CG 3.4Å; D125-H128 PolarHBondContact OD1-N 2.98Å; D125-H128 IonicContact OD1-ND1 3.9Å; D125-H128 PolarHBondContact OD1-ND1 3.16Å; D125-H128 IonicContact OD2-CE1 2.88Å; D125-H128 IonicContact OD2-CG 3.68Å; D125-H128 IonicContact OD2-ND1 3.72Å; D125-H128 PolarHBondContact OD2-ND1 3.12Å; D125-F187 HydrophobicContact CB-CB 4.4Å; D125-F187 HydrophobicContact CB-CD1 4.29Å; D125-F187 HydrophobicContact CB-CD2 4.33Å; D125-F187 HydrophobicContact CB-CG 4.11Å
126	G	77.7	Confident	89.8	Confident	14 Å²	14	20.9 Å²	20.9	14%	0.144	10%	0.104	C	C	.	.	S	Bend	trans	103.5	-31.8	-176.8	0	0	0	0	0	114.2	F49 K50 S124	F49-G126 WeakPolarHBondContact CE2-O 3.35Å; K50-G126 CarbonylContact O-C 3.59Å; K50-G126 WeakPolarHBondContact O-CA 3.41Å; K50-G126 VanDerWaalsContact O-O 3.1Å; S124-G126 PolarHBondContact OG-N 3.18Å
127	E	81.9	Confident	89.9	Confident	106 Å²	106	23.8 Å²	23.8	50%	0.495	12%	0.117	S	C	.	.	S	Bend	trans	-106.2	-35	176.8	-167.8	-176.5	178.9	0	0	111.9	D125 K156	D125-E127 PolarHBondContact OD1-N 3.36Å; E127-K156 WeakPolarHBondContact OE1-CE 3.43Å; E127-K156 IonicContact OE1-NZ 3.56Å; E127-K156 PolarHBondContact OE1-NZ 2.93Å; E127-K156 IonicContact OE2-NZ 3.67Å; E127-K156 PolarHBondContact OE2-NZ 2.85Å
128	H	88	Confident	89.4	Confident	5 Å²	5	21.4 Å²	21.4	2%	0.023	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	142.7	-177	-46.4	97.1	0	0	0	110.4	S124 D125 L154 K155 K156 F187	S124-H128 WeakPolarHBondContact CA-O 3.08Å; D125-H128 PolarHBondContact N-O 2.94Å; D125-H128 WeakPolarHBondContact OD1-CB 3.49Å; D125-H128 IonicContact OD1-CG 3.4Å; D125-H128 PolarHBondContact OD1-N 2.98Å; D125-H128 IonicContact OD1-ND1 3.9Å; D125-H128 PolarHBondContact OD1-ND1 3.16Å; D125-H128 IonicContact OD2-CE1 2.88Å; D125-H128 IonicContact OD2-CG 3.68Å; D125-H128 IonicContact OD2-ND1 3.72Å; D125-H128 PolarHBondContact OD2-ND1 3.12Å; H128-L154 HydrophobicContact CB-CD1 4.02Å; H128-K155 WeakPolarHBondContact CA-O 3.45Å; H128-K156 PolarHBondContact NE2-NZ 2.72Å; H128-F187 HydrophobicContact CB-CE1 4.4Å; H128-F187 HydrophobicContact CB-CZ 4.17Å
129	I	90.7	Very high	88.8	Confident	9 Å²	9	21.5 Å²	21.5	5%	0.046	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	123.7	172.8	-55.7	173.4	0	0	0	108	F49 L60 L94 F96 L154 K155	F49-I129 HydrophobicContact CD2-CD1 3.86Å; F49-I129 HydrophobicContact CD2-CG1 3.79Å; F49-I129 HydrophobicContact CE2-CD1 3.77Å; F49-I129 HydrophobicContact CE2-CG1 3.74Å; F49-I129 HydrophobicContact CG-CD1 4.36Å; F49-I129 HydrophobicContact CZ-CD1 4.2Å; L60-I129 HydrophobicContact CD1-CD1 4.02Å; L60-I129 HydrophobicContact CD1-CG1 4.02Å; L60-I129 HydrophobicContact CD1-CG2 3.81Å; L60-I129 HydrophobicContact CD2-CD1 4.16Å; L94-I129 HydrophobicContact CD1-CD1 3.94Å; F96-I129 HydrophobicContact CZ-CG2 4.01Å; I129-L154 WeakPolarHBondContact O-CA 3.36Å; I129-K155 HydrophobicContact CB-CB 4.45Å; I129-K155 PolarHBondContact N-O 2.78Å; I129-K155 PolarHBondContact O-N 2.63Å
130	L	92	Very high	87.7	Confident	2 Å²	2	22.3 Å²	22.3	1%	0.01	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	125.7	173.3	-176.6	72.4	0	0	0	109.1	V122 R123 C152 L154 A185 F187 V194	V122-L130 WeakPolarHBondContact CA-O 3.42Å; R123-L130 PolarHBondContact N-O 2.82Å; R123-L130 PolarHBondContact O-N 3.35Å; L130-C152 HydrophobicContact CD1-CB 3.89Å; L130-L154 HydrophobicContact CB-CD1 4.24Å; L130-L154 HydrophobicContact CD1-CB 4.25Å; L130-L154 HydrophobicContact CD1-CD1 4.18Å; L130-A185 HydrophobicContact CD2-CB 3.74Å; L130-F187 HydrophobicContact CB-CE2 3.74Å; L130-F187 HydrophobicContact CB-CZ 3.73Å; L130-V194 HydrophobicContact CD2-CG1 3.43Å; L130-V194 VanDerWaalsContact CD2-CG1 3.43Å
131	A	93.9	Very high	86.1	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	133.4	174.8	0	0	0	0	0	110	V80 F96 F118 S121 V122 C152 Y153	V80-A131 HydrophobicContact CG2-CB 3.74Å; F96-A131 HydrophobicContact CE1-CB 4.33Å; F96-A131 HydrophobicContact CZ-CB 4.12Å; F118-A131 HydrophobicContact CE2-CB 3.58Å; F118-A131 HydrophobicContact CZ-CB 3.67Å; S121-A131 WeakPolarHBondContact O-CA 3.18Å; V122-A131 HydrophobicContact CG2-CB 4.36Å; A131-C152 CarbonylContact O-C 3.59Å; A131-C152 WeakPolarHBondContact O-CA 3.49Å; A131-Y153 PolarHBondContact N-O 2.88Å; A131-Y153 PolarHBondContact O-N 2.89Å
132	C	93.4	Very high	84.3	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	158.1	-176	-52.8	0	0	0	0	114.4	F118 G119 S121 T151 C152 G182	F118-C132 WeakPolarHBondContact CA-O 3.25Å; G119-C132 PolarHBondContact N-O 3Å; S121-C132 PolarHBondContact O-N 2.9Å; S121-C132 VanDerWaalsContact OG-CB 3.31Å; S121-C132 WeakPolarHBondContact OG-CB 3.5Å; C132-T151 CarbonylContact C-O 3.6Å; C132-T151 WeakPolarHBondContact CA-O 3.37Å; C132-C152 HydrophobicContact CB-CB 3.98Å; C132-C152 WeakPolarHBondContact CB-SG 3.12Å; C132-C152 WeakPolarHBondContact SG-CB 3.49Å; C132-C152 CovalentContact SG-SG 2.04Å; C132-C152 PolarHBondContact SG-SG 2.95Å; C132-G182 WeakPolarHBondContact CB-O 3.48Å
133	A	93.3	Very high	82.5	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	87	176.4	0	0	0	0	0	109.3	Q116 F118 L135 Y136 G150 T151	Q116-A133 HydrophobicContact CB-CB 4.12Å; Q116-A133 HydrophobicContact CG-CB 3.88Å; Q116-A133 CarbonylContact O-C 3.45Å; Q116-A133 WeakPolarHBondContact O-CA 3.33Å; Q116-A133 WeakPolarHBondContact O-CB 3.38Å; F118-A133 HydrophobicContact CB-CB 4Å; F118-A133 HydrophobicContact CD2-CB 4.18Å; A133-L135 VanDerWaalsContact C-N 3.26Å; A133-L135 PolarHBondContact O-N 3.31Å; A133-Y136 VanDerWaalsContact O-CB 3.31Å; A133-Y136 WeakPolarHBondContact O-CB 3.17Å; A133-Y136 PolarHBondContact O-N 3.01Å; A133-G150 WeakPolarHBondContact O-CA 3.39Å; A133-T151 HydrophobicContact CB-CG2 4.06Å; A133-T151 PolarHBondContact N-O 3.24Å; A133-T151 PolarHBondContact O-N 2.68Å; A133-T151 VanDerWaalsContact O-N 3.14Å
134	P	91.6	Very high	80.8	Confident	7 Å²	7	41 Å²	41	5%	0.045	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-20.6	-172.6	-18.2	30.9	0	0	0	114.3	W117 A120 Q180 F183	W117-P134 WeakPolarHBondContact O-CD 3.45Å; A120-P134 HydrophobicContact CB-CG 3.97Å; P134-Q180 WeakPolarHBondContact O-CA 3.46Å; P134-Q180 WeakPolarHBondContact O-CB 3.41Å; P134-F183 HydrophobicContact CB-CB 4.38Å; P134-F183 HydrophobicContact CB-CD2 4.37Å
135	L	91.1	Very high	79.7	Confident	61 Å²	61	45.5 Å²	45.5	32%	0.319	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	12.6	179.8	-66.2	177.2	0	0	0	112.6	Q116 W117 A133 Q137 Q180	Q116-L135 PolarHBondContact O-N 3.01Å; Q116-L135 VanDerWaalsContact O-N 3.07Å; W117-L135 HydrophobicContact CB-CD1 4.32Å; W117-L135 HydrophobicContact CD2-CD1 4.06Å; W117-L135 HydrophobicContact CG-CD1 3.78Å; W117-L135 HydrophobicContact CG-CG 4.49Å; A133-L135 VanDerWaalsContact C-N 3.26Å; A133-L135 PolarHBondContact O-N 3.31Å; L135-Q137 WeakPolarHBondContact O-CG 3.36Å; L135-Q137 PolarHBondContact O-N 2.98Å; L135-Q180 VanDerWaalsContact CD2-NE2 3.31Å
136	Y	89.4	Confident	79.4	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.268	C	S	.	.			trans	-59.3	127	172.3	170.9	-102.2	0	0	0	110.7	E111 K113 A133 W138 P148 V149 G150 T151	E111-Y136 HydrophobicContact CB-CE2 3.89Å; E111-Y136 WeakPolarHBondContact CB-OH 3.45Å; E111-Y136 PolarHBondContact OE2-OH 2.92Å; K113-Y136 HydrophobicContact CG-CD2 4.4Å; K113-Y136 HydrophobicContact CG-CE2 4.15Å; A133-Y136 VanDerWaalsContact O-CB 3.31Å; A133-Y136 WeakPolarHBondContact O-CB 3.17Å; A133-Y136 PolarHBondContact O-N 3.01Å; Y136-W138 HydrophobicContact CE1-CB 4.48Å; Y136-P148 CarbonylContact O-C 3.58Å; Y136-P148 WeakPolarHBondContact O-CA 3.47Å; Y136-V149 HydrophobicContact CD1-CG2 3.85Å; Y136-V149 HydrophobicContact CE1-CG2 4Å; Y136-V149 PolarHBondContact O-N 2.64Å; Y136-G150 PolarHBondContact O-N 3.24Å; Y136-T151 HydrophobicContact CD1-CG2 3.81Å; Y136-T151 HydrophobicContact CD2-CG2 3.97Å; Y136-T151 HydrophobicContact CE1-CG2 4.37Å; Y136-T151 HydrophobicContact CG-CG2 3.57Å
137	Q	87.9	Confident	79.7	Confident	63 Å²	63	50 Å²	50	29%	0.294	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	140.6	-176.6	-54.1	175.7	-15	0	0	111.3	F112 L135 E147	F112-Q137 HydrophobicContact CB-CB 4.15Å; F112-Q137 HydrophobicContact CD2-CB 4.13Å; F112-Q137 PolarHBondContact N-O 2.99Å; L135-Q137 WeakPolarHBondContact O-CG 3.36Å; L135-Q137 PolarHBondContact O-N 2.98Å; Q137-E147 CarbonylContact C-O 3.49Å; Q137-E147 VanDerWaalsContact CA-O 3.27Å; Q137-E147 WeakPolarHBondContact CA-O 3.34Å
138	W	82.9	Confident	80	Confident	8 Å²	8	45.9 Å²	45.9	3%	0.03	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	144.8	179.3	178.2	-100.7	0	0	0	110.6	I110 E111 Y136 E147 V149 R167 Y224	I110-W138 HydrophobicContact CB-CZ3 4.42Å; I110-W138 HydrophobicContact CG2-CD2 4.32Å; I110-W138 HydrophobicContact CG2-CE3 3.92Å; I110-W138 HydrophobicContact CG2-CH2 3.21Å; I110-W138 HydrophobicContact CG2-CZ2 3.64Å; I110-W138 HydrophobicContact CG2-CZ3 3.37Å; E111-W138 HydrophobicContact CB-CE3 4.48Å; Y136-W138 HydrophobicContact CE1-CB 4.48Å; W138-E147 PolarHBondContact N-O 3.06Å; W138-E147 PolarHBondContact O-N 2.87Å; W138-V149 HydrophobicContact CB-CG1 4.19Å; W138-V149 HydrophobicContact CB-CG2 3.61Å; W138-V149 HydrophobicContact CG-CG2 4.48Å; W138-R167 HydrophobicContact CD2-CG 4.31Å; W138-R167 HydrophobicContact CG-CG 4.47Å; W138-Y224 AromaticContact CH2-CD1 3.55Å; W138-Y224 HydrophobicContact CH2-CD1 3.55Å; W138-Y224 HydrophobicContact CH2-CD2 4.28Å; W138-Y224 HydrophobicContact CH2-CE1 4.18Å; W138-Y224 AromaticContact CH2-CG 3.6Å; W138-Y224 HydrophobicContact CH2-CG 3.6Å; W138-Y224 HydrophobicContact CZ2-CG 4.42Å; W138-Y224 AromaticContact CZ3-CD1 3.91Å; W138-Y224 HydrophobicContact CZ3-CD1 3.91Å; W138-Y224 HydrophobicContact CZ3-CE1 4.4Å; W138-Y224 HydrophobicContact CZ3-CG 4.4Å
139	S	78.6	Confident	80.1	Confident	13 Å²	13	45.7 Å²	45.7	9%	0.091	24%	0.244	C	C	.	.			trans	-113.3	124	171.9	-167.2	0	0	0	0	110.7	I110 F143 E145	I110-S139 PolarHBondContact O-N 2.85Å; S139-F143 PolarHBondContact OG-O 2.94Å; S139-E145 WeakPolarHBondContact CA-O 3.49Å; S139-E145 PolarHBondContact OG-O 2.04Å
140	T	67.5	Low	80.1	Confident	17 Å²	17	45.2 Å²	45.2	10%	0.104	24%	0.242	C	C	.	.			trans	-79.5	140.2	-177.5	-55.1	0	0	0	0	111.4	G142 F143 E147 H171	T140-G142 PolarHBondContact O-N 2.7Å; T140-F143 PolarHBondContact O-N 3.4Å; T140-E147 PolarHBondContact OG1-OE1 3.08Å; T140-E147 PolarHBondContact OG1-OE2 3.34Å; T140-H171 HydrophobicContact CG2-CB 4.06Å; T140-H171 WeakPolarHBondContact CG2-CD2 3.06Å; T140-H171 VanDerWaalsContact CG2-CG 3.41Å; T140-H171 WeakPolarHBondContact CG2-NE2 3.47Å; T140-H171 PolarHBondContact OG1-ND1 2.76Å; T140-H171 VanDerWaalsContact OG1-ND1 3.08Å
141	F	57.3	Low	80	Confident	144 Å²	144	45.1 Å²	45.1	63%	0.632	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.4	113.9	179.2	-78.7	-93.8	0	0	0	111.8	F104	F104-F141 AromaticContact CD1-CD1 3.8Å; F104-F141 HydrophobicContact CD1-CD1 3.8Å; F104-F141 AromaticContact CD1-CE1 3.42Å; F104-F141 HydrophobicContact CD1-CE1 3.42Å; F104-F141 VanDerWaalsContact CD1-CE1 3.42Å; F104-F141 AromaticContact CD1-CZ 3.92Å; F104-F141 HydrophobicContact CD1-CZ 3.92Å; F104-F141 AromaticContact CE1-CD1 3.24Å; F104-F141 HydrophobicContact CE1-CD1 3.24Å; F104-F141 AromaticContact CE1-CD2 3.8Å; F104-F141 HydrophobicContact CE1-CD2 3.8Å; F104-F141 AromaticContact CE1-CE1 3.09Å; F104-F141 HydrophobicContact CE1-CE1 3.09Å; F104-F141 AromaticContact CE1-CE2 3.66Å; F104-F141 HydrophobicContact CE1-CE2 3.66Å; F104-F141 AromaticContact CE1-CG 3.62Å; F104-F141 HydrophobicContact CE1-CG 3.62Å; F104-F141 AromaticContact CE1-CZ 3.33Å; F104-F141 HydrophobicContact CE1-CZ 3.33Å; F104-F141 AromaticContact CZ-CD1 3.85Å; F104-F141 HydrophobicContact CZ-CD1 3.85Å; F104-F141 HydrophobicContact CZ-CD2 4.1Å; F104-F141 HydrophobicContact CZ-CE1 4.13Å; F104-F141 HydrophobicContact CZ-CE2 4.35Å; F104-F141 AromaticContact CZ-CG 3.86Å; F104-F141 HydrophobicContact CZ-CG 3.86Å; F104-F141 HydrophobicContact CZ-CZ 4.38Å
142	G	54.2	Low	79.9	Confident	79 Å²	79	45.1 Å²	45.1	81%	0.814	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	100	-8.3	171.7	0	0	0	0	0	116.7	T140	T140-G142 PolarHBondContact O-N 2.7Å
143	F	55.2	Low	79.8	Confident	150 Å²	150	45.8 Å²	45.8	66%	0.658	24%	0.244	S	C	*	.	S	Bend	trans	-125.8	140.6	175.9	-70	-85.8	0	0	0	111	S139 T140 E145	S139-F143 PolarHBondContact OG-O 2.94Å; T140-F143 PolarHBondContact O-N 3.4Å; F143-E145 PolarHBondContact O-N 2.87Å; F143-E145 VanDerWaalsContact O-N 3.08Å
144	S	56.4	Low	79.7	Confident	121 Å²	121	45.9 Å²	45.9	85%	0.846	24%	0.244	S	C	*	.			trans	-82.4	33	178.5	83.7	0	0	0	0	112.9
145	E	65.8	Low	79.6	Confident	107 Å²	107	47 Å²	47	50%	0.5	25%	0.248	S	C	.	.			trans	-88.3	142.6	179.1	-65.1	-166.3	176.5	0	0	110.1	S139 F143	S139-E145 WeakPolarHBondContact CA-O 3.49Å; S139-E145 PolarHBondContact OG-O 2.04Å; F143-E145 PolarHBondContact O-N 2.87Å; F143-E145 VanDerWaalsContact O-N 3.08Å
146	R	79.7	Confident	79.4	Confident	152 Å²	152	47 Å²	47	57%	0.574	25%	0.246	S	C	*	.			trans	-111.9	104.5	176.6	-67.9	-171.6	-177.8	-174	-0.3	108	F112	F112-R146 HydrophobicContact CD2-CG 4.33Å; F112-R146 VanDerWaalsContact CE1-CZ 3.47Å; F112-R146 VanDerWaalsContact CE1-NH2 3.34Å; F112-R146 HydrophobicContact CE2-CG 3.84Å; F112-R146 HydrophobicContact CZ-CG 4.27Å
147	E	83.5	Confident	79	Confident	6 Å²	6	49.6 Å²	49.6	3%	0.028	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-105.4	123.2	-172.2	-72.2	165	-144.1	0	0	109.8	Q137 W138 T140 V149 H171 G177	Q137-E147 CarbonylContact C-O 3.49Å; Q137-E147 VanDerWaalsContact CA-O 3.27Å; Q137-E147 WeakPolarHBondContact CA-O 3.34Å; W138-E147 PolarHBondContact N-O 3.06Å; W138-E147 PolarHBondContact O-N 2.87Å; T140-E147 PolarHBondContact OG1-OE1 3.08Å; T140-E147 PolarHBondContact OG1-OE2 3.34Å; E147-V149 VanDerWaalsContact C-N 3.28Å; E147-V149 HydrophobicContact CB-CG1 4.25Å; E147-V149 PolarHBondContact O-N 2.81Å; E147-H171 WeakPolarHBondContact OE2-CB 3.08Å; E147-H171 IonicContact OE2-ND1 3.47Å; E147-H171 VanDerWaalsContact OE2-O 3.06Å; E147-G177 CarbonylContact C-O 3.55Å; E147-G177 WeakPolarHBondContact CB-O 3.23Å
148	P	88.6	Confident	78.7	Confident	19 Å²	19	54.3 Å²	54.3	12%	0.123	30%	0.3	C	S	.	.			trans	-80.3	73.7	178.5	34.1	-34.4	0	0	0	111.1	Y136 G150 G177 F178 Q180	Y136-P148 CarbonylContact O-C 3.58Å; Y136-P148 WeakPolarHBondContact O-CA 3.47Å; P148-G150 VanDerWaalsContact C-N 3.33Å; P148-G150 PolarHBondContact O-N 2.88Å; P148-G177 CarbonylContact C-O 3.58Å; P148-F178 HydrophobicContact CG-CD1 3.61Å; P148-F178 HydrophobicContact CG-CE1 4.12Å; P148-F178 HydrophobicContact CG-CG 4.32Å; P148-Q180 HydrophobicContact CB-CG 4.26Å; P148-Q180 HydrophobicContact CG-CG 4.43Å; P148-Q180 WeakPolarHBondContact O-CA 3.02Å; P148-Q180 WeakPolarHBondContact O-CG 3.48Å; P148-Q180 PolarHBondContact O-N 3.49Å
149	V	88.3	Confident	78.8	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.006	33%	0.325	C	S	.	.			trans	-69	-30.3	-178.6	-64	0	0	0	0	112.9	Y136 W138 E147 G177 Q180 A181	Y136-V149 HydrophobicContact CD1-CG2 3.85Å; Y136-V149 HydrophobicContact CE1-CG2 4Å; Y136-V149 PolarHBondContact O-N 2.64Å; W138-V149 HydrophobicContact CB-CG1 4.19Å; W138-V149 HydrophobicContact CB-CG2 3.61Å; W138-V149 HydrophobicContact CG-CG2 4.48Å; E147-V149 VanDerWaalsContact C-N 3.28Å; E147-V149 HydrophobicContact CB-CG1 4.25Å; E147-V149 PolarHBondContact O-N 2.81Å; V149-G177 WeakPolarHBondContact CG1-O 3.46Å; V149-G177 PolarHBondContact N-O 3.33Å; V149-Q180 PolarHBondContact O-N 3.19Å; V149-A181 PolarHBondContact O-N 2.76Å
150	G	90.9	Very high	79.2	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.332	C	S	.	.			trans	77.6	151.2	-173.2	0	0	0	0	0	113.7	A133 Y136 P148 S164	A133-G150 WeakPolarHBondContact O-CA 3.39Å; Y136-G150 PolarHBondContact O-N 3.24Å; P148-G150 VanDerWaalsContact C-N 3.33Å; P148-G150 PolarHBondContact O-N 2.88Å; G150-S164 PolarHBondContact O-OG 3.2Å
151	T	91.3	Very high	80.2	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	152.6	177	-167.9	0	0	0	0	111	C132 A133 Y136 Y153 E162	C132-T151 CarbonylContact C-O 3.6Å; C132-T151 WeakPolarHBondContact CA-O 3.37Å; A133-T151 HydrophobicContact CB-CG2 4.06Å; A133-T151 PolarHBondContact N-O 3.24Å; A133-T151 PolarHBondContact O-N 2.68Å; A133-T151 VanDerWaalsContact O-N 3.14Å; Y136-T151 HydrophobicContact CD1-CG2 3.81Å; Y136-T151 HydrophobicContact CD2-CG2 3.97Å; Y136-T151 HydrophobicContact CE1-CG2 4.37Å; Y136-T151 HydrophobicContact CG-CG2 3.57Å; T151-Y153 HydrophobicContact CG2-CE2 3.92Å; T151-E162 WeakPolarHBondContact OG1-CG 3.4Å; T151-E162 PolarHBondContact OG1-OE1 3.04Å
152	C	91.9	Very high	81.6	Confident	0 Å²	0	54 Å²	54	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	152	173.9	-62.8	0	0	0	0	110.6	L130 A131 C132 Y163	L130-C152 HydrophobicContact CD1-CB 3.89Å; A131-C152 CarbonylContact O-C 3.59Å; A131-C152 WeakPolarHBondContact O-CA 3.49Å; C132-C152 HydrophobicContact CB-CB 3.98Å; C132-C152 WeakPolarHBondContact CB-SG 3.12Å; C132-C152 WeakPolarHBondContact SG-CB 3.49Å; C132-C152 CovalentContact SG-SG 2.04Å; C132-C152 PolarHBondContact SG-SG 2.95Å; C152-Y163 WeakPolarHBondContact CA-O 3.38Å; C152-Y163 HydrophobicContact CB-CD1 4.21Å; C152-Y163 WeakPolarHBondContact CB-O 3.33Å; C152-Y163 PolarHBondContact N-O 3.18Å; C152-Y163 PolarHBondContact O-N 2.9Å
153	Y	91.2	Very high	83.2	Confident	14 Å²	14	50.2 Å²	50.2	6%	0.055	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	125.6	173.7	-64.1	-86.1	0	0	0	109.4	D97 F118 A131 T151 V160 V161 E162	D97-Y153 HydrophobicContact CB-CE1 4.24Å; F118-Y153 AromaticContact CD2-CD2 3.9Å; F118-Y153 HydrophobicContact CD2-CD2 3.9Å; F118-Y153 HydrophobicContact CD2-CE2 4.27Å; F118-Y153 AromaticContact CE2-CD2 3.48Å; F118-Y153 HydrophobicContact CE2-CD2 3.48Å; F118-Y153 VanDerWaalsContact CE2-CD2 3.48Å; F118-Y153 HydrophobicContact CE2-CE2 4.25Å; F118-Y153 HydrophobicContact CE2-CG 4.27Å; F118-Y153 HydrophobicContact CZ-CD2 4.26Å; A131-Y153 PolarHBondContact N-O 2.88Å; A131-Y153 PolarHBondContact O-N 2.89Å; T151-Y153 HydrophobicContact CG2-CE2 3.92Å; Y153-V160 HydrophobicContact CD1-CG1 4.29Å; Y153-V161 WeakPolarHBondContact CA-O 3.41Å; Y153-E162 HydrophobicContact CD1-CB 4.15Å; Y153-E162 HydrophobicContact CD1-CG 4.4Å; Y153-E162 HydrophobicContact CE1-CB 3.95Å; Y153-E162 HydrophobicContact CE1-CG 3.98Å
154	L	90.8	Very high	84.8	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	123.8	176.9	-177.7	72.2	0	0	0	108.9	H128 I129 L130 V160 V161 F187 V213 I216 L217	H128-L154 HydrophobicContact CB-CD1 4.02Å; I129-L154 WeakPolarHBondContact O-CA 3.36Å; L130-L154 HydrophobicContact CB-CD1 4.24Å; L130-L154 HydrophobicContact CD1-CB 4.25Å; L130-L154 HydrophobicContact CD1-CD1 4.18Å; L154-V160 WeakPolarHBondContact O-CA 3.49Å; L154-V161 HydrophobicContact CB-CG2 3.82Å; L154-V161 HydrophobicContact CD2-CG2 4.25Å; L154-V161 HydrophobicContact CG-CG2 4.45Å; L154-V161 PolarHBondContact N-O 2.91Å; L154-V161 PolarHBondContact O-N 2.82Å; L154-F187 HydrophobicContact CD1-CE1 4.38Å; L154-F187 HydrophobicContact CD1-CZ 3.99Å; L154-V213 HydrophobicContact CD2-CG1 4.07Å; L154-I216 HydrophobicContact CD2-CB 4.48Å; L154-I216 HydrophobicContact CD2-CG2 4.06Å; L154-L217 HydrophobicContact CD2-CD2 4.15Å; L154-L217 HydrophobicContact CD2-CG 4.08Å
155	K	88.6	Confident	86.1	Confident	31 Å²	31	38.8 Å²	38.8	14%	0.135	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	129.1	-178.1	-178.5	-179	-173.4	85	0	110.5	L95 F96 H128 I129 G157 T159 V160	L95-K155 PolarHBondContact O-NZ 2.76Å; F96-K155 HydrophobicContact CD1-CB 4.04Å; F96-K155 HydrophobicContact CD1-CD 4.35Å; F96-K155 HydrophobicContact CE1-CB 3.49Å; F96-K155 VanDerWaalsContact CE1-CB 3.49Å; F96-K155 HydrophobicContact CE1-CD 3.92Å; F96-K155 HydrophobicContact CE1-CG 4.34Å; F96-K155 HydrophobicContact CZ-CB 4.25Å; F96-K155 HydrophobicContact CZ-CD 4.03Å; H128-K155 WeakPolarHBondContact CA-O 3.45Å; I129-K155 HydrophobicContact CB-CB 4.45Å; I129-K155 PolarHBondContact N-O 2.78Å; I129-K155 PolarHBondContact O-N 2.63Å; K155-G157 VanDerWaalsContact CE-O 3.3Å; K155-G157 WeakPolarHBondContact CE-O 3.25Å; K155-T159 WeakPolarHBondContact CA-O 3.37Å; K155-V160 HydrophobicContact CB-CG2 4.26Å; K155-V160 HydrophobicContact CD-CG2 4.42Å; K155-V160 HydrophobicContact CG-CG2 3.98Å
156	K	87	Confident	87.1	Confident	61 Å²	61	33.8 Å²	33.8	27%	0.265	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	103.6	171.5	-170.8	-175.9	179	111.7	0	108.4	E127 H128 N158 T159 L217	E127-K156 WeakPolarHBondContact OE1-CE 3.43Å; E127-K156 IonicContact OE1-NZ 3.56Å; E127-K156 PolarHBondContact OE1-NZ 2.93Å; E127-K156 IonicContact OE2-NZ 3.67Å; E127-K156 PolarHBondContact OE2-NZ 2.85Å; H128-K156 PolarHBondContact NE2-NZ 2.72Å; K156-N158 PolarHBondContact O-N 3.03Å; K156-T159 PolarHBondContact N-O 3.39Å; K156-T159 PolarHBondContact O-N 3.3Å; K156-T159 PolarHBondContact O-OG1 3.31Å; K156-L217 HydrophobicContact CD-CD1 3.97Å
157	G	81.8	Confident	87.3	Confident	54 Å²	54	27.3 Å²	27.3	56%	0.557	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	-117.7	-171.5	0	0	0	0	0	112	K155	K155-G157 VanDerWaalsContact CE-O 3.3Å; K155-G157 WeakPolarHBondContact CE-O 3.25Å
158	N	80.8	Confident	87	Confident	163 Å²	163	28.1 Å²	28.1	87%	0.872	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-14.1	176.8	-74.7	-7	0	0	0	113.9	K156	K156-N158 PolarHBondContact O-N 3.03Å
159	T	85.3	Confident	86.2	Confident	90 Å²	90	32.5 Å²	32.5	55%	0.552	20%	0.196	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-78.6	128.6	177.7	10.7	0	0	0	0	110.2	K155 K156	K155-T159 WeakPolarHBondContact CA-O 3.37Å; K156-T159 PolarHBondContact N-O 3.39Å; K156-T159 PolarHBondContact O-N 3.3Å; K156-T159 PolarHBondContact O-OG1 3.31Å
160	V	86.6	Confident	85.4	Confident	42 Å²	42	34.6 Å²	34.6	26%	0.255	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	131.5	176	-177.5	0	0	0	0	108.1	F96 Y153 L154 K155	F96-V160 HydrophobicContact CB-CG1 4.33Å; F96-V160 HydrophobicContact CD1-CG1 4.08Å; Y153-V160 HydrophobicContact CD1-CG1 4.29Å; L154-V160 WeakPolarHBondContact O-CA 3.49Å; K155-V160 HydrophobicContact CB-CG2 4.26Å; K155-V160 HydrophobicContact CD-CG2 4.42Å; K155-V160 HydrophobicContact CG-CG2 3.98Å
161	V	88.4	Confident	84.3	Confident	11 Å²	11	37 Å²	37	7%	0.067	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	144.2	175.6	-60.4	0	0	0	0	110	Y153 L154 I216 L217 F220	Y153-V161 WeakPolarHBondContact CA-O 3.41Å; L154-V161 HydrophobicContact CB-CG2 3.82Å; L154-V161 HydrophobicContact CD2-CG2 4.25Å; L154-V161 HydrophobicContact CG-CG2 4.45Å; L154-V161 PolarHBondContact N-O 2.91Å; L154-V161 PolarHBondContact O-N 2.82Å; V161-I216 HydrophobicContact CG2-CG2 3.9Å; V161-L217 HydrophobicContact CG1-CD2 4.05Å; V161-L217 HydrophobicContact CG2-CD2 3.74Å; V161-F220 HydrophobicContact CB-CB 4.14Å; V161-F220 HydrophobicContact CB-CD1 4.34Å; V161-F220 HydrophobicContact CB-CD2 3.94Å; V161-F220 HydrophobicContact CB-CG 3.85Å; V161-F220 HydrophobicContact CG1-CB 3.86Å; V161-F220 HydrophobicContact CG1-CD1 4.02Å; V161-F220 HydrophobicContact CG1-CD2 4.42Å; V161-F220 HydrophobicContact CG1-CG 3.82Å
162	E	87.8	Confident	83.5	Confident	31 Å²	31	40.4 Å²	40.4	15%	0.145	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	134.3	172.5	-174.4	-174.4	-144.5	0	0	109.5	T151 Y153 R167 F220	T151-E162 WeakPolarHBondContact OG1-CG 3.4Å; T151-E162 PolarHBondContact OG1-OE1 3.04Å; Y153-E162 HydrophobicContact CD1-CB 4.15Å; Y153-E162 HydrophobicContact CD1-CG 4.4Å; Y153-E162 HydrophobicContact CE1-CB 3.95Å; Y153-E162 HydrophobicContact CE1-CG 3.98Å; E162-R167 IonicContact OE2-CZ 3.08Å; E162-R167 IonicContact OE2-NH1 2.68Å; E162-R167 IonicContact OE2-NH2 3.22Å; E162-R167 PolarHBondContact OE2-NH2 2.62Å; E162-R167 VanDerWaalsContact OE2-NH2 3.1Å; E162-F220 HydrophobicContact CB-CE2 3.82Å; E162-F220 HydrophobicContact CB-CZ 4.34Å; E162-F220 WeakPolarHBondContact O-CD2 3.15Å; E162-F220 WeakPolarHBondContact O-CE2 3.14Å
163	Y	87.9	Confident	82.5	Confident	1 Å²	1	42.5 Å²	42.5	0%	0.004	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	102	176.5	174.9	-123.6	0	0	0	109.1	C152 P165 V194 V196 D211 I216 Y228	C152-Y163 WeakPolarHBondContact CA-O 3.38Å; C152-Y163 HydrophobicContact CB-CD1 4.21Å; C152-Y163 WeakPolarHBondContact CB-O 3.33Å; C152-Y163 PolarHBondContact N-O 3.18Å; C152-Y163 PolarHBondContact O-N 2.9Å; Y163-P165 HydrophobicContact CE1-CG 4.13Å; Y163-P165 HydrophobicContact CE2-CB 4.01Å; Y163-P165 HydrophobicContact CE2-CG 4.05Å; Y163-V194 HydrophobicContact CE1-CG1 4.45Å; Y163-V196 HydrophobicContact CD1-CG2 4.38Å; Y163-V196 HydrophobicContact CE1-CG2 3.68Å; Y163-D211 HydrophobicContact CE2-CB 4.17Å; Y163-D211 PolarHBondContact OH-OD2 3.25Å; Y163-I216 HydrophobicContact CD1-CD1 4.37Å; Y163-I216 HydrophobicContact CD2-CD1 3.87Å; Y163-I216 HydrophobicContact CD2-CG1 3.98Å; Y163-I216 HydrophobicContact CD2-CG2 4.26Å; Y163-I216 HydrophobicContact CE1-CD1 4.38Å; Y163-I216 HydrophobicContact CE2-CD1 3.9Å; Y163-I216 HydrophobicContact CE2-CG1 4.16Å; Y163-I216 HydrophobicContact CG-CD1 4.13Å; Y163-I216 HydrophobicContact CG-CG2 4.34Å; Y163-Y228 AromaticContact CD2-CE2 3.88Å; Y163-Y228 HydrophobicContact CD2-CE2 3.88Å; Y163-Y228 AromaticContact CD2-CZ 3.93Å; Y163-Y228 HydrophobicContact CE2-CD2 4.34Å; Y163-Y228 AromaticContact CE2-CE2 3.71Å; Y163-Y228 HydrophobicContact CE2-CE2 3.71Å
164	S	88.3	Confident	81.8	Confident	9 Å²	9	47.7 Å²	47.7	6%	0.063	28%	0.282	C	S	.	.			trans	-129.2	82.1	178.6	-175.3	0	0	0	0	109.9	G150 C166 R167	G150-S164 PolarHBondContact O-OG 3.2Å; S164-C166 VanDerWaalsContact C-N 3.3Å; S164-C166 PolarHBondContact O-N 3.1Å; S164-R167 PolarHBondContact O-N 3.46Å; S164-R167 WeakPolarHBondContact OG-CB 3.15Å
165	P	84.7	Confident	81.4	Confident	22 Å²	22	48 Å²	48	14%	0.143	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-23.6	-173.9	28.4	-36.3	0	0	0	113.6	Y163 R167 I209	Y163-P165 HydrophobicContact CE1-CG 4.13Å; Y163-P165 HydrophobicContact CE2-CB 4.01Å; Y163-P165 HydrophobicContact CE2-CG 4.05Å; P165-R167 VanDerWaalsContact C-N 3.33Å; P165-I209 HydrophobicContact CB-CD1 3.91Å; P165-I209 HydrophobicContact CB-CG2 3.94Å; P165-I209 HydrophobicContact CG-CD1 3.94Å; P165-I209 HydrophobicContact CG-CG2 4.29Å
166	C	86	Confident	81.2	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.014	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-6.6	178.5	-77.3	0	0	0	0	113.8	S164 S168 Q176 C179 A181 I209	S164-C166 VanDerWaalsContact C-N 3.3Å; S164-C166 PolarHBondContact O-N 3.1Å; C166-S168 VanDerWaalsContact C-N 3.32Å; C166-S168 PolarHBondContact O-N 3.1Å; C166-Q176 HydrophobicContact CB-CB 4.29Å; C166-C179 HydrophobicContact CB-CB 3.27Å; C166-C179 WeakPolarHBondContact CB-SG 3.25Å; C166-C179 WeakPolarHBondContact SG-CB 3.33Å; C166-C179 CovalentContact SG-SG 2.03Å; C166-C179 PolarHBondContact SG-SG 3.49Å; C166-A181 HydrophobicContact CB-CB 4.07Å; C166-I209 VanDerWaalsContact SG-CD1 3.6Å
167	R	83.4	Confident	81	Confident	16 Å²	16	44.8 Å²	44.8	6%	0.06	27%	0.272	C	S	.	.			trans	-79.9	82.7	171.7	-171.8	171	66.7	-170.9	-7.8	109.2	W138 E162 S164 P165 Y224	W138-R167 HydrophobicContact CD2-CG 4.31Å; W138-R167 HydrophobicContact CG-CG 4.47Å; E162-R167 IonicContact OE2-CZ 3.08Å; E162-R167 IonicContact OE2-NH1 2.68Å; E162-R167 IonicContact OE2-NH2 3.22Å; E162-R167 PolarHBondContact OE2-NH2 2.62Å; E162-R167 VanDerWaalsContact OE2-NH2 3.1Å; S164-R167 PolarHBondContact O-N 3.46Å; S164-R167 WeakPolarHBondContact OG-CB 3.15Å; P165-R167 VanDerWaalsContact C-N 3.33Å; R167-Y224 PolarHBondContact NE-O 3.19Å; R167-Y224 PolarHBondContact NH2-O 3.34Å
168	S	77.1	Confident	81.3	Confident	23 Å²	23	45 Å²	45	16%	0.161	26%	0.258	C	S	.	.	S	Bend	trans	-129.7	175	-177.3	74.3	0	0	0	0	111.3	C166 S170 H171 Q176	C166-S168 VanDerWaalsContact C-N 3.32Å; C166-S168 PolarHBondContact O-N 3.1Å; S168-S170 PolarHBondContact O-N 3.29Å; S168-S170 VanDerWaalsContact O-N 3.11Å; S168-S170 PolarHBondContact OG-OG 2.89Å; S168-H171 PolarHBondContact O-CE1 3.27Å; S168-H171 PolarHBondContact O-ND1 3.26Å; S168-H171 PolarHBondContact O-NE2 3.08Å; S168-Q176 PolarHBondContact OG-OE1 3.15Å
169	S	71.4	Confident	81.6	Confident	110 Å²	110	37.2 Å²	37.2	77%	0.769	22%	0.216	S	C	*	.	S	Bend	trans	-66.5	-7.3	-179.6	57.9	0	0	0	0	115	H171	S169-H171 VanDerWaalsContact C-N 3.34Å; S169-H171 WeakPolarHBondContact CA-NE2 3.11Å; S169-H171 PolarHBondContact O-CD2 3.4Å; S169-H171 PolarHBondContact O-N 2.71Å
170	S	71.5	Confident	81.9	Confident	46 Å²	46	34.8 Å²	34.8	32%	0.322	20%	0.198	S	C	.	.			trans	-92.6	64.2	179.3	48.9	0	0	0	0	111.5	S168 T172 Q176	S168-S170 PolarHBondContact O-N 3.29Å; S168-S170 VanDerWaalsContact O-N 3.11Å; S168-S170 PolarHBondContact OG-OG 2.89Å; S170-T172 VanDerWaalsContact C-N 3.26Å; S170-T172 PolarHBondContact O-N 3.36Å; S170-Q176 PolarHBondContact O-N 3.41Å
171	H	69.2	Low	82	Confident	49 Å²	49	32.9 Å²	32.9	23%	0.227	19%	0.187	C	C	.	.			trans	-72.1	-7	-171.7	-56.3	-72.6	0	0	0	115.5	T140 E147 S168 S169	T140-H171 HydrophobicContact CG2-CB 4.06Å; T140-H171 WeakPolarHBondContact CG2-CD2 3.06Å; T140-H171 VanDerWaalsContact CG2-CG 3.41Å; T140-H171 WeakPolarHBondContact CG2-NE2 3.47Å; T140-H171 PolarHBondContact OG1-ND1 2.76Å; T140-H171 VanDerWaalsContact OG1-ND1 3.08Å; E147-H171 WeakPolarHBondContact OE2-CB 3.08Å; E147-H171 IonicContact OE2-ND1 3.47Å; E147-H171 VanDerWaalsContact OE2-O 3.06Å; S168-H171 PolarHBondContact O-CE1 3.27Å; S168-H171 PolarHBondContact O-ND1 3.26Å; S168-H171 PolarHBondContact O-NE2 3.08Å; S169-H171 VanDerWaalsContact C-N 3.34Å; S169-H171 WeakPolarHBondContact CA-NE2 3.11Å; S169-H171 PolarHBondContact O-CD2 3.4Å; S169-H171 PolarHBondContact O-N 2.71Å
172	T	73.6	Confident	82	Confident	72 Å²	72	32.4 Å²	32.4	44%	0.442	18%	0.184	S	C	.	.	S	Bend	trans	-80.9	163.9	-176.9	54.6	0	0	0	0	112.6	S170 E174 G175 G177	S170-T172 VanDerWaalsContact C-N 3.26Å; S170-T172 PolarHBondContact O-N 3.36Å; T172-E174 PolarHBondContact O-N 2.92Å; T172-G175 CarbonylContact O-C 3.51Å; T172-G175 WeakPolarHBondContact O-CA 3.1Å; T172-G175 PolarHBondContact O-N 2.82Å; T172-G177 PolarHBondContact O-N 3.44Å
173	P	70.9	Confident	82.1	Confident	45 Å²	45	33.7 Å²	33.7	29%	0.292	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-27.7	167.8	-24.5	33.1	0	0	0	113.8	G175 F178 Y203	P173-G175 PolarHBondContact O-N 3.05Å; P173-F178 HydrophobicContact CB-CD2 4.29Å; P173-F178 HydrophobicContact CB-CE2 4.43Å; P173-F178 HydrophobicContact CG-CD2 4.18Å; P173-F178 HydrophobicContact CG-CE2 3.85Å; P173-Y203 HydrophobicContact CB-CD1 4.14Å; P173-Y203 HydrophobicContact CB-CE1 3.84Å; P173-Y203 PolarHBondContact O-N 2.82Å
174	E	76.8	Confident	82.2	Confident	123 Å²	123	34 Å²	34	58%	0.575	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-19.9	172.1	-71.8	174.5	-176.1	0	0	113.1	T172 F202 Y203	T172-E174 PolarHBondContact O-N 2.92Å; E174-F202 VanDerWaalsContact O-CD1 3.31Å; E174-F202 WeakPolarHBondContact O-CD1 3.3Å; E174-Y203 HydrophobicContact CB-CE2 4.3Å; E174-Y203 HydrophobicContact CG-CD2 4.21Å; E174-Y203 HydrophobicContact CG-CE1 4.49Å; E174-Y203 HydrophobicContact CG-CE2 3.27Å; E174-Y203 VanDerWaalsContact CG-CZ 3.42Å; E174-Y203 VanDerWaalsContact CG-OH 3.22Å; E174-Y203 WeakPolarHBondContact CG-OH 3.31Å; E174-Y203 PolarHBondContact OE1-OH 3.33Å
175	G	82	Confident	82.3	Confident	7 Å²	7	33.8 Å²	33.8	7%	0.072	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-123.5	-179.8	0	0	0	0	0	112.3	T172 P173 F202	T172-G175 CarbonylContact O-C 3.51Å; T172-G175 WeakPolarHBondContact O-CA 3.1Å; T172-G175 PolarHBondContact O-N 2.82Å; P173-G175 PolarHBondContact O-N 3.05Å; G175-F202 PolarHBondContact O-N 3.31Å
176	Q	84.6	Confident	82.6	Confident	24 Å²	24	34.3 Å²	34.3	11%	0.112	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.3	5.6	-172.1	-66.7	178.1	-47.1	0	0	113.5	C166 S168 S170 F178 C179	C166-Q176 HydrophobicContact CB-CB 4.29Å; S168-Q176 PolarHBondContact OG-OE1 3.15Å; S170-Q176 PolarHBondContact O-N 3.41Å; Q176-F178 PolarHBondContact O-N 3.07Å; Q176-C179 HydrophobicContact CB-CB 4.4Å; Q176-C179 WeakPolarHBondContact O-CB 3.5Å; Q176-C179 PolarHBondContact O-N 3.45Å
177	G	82.4	Confident	82.7	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.01	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-36	-178.5	0	0	0	0	0	113.6	E147 P148 V149 T172	E147-G177 CarbonylContact C-O 3.55Å; E147-G177 WeakPolarHBondContact CB-O 3.23Å; P148-G177 CarbonylContact C-O 3.58Å; V149-G177 WeakPolarHBondContact CG1-O 3.46Å; V149-G177 PolarHBondContact N-O 3.33Å; T172-G177 PolarHBondContact O-N 3.44Å
178	F	88.1	Confident	82.8	Confident	58 Å²	58	33.9 Å²	33.9	25%	0.254	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	17.8	179.2	-69.7	-97	0	0	0	113.5	P148 P173 Q176 Q180 G200	P148-F178 HydrophobicContact CG-CD1 3.61Å; P148-F178 HydrophobicContact CG-CE1 4.12Å; P148-F178 HydrophobicContact CG-CG 4.32Å; P173-F178 HydrophobicContact CB-CD2 4.29Å; P173-F178 HydrophobicContact CB-CE2 4.43Å; P173-F178 HydrophobicContact CG-CD2 4.18Å; P173-F178 HydrophobicContact CG-CE2 3.85Å; Q176-F178 PolarHBondContact O-N 3.07Å; F178-Q180 VanDerWaalsContact C-N 3.3Å; F178-Q180 PolarHBondContact O-N 3.12Å; F178-G200 CarbonylContact O-C 3.53Å; F178-G200 WeakPolarHBondContact O-CA 3.23Å
179	C	87.6	Confident	82.8	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.216	C	C	.	.			trans	-53.7	-40	-171.6	168.3	0	0	0	0	114.5	C166 Q176 A181 G198 P199 G200 S201	C166-C179 HydrophobicContact CB-CB 3.27Å; C166-C179 WeakPolarHBondContact CB-SG 3.25Å; C166-C179 WeakPolarHBondContact SG-CB 3.33Å; C166-C179 CovalentContact SG-SG 2.03Å; C166-C179 PolarHBondContact SG-SG 3.49Å; Q176-C179 HydrophobicContact CB-CB 4.4Å; Q176-C179 WeakPolarHBondContact O-CB 3.5Å; Q176-C179 PolarHBondContact O-N 3.45Å; C179-A181 VanDerWaalsContact C-N 3.32Å; C179-G198 CarbonylContact O-C 3.35Å; C179-G198 WeakPolarHBondContact O-CA 3.32Å; C179-P199 WeakPolarHBondContact O-CD 3.39Å; C179-G200 PolarHBondContact O-N 2.99Å; C179-G200 VanDerWaalsContact O-N 3.16Å; C179-S201 VanDerWaalsContact CB-OG 3.3Å; C179-S201 WeakPolarHBondContact CB-OG 3.13Å; C179-S201 PolarHBondContact SG-OG 2.86Å
180	Q	90.9	Very high	83	Confident	39 Å²	39	41.2 Å²	41.2	18%	0.182	21%	0.206	C	C	.	.			trans	54.6	46	-171.8	-56.2	-175.2	-101.1	0	0	112.7	P134 L135 P148 V149 F178 G182 F183	P134-Q180 WeakPolarHBondContact O-CA 3.46Å; P134-Q180 WeakPolarHBondContact O-CB 3.41Å; L135-Q180 VanDerWaalsContact CD2-NE2 3.31Å; P148-Q180 HydrophobicContact CB-CG 4.26Å; P148-Q180 HydrophobicContact CG-CG 4.43Å; P148-Q180 WeakPolarHBondContact O-CA 3.02Å; P148-Q180 WeakPolarHBondContact O-CG 3.48Å; P148-Q180 PolarHBondContact O-N 3.49Å; V149-Q180 PolarHBondContact O-N 3.19Å; F178-Q180 VanDerWaalsContact C-N 3.3Å; F178-Q180 PolarHBondContact O-N 3.12Å; Q180-G182 PolarHBondContact O-N 3.3Å; Q180-F183 PolarHBondContact O-N 2.8Å
181	A	89.6	Confident	83.2	Confident	2 Å²	2	41 Å²	41	2%	0.017	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	133.1	179.3	0	0	0	0	0	111	V149 C166 C179 V196	V149-A181 PolarHBondContact O-N 2.76Å; C166-A181 HydrophobicContact CB-CB 4.07Å; C179-A181 VanDerWaalsContact C-N 3.32Å; A181-V196 HydrophobicContact CB-CG1 4.19Å
182	G	87.9	Confident	84	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	97.8	7.7	178.6	0	0	0	0	0	113.8	S121 C132 Q180 S184 G197	S121-G182 PolarHBondContact OG-O 2.92Å; C132-G182 WeakPolarHBondContact CB-O 3.48Å; Q180-G182 PolarHBondContact O-N 3.3Å; G182-S184 VanDerWaalsContact C-N 3.28Å; G182-S184 PolarHBondContact O-N 3.01Å; G182-G197 PolarHBondContact N-O 3.4Å; G182-G197 VanDerWaalsContact N-O 3.16Å
183	F	90.3	Very high	84.7	Confident	58 Å²	58	39.3 Å²	39.3	25%	0.254	19%	0.192	S	C	.	.	S	Bend	trans	-57.1	-46.5	172	-160.3	-66.5	0	0	0	110.7	P134 Q180 P199 R248 Y249	P134-F183 HydrophobicContact CB-CB 4.38Å; P134-F183 HydrophobicContact CB-CD2 4.37Å; Q180-F183 PolarHBondContact O-N 2.8Å; F183-P199 HydrophobicContact CB-CG 4.12Å; F183-P199 HydrophobicContact CD2-CG 4.11Å; F183-P199 HydrophobicContact CG-CG 4.18Å; F183-R248 HydrophobicContact CD1-CG 4.05Å; F183-R248 WeakPolarHBondContact CD1-O 3.44Å; F183-R248 HydrophobicContact CE1-CG 3.8Å; F183-R248 HydrophobicContact CE2-CG 4.44Å; F183-R248 HydrophobicContact CG-CG 4.43Å; F183-R248 HydrophobicContact CZ-CG 4.02Å; F183-Y249 AromaticContact CE1-CD2 3.61Å; F183-Y249 HydrophobicContact CE1-CD2 3.61Å; F183-Y249 HydrophobicContact CE1-CE2 4.06Å; F183-Y249 HydrophobicContact CE1-CG 4.41Å; F183-Y249 HydrophobicContact CZ-CD2 4.32Å
184	S	90.4	Very high	85.6	Confident	8 Å²	8	37.2 Å²	37.2	6%	0.056	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	143.4	166.3	59	0	0	0	0	109.6	G182 G197 G247 R248 V251	G182-S184 VanDerWaalsContact C-N 3.28Å; G182-S184 PolarHBondContact O-N 3.01Å; S184-G197 PolarHBondContact O-N 3.03Å; S184-G247 PolarHBondContact OG-O 3.29Å; S184-R248 WeakPolarHBondContact CB-O 3.15Å; S184-R248 PolarHBondContact OG-O 3.24Å; S184-V251 WeakPolarHBondContact OG-CG2 3.09Å
185	A	90.3	Very high	86.3	Confident	5 Å²	5	31.4 Å²	31.4	4%	0.041	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	151	175.1	0	0	0	0	0	110	R123 L130 V195 V196	R123-A185 VanDerWaalsContact CG-O 3.27Å; R123-A185 WeakPolarHBondContact CG-O 3.17Å; R123-A185 PolarHBondContact NE-O 2.99Å; L130-A185 HydrophobicContact CD2-CB 3.74Å; A185-V195 VanDerWaalsContact CA-O 3.28Å; A185-V195 WeakPolarHBondContact CA-O 3.46Å; A185-V196 HydrophobicContact CB-CG2 4.26Å
186	D	89.7	Confident	86.7	Confident	32 Å²	32	31.1 Å²	31.1	17%	0.171	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	160.6	173.3	-154	5.9	0	0	0	112	V195	D186-V195 HydrophobicContact CB-CG1 3.93Å; D186-V195 PolarHBondContact N-O 3.06Å; D186-V195 WeakPolarHBondContact O-CG1 3.2Å; D186-V195 PolarHBondContact O-N 3.08Å
187	F	88.8	Confident	87.1	Confident	9 Å²	9	30 Å²	30	4%	0.039	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	132.2	175.4	-80.1	-81.3	0	0	0	111.3	R123 D125 H128 L130 L154 K189 V194 V213	R123-F187 HydrophobicContact CB-CD2 3.84Å; R123-F187 HydrophobicContact CB-CE2 3.91Å; D125-F187 HydrophobicContact CB-CB 4.4Å; D125-F187 HydrophobicContact CB-CD1 4.29Å; D125-F187 HydrophobicContact CB-CD2 4.33Å; D125-F187 HydrophobicContact CB-CG 4.11Å; H128-F187 HydrophobicContact CB-CE1 4.4Å; H128-F187 HydrophobicContact CB-CZ 4.17Å; L130-F187 HydrophobicContact CB-CE2 3.74Å; L130-F187 HydrophobicContact CB-CZ 3.73Å; L154-F187 HydrophobicContact CD1-CE1 4.38Å; L154-F187 HydrophobicContact CD1-CZ 3.99Å; F187-K189 PolarHBondContact O-N 3.32Å; F187-V194 HydrophobicContact CD1-CG2 3.77Å; F187-V194 HydrophobicContact CE1-CG2 3.47Å; F187-V194 VanDerWaalsContact CE1-CG2 3.47Å; F187-V194 HydrophobicContact CZ-CG2 4.21Å; F187-V213 HydrophobicContact CD1-CG2 4.37Å; F187-V213 HydrophobicContact CE1-CG2 4.08Å
188	V	85.9	Confident	87.5	Confident	1 Å²	1	30 Å²	30	1%	0.006	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	86.1	172.9	-163.5	0	0	0	0	108.1	K190 S191 N192 R193 V195 V253 E262 Y264	V188-K190 VanDerWaalsContact C-N 3.33Å; V188-K190 PolarHBondContact O-N 2.82Å; V188-S191 WeakPolarHBondContact CB-OG 3.36Å; V188-S191 WeakPolarHBondContact CG1-OG 3.46Å; V188-S191 PolarHBondContact O-N 2.83Å; V188-N192 PolarHBondContact O-N 3.05Å; V188-R193 HydrophobicContact CB-CB 4.06Å; V188-R193 HydrophobicContact CG2-CB 4.03Å; V188-R193 PolarHBondContact N-O 2.84Å; V188-R193 PolarHBondContact O-N 2.87Å; V188-V195 HydrophobicContact CG2-CG1 4.46Å; V188-V253 HydrophobicContact CG2-CG1 3.94Å; V188-E262 HydrophobicContact CG1-CB 3.74Å; V188-E262 HydrophobicContact CG1-CG 4.42Å; V188-E262 WeakPolarHBondContact CG1-OE2 3.49Å; V188-Y264 HydrophobicContact CG2-CE1 3.78Å
189	K	76.9	Confident	87.6	Confident	158 Å²	158	27.4 Å²	27.4	69%	0.687	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-40.1	-167.7	-69.7	-179.8	-178.7	173.7	0	112.7	F187 S191 E262	F187-K189 PolarHBondContact O-N 3.32Å; K189-S191 VanDerWaalsContact C-N 3.32Å; K189-S191 PolarHBondContact O-N 2.95Å; K189-E262 PolarHBondContact N-OE2 2.81Å; K189-E262 VanDerWaalsContact N-OE2 3.15Å
190	K	76.5	Confident	87.6	Confident	128 Å²	128	27.5 Å²	27.5	56%	0.557	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-29.4	-177.8	-69.1	-172.8	-169.8	171.8	0	113.2	V188 D255 E262	V188-K190 VanDerWaalsContact C-N 3.33Å; V188-K190 PolarHBondContact O-N 2.82Å; K190-D255 IonicContact NZ-OD2 3.64Å; K190-D255 PolarHBondContact NZ-OD2 3.35Å; K190-E262 HydrophobicContact CB-CG 4.37Å; K190-E262 HydrophobicContact CD-CG 4.05Å; K190-E262 HydrophobicContact CG-CG 4.27Å; K190-E262 PolarHBondContact N-OE2 3.25Å
191	S	74.8	Confident	87.5	Confident	42 Å²	42	25.6 Å²	25.6	29%	0.294	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.6	0.3	-174.3	69.5	0	0	0	0	114.7	V188 K189 R193	V188-S191 WeakPolarHBondContact CB-OG 3.36Å; V188-S191 WeakPolarHBondContact CG1-OG 3.46Å; V188-S191 PolarHBondContact O-N 2.83Å; K189-S191 VanDerWaalsContact C-N 3.32Å; K189-S191 PolarHBondContact O-N 2.95Å; S191-R193 VanDerWaalsContact C-N 3.33Å; S191-R193 PolarHBondContact O-N 2.81Å; S191-R193 WeakPolarHBondContact OG-CD 3.36Å; S191-R193 WeakPolarHBondContact OG-CG 3.46Å
192	N	85.9	Confident	87.5	Confident	50 Å²	50	27 Å²	27	27%	0.267	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	46.2	-176.1	-164.8	32	0	0	0	112.8	V188 N212 V213 D214	V188-N192 PolarHBondContact O-N 3.05Å; N192-N212 PolarHBondContact O-OD1 3.45Å; N192-V213 WeakPolarHBondContact O-CG2 3.46Å; N192-V213 PolarHBondContact O-N 3.06Å; N192-V213 VanDerWaalsContact O-N 3.07Å; N192-D214 PolarHBondContact ND2-OD2 2.86Å
193	R	89.1	Confident	87.5	Confident	36 Å²	36	31.5 Å²	31.5	14%	0.136	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	156	179.8	-59.4	180	72.8	145.6	12	111.5	V188 S191 S210 D211 T230	V188-R193 HydrophobicContact CB-CB 4.06Å; V188-R193 HydrophobicContact CG2-CB 4.03Å; V188-R193 PolarHBondContact N-O 2.84Å; V188-R193 PolarHBondContact O-N 2.87Å; S191-R193 VanDerWaalsContact C-N 3.33Å; S191-R193 PolarHBondContact O-N 2.81Å; S191-R193 WeakPolarHBondContact OG-CD 3.36Å; S191-R193 WeakPolarHBondContact OG-CG 3.46Å; R193-S210 PolarHBondContact NE-OG 2.78Å; R193-S210 VanDerWaalsContact NE-OG 3.09Å; R193-S210 PolarHBondContact NH2-O 2.77Å; R193-D211 CarbonylContact C-O 3.57Å; R193-D211 VanDerWaalsContact CA-O 3.28Å; R193-D211 WeakPolarHBondContact CA-O 3.42Å; R193-D211 WeakPolarHBondContact CB-O 3.21Å; R193-T230 PolarHBondContact NH2-O 2.93Å
194	V	89.8	Confident	87.4	Confident	1 Å²	1	33 Å²	33	1%	0.006	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	134.5	169.6	177	0	0	0	0	108.1	L130 Y163 F187 V196 S210 D211 V213	L130-V194 HydrophobicContact CD2-CG1 3.43Å; L130-V194 VanDerWaalsContact CD2-CG1 3.43Å; Y163-V194 HydrophobicContact CE1-CG1 4.45Å; F187-V194 HydrophobicContact CD1-CG2 3.77Å; F187-V194 HydrophobicContact CE1-CG2 3.47Å; F187-V194 VanDerWaalsContact CE1-CG2 3.47Å; F187-V194 HydrophobicContact CZ-CG2 4.21Å; V194-V196 HydrophobicContact CG1-CG2 3.86Å; V194-S210 VanDerWaalsContact O-CA 3.23Å; V194-S210 WeakPolarHBondContact O-CA 3.43Å; V194-D211 PolarHBondContact N-O 3Å; V194-D211 PolarHBondContact O-N 2.78Å; V194-V213 HydrophobicContact CG2-CG2 3.7Å
195	V	90.7	Very high	87.3	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	133.5	168.3	60.3	0	0	0	0	109.8	A185 D186 V188 L208 I209 V251 V253 Y264	A185-V195 VanDerWaalsContact CA-O 3.28Å; A185-V195 WeakPolarHBondContact CA-O 3.46Å; D186-V195 HydrophobicContact CB-CG1 3.93Å; D186-V195 PolarHBondContact N-O 3.06Å; D186-V195 WeakPolarHBondContact O-CG1 3.2Å; D186-V195 PolarHBondContact O-N 3.08Å; V188-V195 HydrophobicContact CG2-CG1 4.46Å; V195-L208 HydrophobicContact CG2-CD2 4.14Å; V195-I209 CarbonylContact C-O 3.55Å; V195-I209 WeakPolarHBondContact CA-O 3.37Å; V195-V251 HydrophobicContact CB-CG1 4.3Å; V195-V251 HydrophobicContact CG1-CG1 3.46Å; V195-V251 VanDerWaalsContact CG1-CG1 3.46Å; V195-V251 HydrophobicContact CG2-CG1 3.85Å; V195-V253 HydrophobicContact CG1-CG1 4.26Å; V195-Y264 HydrophobicContact CB-CD1 4.02Å; V195-Y264 HydrophobicContact CB-CE1 3.98Å; V195-Y264 HydrophobicContact CG1-CD1 4.26Å; V195-Y264 HydrophobicContact CG1-CE1 4.48Å; V195-Y264 HydrophobicContact CG2-CD1 3.86Å; V195-Y264 HydrophobicContact CG2-CE1 4.15Å
196	V	91	Very high	87.3	Confident	2 Å²	2	33.3 Å²	33.3	1%	0.012	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	133.3	178.9	176.6	0	0	0	0	109.8	Y163 A181 A185 V194 I209	Y163-V196 HydrophobicContact CD1-CG2 4.38Å; Y163-V196 HydrophobicContact CE1-CG2 3.68Å; A181-V196 HydrophobicContact CB-CG1 4.19Å; A185-V196 HydrophobicContact CB-CG2 4.26Å; V194-V196 HydrophobicContact CG1-CG2 3.86Å; V196-I209 PolarHBondContact N-O 2.88Å; V196-I209 PolarHBondContact O-N 2.68Å
197	G	91.8	Very high	87.3	Confident	0 Å²	0	32 Å²	32	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	137.6	172.8	0	0	0	0	0	112.2	G182 S184 G247	G182-G197 PolarHBondContact N-O 3.4Å; G182-G197 VanDerWaalsContact N-O 3.16Å; S184-G197 PolarHBondContact O-N 3.03Å; G197-G247 CarbonylContact C-O 3.54Å; G197-G247 VanDerWaalsContact C-O 3.28Å; G197-G247 WeakPolarHBondContact CA-O 3.3Å
198	G	91.6	Very high	87.4	Confident	2 Å²	2	31.6 Å²	31.6	2%	0.021	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	88.3	179.4	0	0	0	0	0	110.7	C179 G200 G206 Q207	C179-G198 CarbonylContact O-C 3.35Å; C179-G198 WeakPolarHBondContact O-CA 3.32Å; G198-G200 VanDerWaalsContact C-N 3.28Å; G198-G200 PolarHBondContact O-N 2.93Å; G198-G206 CarbonylContact O-C 3.56Å; G198-G206 VanDerWaalsContact O-CA 3.27Å; G198-G206 WeakPolarHBondContact O-CA 3.37Å; G198-Q207 PolarHBondContact N-O 2.8Å; G198-Q207 PolarHBondContact O-N 3.28Å
199	P	91.1	Very high	87.7	Confident	3 Å²	3	31.8 Å²	31.8	2%	0.019	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-16.2	-169.2	27.2	-36.2	0	0	0	115.9	C179 F183 G206 L246 R248	C179-P199 WeakPolarHBondContact O-CD 3.39Å; F183-P199 HydrophobicContact CB-CG 4.12Å; F183-P199 HydrophobicContact CD2-CG 4.11Å; F183-P199 HydrophobicContact CG-CG 4.18Å; P199-G206 WeakPolarHBondContact O-CA 3.42Å; P199-G206 PolarHBondContact O-N 2.97Å; P199-L246 WeakPolarHBondContact CA-O 3.28Å; P199-R248 HydrophobicContact CB-CB 3.68Å; P199-R248 HydrophobicContact CB-CG 3.94Å; P199-R248 HydrophobicContact CG-CB 4.22Å; P199-R248 HydrophobicContact CG-CG 4.08Å
200	G	87.4	Confident	88.3	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.01	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	2	-174.9	0	0	0	0	0	115.5	F178 C179 G198 W204	F178-G200 CarbonylContact O-C 3.53Å; F178-G200 WeakPolarHBondContact O-CA 3.23Å; C179-G200 PolarHBondContact O-N 2.99Å; C179-G200 VanDerWaalsContact O-N 3.16Å; G198-G200 VanDerWaalsContact C-N 3.28Å; G198-G200 PolarHBondContact O-N 2.93Å; G200-W204 PolarHBondContact O-N 3.08Å
201	S	88.5	Confident	89	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-64.3	145.8	174.9	-61.9	0	0	0	0	111.5	C179 W204 Q205 G206 Q207	C179-S201 VanDerWaalsContact CB-OG 3.3Å; C179-S201 WeakPolarHBondContact CB-OG 3.13Å; C179-S201 PolarHBondContact SG-OG 2.86Å; S201-W204 PolarHBondContact O-N 3.05Å; S201-Q205 PolarHBondContact O-N 2.89Å; S201-Q205 VanDerWaalsContact O-N 3.15Å; S201-G206 PolarHBondContact O-N 2.79Å; S201-Q207 PolarHBondContact OG-OE1 2.95Å; S201-Q207 VanDerWaalsContact OG-OE1 3.11Å
202	F	88.5	Confident	89.6	Confident	30 Å²	30	18.5 Å²	18.5	13%	0.132	8%	0.083	C	C	.	.	H	α-helix	trans	52.1	70.9	176.6	-44.1	-71.4	0	0	0	112.7	E174 G175 W204 Q205 Q207	E174-F202 VanDerWaalsContact O-CD1 3.31Å; E174-F202 WeakPolarHBondContact O-CD1 3.3Å; G175-F202 PolarHBondContact O-N 3.31Å; F202-W204 VanDerWaalsContact C-N 3.25Å; F202-W204 PolarHBondContact O-N 2.03Å; F202-Q205 HydrophobicContact CB-CB 4.13Å; F202-Q205 HydrophobicContact CB-CG 4.24Å; F202-Q205 VanDerWaalsContact O-CB 3.3Å; F202-Q205 WeakPolarHBondContact O-CB 3.39Å; F202-Q205 WeakPolarHBondContact O-CG 3.43Å; F202-Q205 PolarHBondContact O-N 2.68Å; F202-Q207 HydrophobicContact CE2-CB 4.47Å; F202-Q207 HydrophobicContact CE2-CG 4.29Å
203	Y	88.4	Confident	89.7	Confident	95 Å²	95	16.1 Å²	16.1	37%	0.373	7%	0.07	S	C	.	.	H	α-helix	trans	46.7	46.9	-175.7	-68.6	-65.4	0	0	0	113.5	P173 E174 Q205 D243	P173-Y203 HydrophobicContact CB-CD1 4.14Å; P173-Y203 HydrophobicContact CB-CE1 3.84Å; P173-Y203 PolarHBondContact O-N 2.82Å; E174-Y203 HydrophobicContact CB-CE2 4.3Å; E174-Y203 HydrophobicContact CG-CD2 4.21Å; E174-Y203 HydrophobicContact CG-CE1 4.49Å; E174-Y203 HydrophobicContact CG-CE2 3.27Å; E174-Y203 VanDerWaalsContact CG-CZ 3.42Å; E174-Y203 VanDerWaalsContact CG-OH 3.22Å; E174-Y203 WeakPolarHBondContact CG-OH 3.31Å; E174-Y203 PolarHBondContact OE1-OH 3.33Å; Y203-Q205 PolarHBondContact O-N 2.93Å; Y203-D243 PolarHBondContact O-N 3.12Å; Y203-D243 VanDerWaalsContact O-N 3.14Å
204	W	88.5	Confident	89.5	Confident	90 Å²	90	17.6 Å²	17.6	34%	0.341	8%	0.081	S	C	.	.	H	α-helix	trans	61	20.3	-179.6	-59.2	-83.6	0	0	0	116	G200 S201 F202 G206 D243 S244 Y245	G200-W204 PolarHBondContact O-N 3.08Å; S201-W204 PolarHBondContact O-N 3.05Å; F202-W204 VanDerWaalsContact C-N 3.25Å; F202-W204 PolarHBondContact O-N 2.03Å; W204-G206 PolarHBondContact O-N 3.33Å; W204-D243 CarbonylContact O-C 3.56Å; W204-D243 WeakPolarHBondContact O-CA 3.33Å; W204-D243 PolarHBondContact O-N 2.85Å; W204-S244 PolarHBondContact O-N 2.85Å; W204-Y245 HydrophobicContact CB-CD1 3.86Å; W204-Y245 HydrophobicContact CB-CE1 3.59Å; W204-Y245 AromaticContact CD1-CE1 3.64Å; W204-Y245 HydrophobicContact CG-CD1 4.43Å; W204-Y245 AromaticContact CG-CE1 3.82Å; W204-Y245 HydrophobicContact CG-CE1 3.82Å; W204-Y245 PolarHBondContact O-N 2.86Å
205	Q	89	Confident	89.3	Confident	16 Å²	16	18.5 Å²	18.5	8%	0.075	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-44	163.3	-71.1	171	20.8	0	0	109.9	S201 F202 Y203 A237 Y241 D242 Y245 L246	S201-Q205 PolarHBondContact O-N 2.89Å; S201-Q205 VanDerWaalsContact O-N 3.15Å; F202-Q205 HydrophobicContact CB-CB 4.13Å; F202-Q205 HydrophobicContact CB-CG 4.24Å; F202-Q205 VanDerWaalsContact O-CB 3.3Å; F202-Q205 WeakPolarHBondContact O-CB 3.39Å; F202-Q205 WeakPolarHBondContact O-CG 3.43Å; F202-Q205 PolarHBondContact O-N 2.68Å; Y203-Q205 PolarHBondContact O-N 2.93Å; Q205-A237 PolarHBondContact NE2-O 2.92Å; Q205-A237 VanDerWaalsContact NE2-O 3.14Å; Q205-Y241 WeakPolarHBondContact CG-O 3.23Å; Q205-D242 WeakPolarHBondContact CG-OD1 3.12Å; Q205-D242 PolarHBondContact NE2-OD1 2.86Å; Q205-Y245 PolarHBondContact O-N 3.42Å; Q205-L246 WeakPolarHBondContact O-CB 3.26Å; Q205-L246 PolarHBondContact O-N 2.99Å
206	G	89.3	Confident	89	Confident	4 Å²	4	18.5 Å²	18.5	4%	0.041	9%	0.085	C	C	.	.	B	Isolated β-bridge	trans	91.9	164.9	-177.5	0	0	0	0	0	113.5	G198 P199 S201 W204 L246	G198-G206 CarbonylContact O-C 3.56Å; G198-G206 VanDerWaalsContact O-CA 3.27Å; G198-G206 WeakPolarHBondContact O-CA 3.37Å; P199-G206 WeakPolarHBondContact O-CA 3.42Å; P199-G206 PolarHBondContact O-N 2.97Å; S201-G206 PolarHBondContact O-N 2.79Å; W204-G206 PolarHBondContact O-N 3.33Å; G206-L246 CarbonylContact C-O 3.53Å; G206-L246 VanDerWaalsContact CA-O 3.31Å; G206-L246 WeakPolarHBondContact CA-O 3.4Å
207	Q	90.3	Very high	88.6	Confident	4 Å²	4	20.5 Å²	20.5	2%	0.019	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	146	-171.6	-167.9	173	24.9	0	0	112	G198 S201 F202 I209 T234 L246	G198-Q207 PolarHBondContact N-O 2.8Å; G198-Q207 PolarHBondContact O-N 3.28Å; S201-Q207 PolarHBondContact OG-OE1 2.95Å; S201-Q207 VanDerWaalsContact OG-OE1 3.11Å; F202-Q207 HydrophobicContact CE2-CB 4.47Å; F202-Q207 HydrophobicContact CE2-CG 4.29Å; Q207-I209 HydrophobicContact CG-CD1 4.43Å; Q207-I209 HydrophobicContact CG-CG1 3.97Å; Q207-T234 WeakPolarHBondContact CA-OG1 3.33Å; Q207-T234 WeakPolarHBondContact CG-OG1 2.96Å; Q207-T234 PolarHBondContact NE2-O 3.08Å; Q207-T234 VanDerWaalsContact NE2-O 3.08Å; Q207-L246 PolarHBondContact N-O 3.18Å
208	L	91.4	Very high	88.1	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	137.5	164.4	-74.7	173.1	0	0	0	109.5	V195 S233 T234 V251 T266 F281 M286	V195-L208 HydrophobicContact CG2-CD2 4.14Å; L208-S233 VanDerWaalsContact O-CA 3.23Å; L208-S233 WeakPolarHBondContact O-CA 3.36Å; L208-T234 HydrophobicContact CB-CG2 4.19Å; L208-T234 PolarHBondContact N-OG1 3Å; L208-T234 VanDerWaalsContact N-OG1 3.1Å; L208-T234 PolarHBondContact O-N 3.41Å; L208-T234 VanDerWaalsContact O-N 3.08Å; L208-V251 HydrophobicContact CD2-CG1 4.41Å; L208-V251 HydrophobicContact CD2-CG2 3.49Å; L208-V251 VanDerWaalsContact CD2-CG2 3.49Å; L208-T266 HydrophobicContact CD1-CG2 3.53Å; L208-T266 HydrophobicContact CG-CG2 4.37Å; L208-F281 HydrophobicContact CD1-CD2 3.74Å; L208-F281 HydrophobicContact CD1-CE2 3.9Å; L208-M286 HydrophobicContact CB-CE 4.46Å; L208-M286 HydrophobicContact CB-SD 4.47Å
209	I	90.4	Very high	87.3	Confident	6 Å²	6	34.3 Å²	34.3	3%	0.031	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	127.5	178.7	-52.4	176.9	0	0	0	108.4	P165 C166 V195 V196 Q207 T231 L232	P165-I209 HydrophobicContact CB-CD1 3.91Å; P165-I209 HydrophobicContact CB-CG2 3.94Å; P165-I209 HydrophobicContact CG-CD1 3.94Å; P165-I209 HydrophobicContact CG-CG2 4.29Å; C166-I209 VanDerWaalsContact SG-CD1 3.6Å; V195-I209 CarbonylContact C-O 3.55Å; V195-I209 WeakPolarHBondContact CA-O 3.37Å; V196-I209 PolarHBondContact N-O 2.88Å; V196-I209 PolarHBondContact O-N 2.68Å; Q207-I209 HydrophobicContact CG-CD1 4.43Å; Q207-I209 HydrophobicContact CG-CG1 3.97Å; I209-T231 HydrophobicContact CG2-CG2 3.73Å; I209-L232 CarbonylContact C-O 3.49Å; I209-L232 WeakPolarHBondContact CA-O 3.2Å
210	S	90.6	Very high	86.2	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	125.1	179.5	173.9	0	0	0	0	111.5	R193 V194 L232 Y264	R193-S210 PolarHBondContact NE-OG 2.78Å; R193-S210 VanDerWaalsContact NE-OG 3.09Å; R193-S210 PolarHBondContact NH2-O 2.77Å; V194-S210 VanDerWaalsContact O-CA 3.23Å; V194-S210 WeakPolarHBondContact O-CA 3.43Å; S210-L232 PolarHBondContact N-O 3.08Å; S210-L232 PolarHBondContact O-N 3.1Å; S210-Y264 WeakPolarHBondContact CB-OH 3.22Å; S210-Y264 PolarHBondContact OG-OH 3.08Å
211	D	90.1	Very high	85	Confident	1 Å²	1	42 Å²	42	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	155.2	-175.8	-79.3	-63	0	0	0	111.6	Y163 R193 V194 I216 T231	Y163-D211 HydrophobicContact CE2-CB 4.17Å; Y163-D211 PolarHBondContact OH-OD2 3.25Å; R193-D211 CarbonylContact C-O 3.57Å; R193-D211 VanDerWaalsContact CA-O 3.28Å; R193-D211 WeakPolarHBondContact CA-O 3.42Å; R193-D211 WeakPolarHBondContact CB-O 3.21Å; V194-D211 PolarHBondContact N-O 3Å; V194-D211 PolarHBondContact O-N 2.78Å; D211-I216 HydrophobicContact CB-CD1 4.03Å; D211-I216 HydrophobicContact CB-CG1 4.32Å; D211-T231 WeakPolarHBondContact OD1-CA 3.29Å; D211-T231 VanDerWaalsContact OD1-CB 3.24Å; D211-T231 WeakPolarHBondContact OD1-CB 3.42Å; D211-T231 PolarHBondContact OD1-N 3.49Å; D211-T231 PolarHBondContact OD1-OG1 2.81Å
212	N	89.1	Confident	83.8	Confident	47 Å²	47	48.5 Å²	48.5	25%	0.251	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	131.1	-179.6	-171	-41.7	0	0	0	111.5	N192 D214 E215 I216	N192-N212 PolarHBondContact O-OD1 3.45Å; N212-D214 VanDerWaalsContact C-N 3.31Å; N212-D214 PolarHBondContact O-N 2.78Å; N212-D214 PolarHBondContact OD1-N 2.8Å; N212-E215 HydrophobicContact CB-CB 4.21Å; N212-E215 PolarHBondContact O-N 2.74Å; N212-E215 VanDerWaalsContact O-N 3.14Å; N212-I216 WeakPolarHBondContact O-CG1 3.36Å; N212-I216 PolarHBondContact O-N 2.8Å; N212-I216 VanDerWaalsContact O-N 3.1Å
213	V	87.7	Confident	82.7	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-56.3	-42.8	-179.2	175.6	0	0	0	0	112	L154 F187 N192 V194 E215 I216 L217	L154-V213 HydrophobicContact CD2-CG1 4.07Å; F187-V213 HydrophobicContact CD1-CG2 4.37Å; F187-V213 HydrophobicContact CE1-CG2 4.08Å; N192-V213 WeakPolarHBondContact O-CG2 3.46Å; N192-V213 PolarHBondContact O-N 3.06Å; N192-V213 VanDerWaalsContact O-N 3.07Å; V194-V213 HydrophobicContact CG2-CG2 3.7Å; V213-E215 VanDerWaalsContact C-N 3.31Å; V213-E215 PolarHBondContact O-N 3.19Å; V213-I216 PolarHBondContact O-N 2.93Å; V213-L217 HydrophobicContact CG1-CD1 4.25Å; V213-L217 PolarHBondContact O-N 3.38Å; V213-L217 VanDerWaalsContact O-N 3.14Å
214	D	85.4	Confident	81.8	Confident	68 Å²	68	51 Å²	51	36%	0.364	24%	0.239	S	C	.	.	H	α-helix	trans	-68.5	-32.7	-178.1	-70.9	-36.4	0	0	0	112.1	N192 N212 K218	N192-D214 PolarHBondContact ND2-OD2 2.86Å; N212-D214 VanDerWaalsContact C-N 3.31Å; N212-D214 PolarHBondContact O-N 2.78Å; N212-D214 PolarHBondContact OD1-N 2.8Å; D214-K218 WeakPolarHBondContact O-CB 3.06Å; D214-K218 VanDerWaalsContact O-CG 3.24Å; D214-K218 WeakPolarHBondContact O-CG 3.47Å; D214-K218 PolarHBondContact O-N 3.25Å; D214-K218 VanDerWaalsContact O-N 3.08Å
215	E	83.9	Confident	81.1	Confident	19 Å²	19	50.5 Å²	50.5	9%	0.089	25%	0.246	C	C	.	.	H	α-helix	trans	-71.8	-41.1	177.7	-168.9	174.3	-175.1	0	0	110.7	N212 V213 L217 K218 R219 Y228 S229 T230	N212-E215 HydrophobicContact CB-CB 4.21Å; N212-E215 PolarHBondContact O-N 2.74Å; N212-E215 VanDerWaalsContact O-N 3.14Å; V213-E215 VanDerWaalsContact C-N 3.31Å; V213-E215 PolarHBondContact O-N 3.19Å; E215-L217 VanDerWaalsContact C-N 3.31Å; E215-L217 PolarHBondContact O-N 3.15Å; E215-K218 PolarHBondContact O-N 2.81Å; E215-R219 HydrophobicContact CG-CG 4.15Å; E215-R219 WeakPolarHBondContact O-CB 3.19Å; E215-R219 PolarHBondContact O-N 2.74Å; E215-R219 IonicContact OE1-CZ 2.7Å; E215-R219 IonicContact OE1-NE 3.44Å; E215-R219 PolarHBondContact OE1-NE 3.15Å; E215-R219 IonicContact OE1-NH1 2.79Å; E215-R219 PolarHBondContact OE1-NH1 3.48Å; E215-R219 IonicContact OE1-NH2 3.93Å; E215-R219 PolarHBondContact OE1-NH2 3.37Å; E215-Y228 HydrophobicContact CG-CD1 4.26Å; E215-S229 PolarHBondContact OE1-N 3.37Å; E215-S229 PolarHBondContact OE1-OG 3.11Å; E215-T230 WeakPolarHBondContact OE2-CB 3.34Å; E215-T230 PolarHBondContact OE2-N 3.31Å; E215-T230 PolarHBondContact OE2-OG1 3.13Å
216	I	84.2	Confident	80.2	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-58	-44.8	175.5	-64.7	166.3	0	0	0	110.4	L154 V161 Y163 D211 N212 V213 Y228	L154-I216 HydrophobicContact CD2-CB 4.48Å; L154-I216 HydrophobicContact CD2-CG2 4.06Å; V161-I216 HydrophobicContact CG2-CG2 3.9Å; Y163-I216 HydrophobicContact CD1-CD1 4.37Å; Y163-I216 HydrophobicContact CD2-CD1 3.87Å; Y163-I216 HydrophobicContact CD2-CG1 3.98Å; Y163-I216 HydrophobicContact CD2-CG2 4.26Å; Y163-I216 HydrophobicContact CE1-CD1 4.38Å; Y163-I216 HydrophobicContact CE2-CD1 3.9Å; Y163-I216 HydrophobicContact CE2-CG1 4.16Å; Y163-I216 HydrophobicContact CG-CD1 4.13Å; Y163-I216 HydrophobicContact CG-CG2 4.34Å; D211-I216 HydrophobicContact CB-CD1 4.03Å; D211-I216 HydrophobicContact CB-CG1 4.32Å; N212-I216 WeakPolarHBondContact O-CG1 3.36Å; N212-I216 PolarHBondContact O-N 2.8Å; N212-I216 VanDerWaalsContact O-N 3.1Å; V213-I216 PolarHBondContact O-N 2.93Å; I216-Y228 HydrophobicContact CG1-CE1 4.24Å
217	L	83.4	Confident	79.4	Confident	43 Å²	43	56.1 Å²	56.1	23%	0.225	28%	0.282	C	S	.	.	H	α-helix	trans	-70.8	-37.7	179.3	-70.3	168.7	0	0	0	113.4	L154 K156 V161 V213 E215	L154-L217 HydrophobicContact CD2-CD2 4.15Å; L154-L217 HydrophobicContact CD2-CG 4.08Å; K156-L217 HydrophobicContact CD-CD1 3.97Å; V161-L217 HydrophobicContact CG1-CD2 4.05Å; V161-L217 HydrophobicContact CG2-CD2 3.74Å; V213-L217 HydrophobicContact CG1-CD1 4.25Å; V213-L217 PolarHBondContact O-N 3.38Å; V213-L217 VanDerWaalsContact O-N 3.14Å; E215-L217 VanDerWaalsContact C-N 3.31Å; E215-L217 PolarHBondContact O-N 3.15Å
218	K	81.9	Confident	78.9	Confident	172 Å²	172	57.1 Å²	57.1	75%	0.748	29%	0.286	S	S	*	.	H	α-helix	trans	-80.2	-37.3	-175.4	-75.6	172.5	-175.6	167.2	0	113.9	D214 E215	D214-K218 WeakPolarHBondContact O-CB 3.06Å; D214-K218 VanDerWaalsContact O-CG 3.24Å; D214-K218 WeakPolarHBondContact O-CG 3.47Å; D214-K218 PolarHBondContact O-N 3.25Å; D214-K218 VanDerWaalsContact O-N 3.08Å; E215-K218 PolarHBondContact O-N 2.81Å
219	R	73.2	Confident	78	Confident	120 Å²	120	60.9 Å²	60.9	45%	0.453	31%	0.313	S	S	.	.	H	α-helix	trans	-94	1.7	-173.8	-69.3	-165.6	179.4	-179.7	10.7	113.9	E215 N221 S229	E215-R219 HydrophobicContact CG-CG 4.15Å; E215-R219 WeakPolarHBondContact O-CB 3.19Å; E215-R219 PolarHBondContact O-N 2.74Å; E215-R219 IonicContact OE1-CZ 2.7Å; E215-R219 IonicContact OE1-NE 3.44Å; E215-R219 PolarHBondContact OE1-NE 3.15Å; E215-R219 IonicContact OE1-NH1 2.79Å; E215-R219 PolarHBondContact OE1-NH1 3.48Å; E215-R219 IonicContact OE1-NH2 3.93Å; E215-R219 PolarHBondContact OE1-NH2 3.37Å; R219-N221 PolarHBondContact O-N 3.45Å; R219-S229 PolarHBondContact NH1-OG 2.81Å; R219-S229 PolarHBondContact NH2-OG 3.48Å
220	F	69.3	Low	77.5	Confident	78 Å²	78	63.6 Å²	63.6	34%	0.342	33%	0.33	S	S	.	.			trans	-59.5	109.6	174.2	-173.2	-102.8	0	0	0	110	V161 E162	V161-F220 HydrophobicContact CB-CB 4.14Å; V161-F220 HydrophobicContact CB-CD1 4.34Å; V161-F220 HydrophobicContact CB-CD2 3.94Å; V161-F220 HydrophobicContact CB-CG 3.85Å; V161-F220 HydrophobicContact CG1-CB 3.86Å; V161-F220 HydrophobicContact CG1-CD1 4.02Å; V161-F220 HydrophobicContact CG1-CD2 4.42Å; V161-F220 HydrophobicContact CG1-CG 3.82Å; E162-F220 HydrophobicContact CB-CE2 3.82Å; E162-F220 HydrophobicContact CB-CZ 4.34Å; E162-F220 WeakPolarHBondContact O-CD2 3.15Å; E162-F220 WeakPolarHBondContact O-CE2 3.14Å
221	N	62.8	Low	77.1	Confident	89 Å²	89	66.1 Å²	66.1	48%	0.476	35%	0.345	S	S	.	.			trans	-114.2	158.5	171.1	-165.6	14.2	0	0	0	107.9	R219 D223	R219-N221 PolarHBondContact O-N 3.45Å; N221-D223 PolarHBondContact ND2-OD2 3.17Å; N221-D223 PolarHBondContact O-N 2.63Å
222	N	63	Low	77	Confident	136 Å²	136	67.6 Å²	67.6	73%	0.727	35%	0.353	S	S	*	.	S	Bend	trans	-68.4	18.1	174.4	-75.7	-21.5	0	0	0	113.4
223	D	65.7	Low	76.9	Confident	96 Å²	96	67.7 Å²	67.7	51%	0.513	36%	0.357	S	S	.	.			trans	-86.2	139.6	173.5	-68.8	-37.9	0	0	0	109.4	N221 V225	N221-D223 PolarHBondContact ND2-OD2 3.17Å; N221-D223 PolarHBondContact O-N 2.63Å; D223-V225 VanDerWaalsContact C-N 3.32Å; D223-V225 PolarHBondContact O-N 3.09Å
224	Y	69.6	Low	76.9	Confident	80 Å²	80	68.4 Å²	68.4	31%	0.314	36%	0.361	S	S	.	.	S	Bend	trans	-69.6	-27.9	-179.3	-57.3	-75.5	0	0	0	112.3	W138 R167	W138-Y224 AromaticContact CH2-CD1 3.55Å; W138-Y224 HydrophobicContact CH2-CD1 3.55Å; W138-Y224 HydrophobicContact CH2-CD2 4.28Å; W138-Y224 HydrophobicContact CH2-CE1 4.18Å; W138-Y224 AromaticContact CH2-CG 3.6Å; W138-Y224 HydrophobicContact CH2-CG 3.6Å; W138-Y224 HydrophobicContact CZ2-CG 4.42Å; W138-Y224 AromaticContact CZ3-CD1 3.91Å; W138-Y224 HydrophobicContact CZ3-CD1 3.91Å; W138-Y224 HydrophobicContact CZ3-CE1 4.4Å; W138-Y224 HydrophobicContact CZ3-CG 4.4Å; R167-Y224 PolarHBondContact NE-O 3.19Å; R167-Y224 PolarHBondContact NH2-O 3.34Å
225	V	72.8	Confident	76.9	Confident	80 Å²	80	73.9 Å²	73.9	49%	0.485	38%	0.382	S	S	.	.			trans	-116.5	111.9	179.2	-177.1	0	0	0	0	109.7	D223	D223-V225 VanDerWaalsContact C-N 3.32Å; D223-V225 PolarHBondContact O-N 3.09Å
226	T	70.9	Confident	77	Confident	29 Å²	29	76.4 Å²	76.4	18%	0.178	40%	0.402	C	S	.	.			trans	-112	107.8	-179.5	50	0	0	0	0	111	Y228	T226-Y228 PolarHBondContact O-N 3.24Å; T226-Y228 PolarHBondContact OG1-OH 3.17Å
227	P	71.6	Confident	77	Confident	109 Å²	109	78.5 Å²	78.5	71%	0.708	42%	0.419	S	S	*	.			trans	-77.1	122.4	174.6	29.5	-32.1	0	0	0	111.1
228	Y	79.3	Confident	77	Confident	26 Å²	26	78 Å²	78	10%	0.102	43%	0.425	C	S	.	.			trans	-91.4	147.3	171.5	-49.4	-76.4	0	0	0	110.1	Y163 E215 I216 T226 T231	Y163-Y228 AromaticContact CD2-CE2 3.88Å; Y163-Y228 HydrophobicContact CD2-CE2 3.88Å; Y163-Y228 AromaticContact CD2-CZ 3.93Å; Y163-Y228 HydrophobicContact CE2-CD2 4.34Å; Y163-Y228 AromaticContact CE2-CE2 3.71Å; Y163-Y228 HydrophobicContact CE2-CE2 3.71Å; E215-Y228 HydrophobicContact CG-CD1 4.26Å; I216-Y228 HydrophobicContact CG1-CE1 4.24Å; T226-Y228 PolarHBondContact O-N 3.24Å; T226-Y228 PolarHBondContact OG1-OH 3.17Å; Y228-T231 WeakPolarHBondContact CB-OG1 3.33Å; Y228-T231 PolarHBondContact O-OG1 2.96Å
229	S	72.6	Confident	77	Confident	79 Å²	79	73.4 Å²	73.4	55%	0.552	42%	0.419	S	S	*	.	S	Bend	trans	-90.7	-18.7	-175.1	54.1	0	0	0	0	114.2	E215 R219	E215-S229 PolarHBondContact OE1-N 3.37Å; E215-S229 PolarHBondContact OE1-OG 3.11Å; R219-S229 PolarHBondContact NH1-OG 2.81Å; R219-S229 PolarHBondContact NH2-OG 3.48Å
230	T	79.8	Confident	77.3	Confident	63 Å²	63	74.5 Å²	74.5	39%	0.387	43%	0.429	S	S	.	.	S	Bend	trans	-109.1	13.9	-177.5	63.5	0	0	0	0	114	R193 E215 L232	R193-T230 PolarHBondContact NH2-O 2.93Å; E215-T230 WeakPolarHBondContact OE2-CB 3.34Å; E215-T230 PolarHBondContact OE2-N 3.31Å; E215-T230 PolarHBondContact OE2-OG1 3.13Å; T230-L232 PolarHBondContact O-N 3.24Å
231	T	83.7	Confident	77.9	Confident	52 Å²	52	75.9 Å²	75.9	32%	0.319	43%	0.433	S	S	.	.			trans	-60.9	123.5	-178.4	-49.6	0	0	0	0	111.7	I209 D211 Y228	I209-T231 HydrophobicContact CG2-CG2 3.73Å; D211-T231 WeakPolarHBondContact OD1-CA 3.29Å; D211-T231 VanDerWaalsContact OD1-CB 3.24Å; D211-T231 WeakPolarHBondContact OD1-CB 3.42Å; D211-T231 PolarHBondContact OD1-N 3.49Å; D211-T231 PolarHBondContact OD1-OG1 2.81Å; Y228-T231 WeakPolarHBondContact CB-OG1 3.33Å; Y228-T231 PolarHBondContact O-OG1 2.96Å
232	L	86.1	Confident	79	Confident	33 Å²	33	73.9 Å²	73.9	17%	0.173	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	124.2	165.3	-64.9	178.3	0	0	0	107.9	I209 S210 T230 G283 M286	I209-L232 CarbonylContact C-O 3.49Å; I209-L232 WeakPolarHBondContact CA-O 3.2Å; S210-L232 PolarHBondContact N-O 3.08Å; S210-L232 PolarHBondContact O-N 3.1Å; T230-L232 PolarHBondContact O-N 3.24Å; L232-G283 WeakPolarHBondContact CD1-O 3.41Å; L232-M286 HydrophobicContact CB-CB 4.39Å; L232-M286 HydrophobicContact CB-CE 3.73Å; L232-M286 VanDerWaalsContact O-CE 3.28Å; L232-M286 WeakPolarHBondContact O-CE 3.39Å
233	S	87.8	Confident	80.2	Confident	49 Å²	49	70.6 Å²	70.6	34%	0.343	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	145.8	-179.9	66.5	0	0	0	0	112.2	L208	L208-S233 VanDerWaalsContact O-CA 3.23Å; L208-S233 WeakPolarHBondContact O-CA 3.36Å
234	T	87.6	Confident	81.2	Confident	14 Å²	14	66.3 Å²	66.3	9%	0.086	38%	0.382	C	S	.	.			trans	-69.6	150.7	167.9	58.9	0	0	0	0	110.8	Q207 L208 L246 F281 M286	Q207-T234 WeakPolarHBondContact CA-OG1 3.33Å; Q207-T234 WeakPolarHBondContact CG-OG1 2.96Å; Q207-T234 PolarHBondContact NE2-O 3.08Å; Q207-T234 VanDerWaalsContact NE2-O 3.08Å; L208-T234 HydrophobicContact CB-CG2 4.19Å; L208-T234 PolarHBondContact N-OG1 3Å; L208-T234 VanDerWaalsContact N-OG1 3.1Å; L208-T234 PolarHBondContact O-N 3.41Å; L208-T234 VanDerWaalsContact O-N 3.08Å; T234-L246 HydrophobicContact CG2-CD2 4.26Å; T234-F281 HydrophobicContact CG2-CD1 4.34Å; T234-F281 HydrophobicContact CG2-CE1 3.82Å; T234-F281 HydrophobicContact CG2-CZ 3.91Å; T234-M286 HydrophobicContact CG2-CG 3.83Å
235	K	86.5	Confident	82	Confident	184 Å²	184	64.4 Å²	64.4	80%	0.8	37%	0.374	S	S	*	.			trans	-105.8	161.3	-177.2	-62.4	180	-178.2	175.2	0	110.7
236	S	85.5	Confident	82.7	Confident	71 Å²	71	61.5 Å²	61.5	50%	0.497	36%	0.356	S	S	.	.			trans	-56.1	137.1	172.4	-172.6	0	0	0	0	111.3
237	A	84.9	Confident	82.9	Confident	45 Å²	45	60.1 Å²	60.1	37%	0.372	35%	0.347	S	S	.	.			trans	-105.3	-178.7	171.4	0	0	0	0	0	110.9	Q205 Y241	Q205-A237 PolarHBondContact NE2-O 2.92Å; Q205-A237 VanDerWaalsContact NE2-O 3.14Å; A237-Y241 HydrophobicContact CB-CD2 3.62Å; A237-Y241 HydrophobicContact CB-CE2 4.37Å; A237-Y241 HydrophobicContact CB-CG 4.18Å
238	G	82.6	Confident	82.6	Confident	34 Å²	34	58.1 Å²	58.1	35%	0.351	33%	0.326	S	S	.	.			trans	-68.9	158.4	173.3	0	0	0	0	0	112.3	Q240 Y241	G238-Q240 VanDerWaalsContact CA-OE1 3.31Å; G238-Q240 PolarHBondContact O-N 2.83Å; G238-Q240 PolarHBondContact O-OE1 2.8Å; G238-Y241 PolarHBondContact O-N 2.87Å
239	A	82.4	Confident	81.8	Confident	75 Å²	75	59.4 Å²	59.4	62%	0.62	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-57.7	-16.2	-173.1	0	0	0	0	0	115.2	Y241 D242	A239-Y241 PolarHBondContact O-N 3.15Å; A239-D242 WeakPolarHBondContact CA-OD2 3.25Å; A239-D242 WeakPolarHBondContact O-CB 3.14Å; A239-D242 VanDerWaalsContact O-CG 3.23Å; A239-D242 PolarHBondContact O-N 2.84Å
240	Q	79.6	Confident	81.3	Confident	143 Å²	143	56 Å²	56	67%	0.668	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-64.6	-16.8	173.7	69.4	-84.8	15.9	0	0	113.9	G238	G238-Q240 VanDerWaalsContact CA-OE1 3.31Å; G238-Q240 PolarHBondContact O-N 2.83Å; G238-Q240 PolarHBondContact O-OE1 2.8Å
241	Y	81.8	Confident	81	Confident	107 Å²	107	53.6 Å²	53.6	42%	0.42	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-100.1	2.2	178.2	-63.6	-74.7	0	0	0	113	Q205 A237 G238 A239 S244	Q205-Y241 WeakPolarHBondContact CG-O 3.23Å; A237-Y241 HydrophobicContact CB-CD2 3.62Å; A237-Y241 HydrophobicContact CB-CE2 4.37Å; A237-Y241 HydrophobicContact CB-CG 4.18Å; G238-Y241 PolarHBondContact O-N 2.87Å; A239-Y241 PolarHBondContact O-N 3.15Å; Y241-S244 WeakPolarHBondContact O-CB 3.27Å; Y241-S244 PolarHBondContact O-N 2.88Å; Y241-S244 PolarHBondContact O-OG 3.14Å
242	D	86.3	Confident	80.8	Confident	46 Å²	46	52 Å²	52	25%	0.246	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	152.3	175.8	-62.6	-7.5	0	0	0	110.4	Q205 A239 S244	Q205-D242 WeakPolarHBondContact CG-OD1 3.12Å; Q205-D242 PolarHBondContact NE2-OD1 2.86Å; A239-D242 WeakPolarHBondContact CA-OD2 3.25Å; A239-D242 WeakPolarHBondContact O-CB 3.14Å; A239-D242 VanDerWaalsContact O-CG 3.23Å; A239-D242 PolarHBondContact O-N 2.84Å; D242-S244 PolarHBondContact O-N 3.35Å
243	D	87.7	Confident	80.6	Confident	68 Å²	68	51.5 Å²	51.5	36%	0.364	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	21	-177.1	-65	-67.6	0	0	0	116.4	Y203 W204 R270	Y203-D243 PolarHBondContact O-N 3.12Å; Y203-D243 VanDerWaalsContact O-N 3.14Å; W204-D243 CarbonylContact O-C 3.56Å; W204-D243 WeakPolarHBondContact O-CA 3.33Å; W204-D243 PolarHBondContact O-N 2.85Å; D243-R270 WeakPolarHBondContact O-CB 3.3Å
244	S	85.7	Confident	80.3	Confident	5 Å²	5	49.3 Å²	49.3	4%	0.035	27%	0.266	C	S	.	.			trans	-79.4	-27	-179	-68.1	0	0	0	0	114.2	W204 Y241 D242 V268 R270	W204-S244 PolarHBondContact O-N 2.85Å; Y241-S244 WeakPolarHBondContact O-CB 3.27Å; Y241-S244 PolarHBondContact O-N 2.88Å; Y241-S244 PolarHBondContact O-OG 3.14Å; D242-S244 PolarHBondContact O-N 3.35Å; S244-V268 WeakPolarHBondContact O-CG1 3.28Å; S244-R270 PolarHBondContact O-N 2.64Å
245	Y	87.9	Confident	80.2	Confident	41 Å²	41	50 Å²	50	16%	0.161	27%	0.269	C	S	.	.			trans	59.4	47.5	-177.8	-56.5	-30.7	0	0	0	115.1	W204 Q205 G247 R248 R270	W204-Y245 HydrophobicContact CB-CD1 3.86Å; W204-Y245 HydrophobicContact CB-CE1 3.59Å; W204-Y245 AromaticContact CD1-CE1 3.64Å; W204-Y245 HydrophobicContact CG-CD1 4.43Å; W204-Y245 AromaticContact CG-CE1 3.82Å; W204-Y245 HydrophobicContact CG-CE1 3.82Å; W204-Y245 PolarHBondContact O-N 2.86Å; Q205-Y245 PolarHBondContact O-N 3.42Å; Y245-G247 PolarHBondContact O-N 3.2Å; Y245-R248 WeakPolarHBondContact O-CB 3.36Å; Y245-R248 PolarHBondContact O-N 2.8Å; Y245-R270 HydrophobicContact CD2-CB 4.36Å; Y245-R270 VanDerWaalsContact CD2-CD 3.49Å; Y245-R270 HydrophobicContact CD2-CG 3.91Å; Y245-R270 HydrophobicContact CE2-CG 4.12Å; Y245-R270 PolarHBondContact OH-NH1 3Å; Y245-R270 VanDerWaalsContact OH-NH1 3.13Å
246	L	86.1	Confident	80.1	Confident	18 Å²	18	41.3 Å²	41.3	9%	0.094	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-57.5	133.8	171	177.7	73.8	0	0	0	111.2	P199 Q205 G206 Q207 T234 R248 T266 V268 F281	P199-L246 WeakPolarHBondContact CA-O 3.28Å; Q205-L246 WeakPolarHBondContact O-CB 3.26Å; Q205-L246 PolarHBondContact O-N 2.99Å; G206-L246 CarbonylContact C-O 3.53Å; G206-L246 VanDerWaalsContact CA-O 3.31Å; G206-L246 WeakPolarHBondContact CA-O 3.4Å; Q207-L246 PolarHBondContact N-O 3.18Å; T234-L246 HydrophobicContact CG2-CD2 4.26Å; L246-R248 VanDerWaalsContact C-N 3.28Å; L246-R248 PolarHBondContact O-N 2.91Å; L246-T266 HydrophobicContact CD1-CG2 3.41Å; L246-T266 VanDerWaalsContact CD1-CG2 3.41Å; L246-T266 HydrophobicContact CG-CG2 4.49Å; L246-V268 HydrophobicContact CB-CG2 4.32Å; L246-V268 HydrophobicContact CD1-CG2 3.43Å; L246-V268 VanDerWaalsContact CD1-CG2 3.43Å; L246-F281 HydrophobicContact CD1-CE2 4.07Å; L246-F281 HydrophobicContact CD1-CZ 4.33Å; L246-F281 HydrophobicContact CD2-CZ 4.44Å
247	G	74.6	Confident	79.8	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	24.8	178.5	0	0	0	0	0	113	S184 G197 Y245 T266	S184-G247 PolarHBondContact OG-O 3.29Å; G197-G247 CarbonylContact C-O 3.54Å; G197-G247 VanDerWaalsContact C-O 3.28Å; G197-G247 WeakPolarHBondContact CA-O 3.3Å; Y245-G247 PolarHBondContact O-N 3.2Å; G247-T266 WeakPolarHBondContact CA-OG1 3.19Å; G247-T266 PolarHBondContact N-OG1 2.89Å; G247-T266 VanDerWaalsContact N-OG1 3.12Å
248	R	66.1	Low	79.5	Confident	68 Å²	68	44.2 Å²	44.2	26%	0.257	23%	0.231	S	C	.	.	S	Bend	trans	-69.9	-77.5	175.3	-168.6	167.8	175.1	-170.7	-4.1	110.8	F183 S184 P199 Y245 L246	F183-R248 HydrophobicContact CD1-CG 4.05Å; F183-R248 WeakPolarHBondContact CD1-O 3.44Å; F183-R248 HydrophobicContact CE1-CG 3.8Å; F183-R248 HydrophobicContact CE2-CG 4.44Å; F183-R248 HydrophobicContact CG-CG 4.43Å; F183-R248 HydrophobicContact CZ-CG 4.02Å; S184-R248 WeakPolarHBondContact CB-O 3.15Å; S184-R248 PolarHBondContact OG-O 3.24Å; P199-R248 HydrophobicContact CB-CB 3.68Å; P199-R248 HydrophobicContact CB-CG 3.94Å; P199-R248 HydrophobicContact CG-CB 4.22Å; P199-R248 HydrophobicContact CG-CG 4.08Å; Y245-R248 WeakPolarHBondContact O-CB 3.36Å; Y245-R248 PolarHBondContact O-N 2.8Å; L246-R248 VanDerWaalsContact C-N 3.28Å; L246-R248 PolarHBondContact O-N 2.91Å
249	Y	61.7	Low	79.3	Confident	53 Å²	53	46 Å²	46	21%	0.208	23%	0.233	C	C	.	.	S	Bend	trans	-108.6	-22.9	-155.8	-152.5	-77.3	0	0	0	113.9	F183 Y303 Y432	F183-Y249 AromaticContact CE1-CD2 3.61Å; F183-Y249 HydrophobicContact CE1-CD2 3.61Å; F183-Y249 HydrophobicContact CE1-CE2 4.06Å; F183-Y249 HydrophobicContact CE1-CG 4.41Å; F183-Y249 HydrophobicContact CZ-CD2 4.32Å; Y249-Y303 WeakPolarHBondContact CB-O 3.44Å; Y249-Y303 HydrophobicContact CD1-CD1 4.17Å; Y249-Y303 AromaticContact CD1-CE1 3.91Å; Y249-Y303 HydrophobicContact CD1-CE1 3.91Å; Y249-Y303 HydrophobicContact CD1-CE2 4.42Å; Y249-Y303 WeakPolarHBondContact CD1-O 3.32Å; Y249-Y303 HydrophobicContact CD2-CD2 4.35Å; Y249-Y303 AromaticContact CD2-CE2 3.76Å; Y249-Y303 HydrophobicContact CD2-CE2 3.76Å; Y249-Y303 AromaticContact CD2-CZ 3.87Å; Y249-Y303 HydrophobicContact CE1-CD1 4.27Å; Y249-Y303 AromaticContact CE1-CE1 3.58Å; Y249-Y303 HydrophobicContact CE1-CE1 3.58Å; Y249-Y303 HydrophobicContact CE1-CE2 4.47Å; Y249-Y303 AromaticContact CE1-CZ 3.71Å; Y249-Y303 HydrophobicContact CE2-CE1 4.29Å; Y249-Y303 AromaticContact CE2-CE2 3.84Å; Y249-Y303 HydrophobicContact CE2-CE2 3.84Å; Y249-Y303 AromaticContact CE2-CZ 3.53Å; Y249-Y303 WeakPolarHBondContact CE2-OH 3.43Å; Y249-Y303 HydrophobicContact CG-CD2 4.31Å; Y249-Y303 HydrophobicContact CG-CE1 4.4Å; Y249-Y303 HydrophobicContact CG-CE2 4.1Å; Y249-Y303 AromaticContact CZ-CE1 3.81Å; Y249-Y303 AromaticContact CZ-CZ 3.45Å; Y249-Y303 VanDerWaalsContact CZ-CZ 3.45Å; Y249-Y303 PolarHBondContact OH-OH 3.29Å; Y249-Y303 VanDerWaalsContact OH-OH 3.12Å; Y249-Y432 WeakPolarHBondContact OH-CE1 3.45Å; Y249-Y432 PolarHBondContact OH-OH 2.97Å
250	S	62.3	Low	79.1	Confident	8 Å²	8	44.4 Å²	44.4	6%	0.056	22%	0.223	C	C	.	.			trans	-145.4	106	-171.8	60.1	0	0	0	0	110.8	T266 G267 V305	S250-T266 WeakPolarHBondContact O-CA 3.37Å; S250-G267 PolarHBondContact O-N 3.35Å; S250-V305 VanDerWaalsContact CB-CG2 3.44Å; S250-V305 WeakPolarHBondContact O-CG2 3.37Å; S250-V305 WeakPolarHBondContact OG-CG2 3.35Å; S250-V305 PolarHBondContact OG-N 2.92Å
251	V	74.8	Confident	79.2	Confident	12 Å²	12	42.7 Å²	42.7	7%	0.073	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	126.6	163.2	179.8	0	0	0	0	105.7	S184 V195 L208 V265	S184-V251 WeakPolarHBondContact OG-CG2 3.09Å; V195-V251 HydrophobicContact CB-CG1 4.3Å; V195-V251 HydrophobicContact CG1-CG1 3.46Å; V195-V251 VanDerWaalsContact CG1-CG1 3.46Å; V195-V251 HydrophobicContact CG2-CG1 3.85Å; L208-V251 HydrophobicContact CD2-CG1 4.41Å; L208-V251 HydrophobicContact CD2-CG2 3.49Å; L208-V251 VanDerWaalsContact CD2-CG2 3.49Å; V251-V265 WeakPolarHBondContact CA-O 3.47Å
252	T	78.1	Confident	79.4	Confident	18 Å²	18	38.9 Å²	38.9	11%	0.11	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	156.6	170.2	-171.7	0	0	0	0	107.8	V265 V305 A307	T252-V265 HydrophobicContact CG2-CB 3.68Å; T252-V265 HydrophobicContact CG2-CG1 4.27Å; T252-V265 HydrophobicContact CG2-CG2 4.16Å; T252-V265 PolarHBondContact N-O 2.87Å; T252-V265 VanDerWaalsContact N-O 3.11Å; T252-V265 PolarHBondContact O-N 2.85Å; T252-V305 HydrophobicContact CG2-CB 4.32Å; T252-V305 HydrophobicContact CG2-CG2 3.6Å; T252-A307 HydrophobicContact CG2-CB 3.71Å; T252-A307 PolarHBondContact OG1-N 3.04Å
253	V	82.7	Confident	79.5	Confident	22 Å²	22	36.7 Å²	36.7	13%	0.133	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	145.4	179.9	-61.1	0	0	0	0	109.9	V188 V195 E262 D263 Y264	V188-V253 HydrophobicContact CG2-CG1 3.94Å; V195-V253 HydrophobicContact CG1-CG1 4.26Å; V253-E262 HydrophobicContact CB-CB 4.21Å; V253-D263 WeakPolarHBondContact CA-O 3.41Å; V253-Y264 HydrophobicContact CG1-CD1 4.43Å
254	G	82.2	Confident	79.7	Confident	4 Å²	4	33.5 Å²	33.5	4%	0.041	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.4	149.7	179.3	0	0	0	0	0	111	F256 D263	G254-F256 WeakPolarHBondContact O-CD2 3.38Å; G254-D263 PolarHBondContact N-O 3.25Å; G254-D263 VanDerWaalsContact N-O 3.1Å; G254-D263 WeakPolarHBondContact O-CA 3.43Å; G254-D263 VanDerWaalsContact O-CB 3.32Å; G254-D263 WeakPolarHBondContact O-CB 3.45Å; G254-D263 PolarHBondContact O-N 2.91Å
255	D	85.3	Confident	79.9	Confident	29 Å²	29	33.3 Å²	33.3	16%	0.155	17%	0.169	C	C	.	.			trans	-95.5	108.2	179.2	-174.2	-13.8	0	0	0	108.6	K190 N257 E258 G260	K190-D255 IonicContact NZ-OD2 3.64Å; K190-D255 PolarHBondContact NZ-OD2 3.35Å; D255-N257 PolarHBondContact OD1-OD1 2.95Å; D255-E258 VanDerWaalsContact OD1-CA 3.25Å; D255-E258 WeakPolarHBondContact OD1-CA 3.33Å; D255-E258 PolarHBondContact OD1-N 3.27Å; D255-G260 WeakPolarHBondContact OD2-CA 3.34Å; D255-G260 PolarHBondContact OD2-N 3.2Å
256	F	83.8	Confident	80	Confident	1 Å²	1	31.3 Å²	31.3	0%	0.004	16%	0.161	C	C	.	.	S	Bend	trans	-107	-13.8	-177.6	-59.9	-81.2	0	0	0	113.2	G254 D263 V265 I280 A307 V316 V318 G348 F349 F351	G254-F256 WeakPolarHBondContact O-CD2 3.38Å; F256-D263 HydrophobicContact CD2-CB 3.95Å; F256-D263 PolarHBondContact N-OD2 2.8Å; F256-V265 HydrophobicContact CE2-CG2 3.38Å; F256-V265 HydrophobicContact CZ-CG2 3.65Å; F256-I280 HydrophobicContact CD1-CD1 4.42Å; F256-I280 HydrophobicContact CD2-CD1 4.22Å; F256-I280 HydrophobicContact CD2-CG2 3.93Å; F256-I280 HydrophobicContact CE1-CD1 4.38Å; F256-I280 HydrophobicContact CE2-CD1 4.19Å; F256-I280 HydrophobicContact CE2-CG2 4.27Å; F256-I280 HydrophobicContact CG-CD1 4.35Å; F256-I280 HydrophobicContact CZ-CD1 4.27Å; F256-A307 HydrophobicContact CZ-CB 4.48Å; F256-V316 HydrophobicContact CD1-CB 4.48Å; F256-V316 HydrophobicContact CE1-CB 4.08Å; F256-V316 HydrophobicContact CE1-CG1 4.09Å; F256-V316 VanDerWaalsContact CE1-O 3.25Å; F256-V316 WeakPolarHBondContact CE1-O 3.45Å; F256-V316 HydrophobicContact CZ-CG1 4.15Å; F256-V318 HydrophobicContact CD1-CG2 4.45Å; F256-V318 HydrophobicContact CE1-CG2 3.35Å; F256-V318 HydrophobicContact CZ-CG2 3.54Å; F256-G348 PolarHBondContact O-N 2.91Å; F256-F349 HydrophobicContact CB-CD1 3.79Å; F256-F349 HydrophobicContact CB-CE1 3.72Å; F256-F351 HydrophobicContact CD1-CE1 4.36Å; F256-F351 AromaticContact CD1-CZ 3.98Å; F256-F351 HydrophobicContact CD1-CZ 3.98Å; F256-F351 HydrophobicContact CE1-CE1 4.46Å; F256-F351 HydrophobicContact CE1-CZ 4.32Å
257	N	80.1	Confident	80.3	Confident	38 Å²	38	30.5 Å²	30.5	20%	0.203	16%	0.157	C	C	.	.	S	Bend	trans	-111.2	-1.9	-175.4	69.3	4.3	0	0	0	113.8	D255 D259 F349	D255-N257 PolarHBondContact OD1-OD1 2.95Å; N257-D259 VanDerWaalsContact CG-CG 3.47Å; N257-D259 PolarHBondContact ND2-OD2 3.07Å; N257-D259 PolarHBondContact O-N 3.04Å; N257-D259 WeakPolarHBondContact OD1-CB 3.3Å; N257-D259 PolarHBondContact OD1-N 2.78Å; N257-D259 PolarHBondContact OD1-OD1 2.88Å; N257-D259 VanDerWaalsContact OD1-OD1 3.07Å; N257-F349 HydrophobicContact CB-CE2 3.63Å; N257-F349 HydrophobicContact CB-CZ 3.65Å
258	E	77.4	Confident	81.1	Confident	138 Å²	138	30.5 Å²	30.5	65%	0.645	16%	0.157	S	C	*	.	S	Bend	trans	58.3	22.3	-178	-55.3	-173.3	144	0	0	114	D255 G260 F315	D255-E258 VanDerWaalsContact OD1-CA 3.25Å; D255-E258 WeakPolarHBondContact OD1-CA 3.33Å; D255-E258 PolarHBondContact OD1-N 3.27Å; E258-G260 PolarHBondContact O-N 3.21Å; E258-F315 HydrophobicContact CG-CE1 4.3Å; E258-F315 WeakPolarHBondContact OE1-CE1 3.04Å
259	D	79.7	Confident	82.1	Confident	73 Å²	73	27.4 Å²	27.4	39%	0.39	15%	0.146	S	C	.	.	S	Bend	trans	-79.5	-3.3	177.3	79.8	3.8	0	0	0	112.7	N257 K261	N257-D259 VanDerWaalsContact CG-CG 3.47Å; N257-D259 PolarHBondContact ND2-OD2 3.07Å; N257-D259 PolarHBondContact O-N 3.04Å; N257-D259 WeakPolarHBondContact OD1-CB 3.3Å; N257-D259 PolarHBondContact OD1-N 2.78Å; N257-D259 PolarHBondContact OD1-OD1 2.88Å; N257-D259 VanDerWaalsContact OD1-OD1 3.07Å; D259-K261 PolarHBondContact O-N 3.22Å; D259-K261 VanDerWaalsContact OD1-CA 3.31Å; D259-K261 WeakPolarHBondContact OD1-CA 3Å; D259-K261 WeakPolarHBondContact OD1-CB 3.19Å; D259-K261 PolarHBondContact OD1-N 2.76Å
260	G	77.5	Confident	83.4	Confident	41 Å²	41	29.3 Å²	29.3	42%	0.423	15%	0.153	S	C	.	.	S	Bend	trans	81.4	-3.7	-179.2	0	0	0	0	0	114.1	D255 E258	D255-G260 WeakPolarHBondContact OD2-CA 3.34Å; D255-G260 PolarHBondContact OD2-N 3.2Å; E258-G260 PolarHBondContact O-N 3.21Å
261	K	81.3	Confident	84.4	Confident	106 Å²	106	28.9 Å²	28.9	46%	0.461	15%	0.15	S	C	.	.	S	Bend	trans	-98.8	141.5	169.1	-58.7	175.4	-179.3	171.9	0	108.7	D259 A284	D259-K261 PolarHBondContact O-N 3.22Å; D259-K261 VanDerWaalsContact OD1-CA 3.31Å; D259-K261 WeakPolarHBondContact OD1-CA 3Å; D259-K261 WeakPolarHBondContact OD1-CB 3.19Å; D259-K261 PolarHBondContact OD1-N 2.76Å; K261-A284 HydrophobicContact CD-CB 4.28Å
262	E	85.8	Confident	84.9	Confident	28 Å²	28	32.2 Å²	32.2	13%	0.131	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-81	132.2	176.6	-63.1	165.7	143.5	0	0	109.1	V188 K189 K190 V253 G283	V188-E262 HydrophobicContact CG1-CB 3.74Å; V188-E262 HydrophobicContact CG1-CG 4.42Å; V188-E262 WeakPolarHBondContact CG1-OE2 3.49Å; K189-E262 PolarHBondContact N-OE2 2.81Å; K189-E262 VanDerWaalsContact N-OE2 3.15Å; K190-E262 HydrophobicContact CB-CG 4.37Å; K190-E262 HydrophobicContact CD-CG 4.05Å; K190-E262 HydrophobicContact CG-CG 4.27Å; K190-E262 PolarHBondContact N-OE2 3.25Å; V253-E262 HydrophobicContact CB-CB 4.21Å; E262-G283 WeakPolarHBondContact O-CA 3.47Å
263	D	89.7	Confident	85.2	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	161.4	173.4	-61.4	-49.4	0	0	0	111	V253 G254 F256 I280 F281 N282 G283	V253-D263 WeakPolarHBondContact CA-O 3.41Å; G254-D263 PolarHBondContact N-O 3.25Å; G254-D263 VanDerWaalsContact N-O 3.1Å; G254-D263 WeakPolarHBondContact O-CA 3.43Å; G254-D263 VanDerWaalsContact O-CB 3.32Å; G254-D263 WeakPolarHBondContact O-CB 3.45Å; G254-D263 PolarHBondContact O-N 2.91Å; F256-D263 HydrophobicContact CD2-CB 3.95Å; F256-D263 PolarHBondContact N-OD2 2.8Å; D263-I280 HydrophobicContact CB-CG2 4.19Å; D263-F281 WeakPolarHBondContact CB-O 3.3Å; D263-N282 VanDerWaalsContact OD1-CA 3.31Å; D263-N282 WeakPolarHBondContact OD1-CA 3.23Å; D263-G283 PolarHBondContact OD1-N 2.89Å
264	Y	89.9	Confident	85.3	Confident	1 Å²	1	39.9 Å²	39.9	0%	0.004	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	125.6	-178.1	-46.6	-77	0	0	0	110.9	V188 V195 S210 V253 I280 F281 M286	V188-Y264 HydrophobicContact CG2-CE1 3.78Å; V195-Y264 HydrophobicContact CB-CD1 4.02Å; V195-Y264 HydrophobicContact CB-CE1 3.98Å; V195-Y264 HydrophobicContact CG1-CD1 4.26Å; V195-Y264 HydrophobicContact CG1-CE1 4.48Å; V195-Y264 HydrophobicContact CG2-CD1 3.86Å; V195-Y264 HydrophobicContact CG2-CE1 4.15Å; S210-Y264 WeakPolarHBondContact CB-OH 3.22Å; S210-Y264 PolarHBondContact OG-OH 3.08Å; V253-Y264 HydrophobicContact CG1-CD1 4.43Å; Y264-I280 CarbonylContact O-C 3.57Å; Y264-I280 WeakPolarHBondContact O-CA 3.22Å; Y264-F281 HydrophobicContact CD2-CB 4.27Å; Y264-F281 PolarHBondContact N-O 3.09Å; Y264-F281 PolarHBondContact O-N 2.83Å; Y264-M286 HydrophobicContact CD2-CE 4.13Å; Y264-M286 HydrophobicContact CD2-SD 3.48Å; Y264-M286 WeakPolarHBondContact CD2-SD 3.48Å; Y264-M286 HydrophobicContact CE2-CE 3.9Å; Y264-M286 HydrophobicContact CE2-SD 3.75Å; Y264-M286 HydrophobicContact CG-SD 4.29Å
265	V	90.9	Very high	85.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	128.6	172.6	-173.1	0	0	0	0	108.8	V251 T252 F256 V278 I280 V305 V318	V251-V265 WeakPolarHBondContact CA-O 3.47Å; T252-V265 HydrophobicContact CG2-CB 3.68Å; T252-V265 HydrophobicContact CG2-CG1 4.27Å; T252-V265 HydrophobicContact CG2-CG2 4.16Å; T252-V265 PolarHBondContact N-O 2.87Å; T252-V265 VanDerWaalsContact N-O 3.11Å; T252-V265 PolarHBondContact O-N 2.85Å; F256-V265 HydrophobicContact CE2-CG2 3.38Å; F256-V265 HydrophobicContact CZ-CG2 3.65Å; V265-V278 HydrophobicContact CG1-CG1 3.51Å; V265-I280 HydrophobicContact CG1-CG1 4.3Å; V265-I280 HydrophobicContact CG2-CD1 4.41Å; V265-I280 HydrophobicContact CG2-CG1 4.09Å; V265-I280 HydrophobicContact CG2-CG2 4.48Å; V265-V305 HydrophobicContact CG1-CG2 4.24Å; V265-V318 HydrophobicContact CG1-CG1 4.27Å
266	T	90.9	Very high	85.8	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	139.6	179.2	177.7	0	0	0	0	112.9	L208 L246 G247 S250 V278 N279 F281	L208-T266 HydrophobicContact CD1-CG2 3.53Å; L208-T266 HydrophobicContact CG-CG2 4.37Å; L246-T266 HydrophobicContact CD1-CG2 3.41Å; L246-T266 VanDerWaalsContact CD1-CG2 3.41Å; L246-T266 HydrophobicContact CG-CG2 4.49Å; G247-T266 WeakPolarHBondContact CA-OG1 3.19Å; G247-T266 PolarHBondContact N-OG1 2.89Å; G247-T266 VanDerWaalsContact N-OG1 3.12Å; S250-T266 WeakPolarHBondContact O-CA 3.37Å; T266-V278 CarbonylContact O-C 3.24Å; T266-V278 WeakPolarHBondContact O-CA 3.39Å; T266-V278 WeakPolarHBondContact O-CG1 3.2Å; T266-N279 HydrophobicContact CG2-CB 4.33Å; T266-N279 PolarHBondContact N-O 2.79Å; T266-N279 PolarHBondContact O-N 2.94Å; T266-F281 HydrophobicContact CG2-CD2 3.85Å; T266-F281 HydrophobicContact CG2-CE2 3.46Å; T266-F281 VanDerWaalsContact CG2-CE2 3.46Å
267	G	90.4	Very high	86.2	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	144.8	169.7	0	0	0	0	0	113.2	S250 G302	S250-G267 PolarHBondContact O-N 3.35Å; G267-G302 WeakPolarHBondContact CA-O 3.24Å
268	V	91.6	Very high	86.7	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	73.3	177.6	-165.9	0	0	0	0	108.3	S244 L246 R270 G271 G276 Y277	S244-V268 WeakPolarHBondContact O-CG1 3.28Å; L246-V268 HydrophobicContact CB-CG2 4.32Å; L246-V268 HydrophobicContact CD1-CG2 3.43Å; L246-V268 VanDerWaalsContact CD1-CG2 3.43Å; V268-R270 VanDerWaalsContact C-N 3.25Å; V268-R270 PolarHBondContact O-N 2.93Å; V268-R270 VanDerWaalsContact O-N 3.14Å; V268-G271 PolarHBondContact O-N 3.04Å; V268-G271 VanDerWaalsContact O-N 3.13Å; V268-G276 VanDerWaalsContact O-CA 3.3Å; V268-G276 WeakPolarHBondContact O-CA 3.3Å; V268-Y277 CarbonylContact C-O 3.44Å; V268-Y277 VanDerWaalsContact CA-O 3.29Å; V268-Y277 WeakPolarHBondContact CA-O 3.45Å; V268-Y277 HydrophobicContact CB-CD1 4.18Å; V268-Y277 HydrophobicContact CB-CD2 3.97Å; V268-Y277 HydrophobicContact CB-CE1 4.01Å; V268-Y277 HydrophobicContact CB-CE2 3.78Å; V268-Y277 HydrophobicContact CB-CG 4.15Å; V268-Y277 VanDerWaalsContact CB-O 3.29Å; V268-Y277 WeakPolarHBondContact CB-O 3.36Å; V268-Y277 HydrophobicContact CG1-CD1 4.32Å; V268-Y277 HydrophobicContact CG1-CE1 3.75Å; V268-Y277 HydrophobicContact CG1-CE2 4.14Å; V268-Y277 HydrophobicContact CG2-CD2 3.93Å; V268-Y277 HydrophobicContact CG2-CE2 3.52Å; V268-Y277 PolarHBondContact N-O 2.98Å; V268-Y277 PolarHBondContact O-N 2.7Å
269	P	88.3	Confident	87.4	Confident	3 Å²	3	33.7 Å²	33.7	2%	0.019	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-19.1	-163.8	25.7	-35.3	0	0	0	115.1	G276 Y300 F301	P269-G276 WeakPolarHBondContact O-CA 3.22Å; P269-Y300 HydrophobicContact CB-CD1 3.78Å; P269-Y300 HydrophobicContact CB-CE1 4.34Å; P269-Y300 HydrophobicContact CB-CG 4.27Å; P269-Y300 HydrophobicContact CG-CD1 4.37Å; P269-F301 WeakPolarHBondContact CA-O 3.37Å
270	R	87.8	Confident	87.9	Confident	92 Å²	92	30.2 Å²	30.2	35%	0.347	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	0.4	177.5	-71.6	-168.8	73.3	-168.2	-4.9	113.9	D243 S244 Y245 V268 A274	D243-R270 WeakPolarHBondContact O-CB 3.3Å; S244-R270 PolarHBondContact O-N 2.64Å; Y245-R270 HydrophobicContact CD2-CB 4.36Å; Y245-R270 VanDerWaalsContact CD2-CD 3.49Å; Y245-R270 HydrophobicContact CD2-CG 3.91Å; Y245-R270 HydrophobicContact CE2-CG 4.12Å; Y245-R270 PolarHBondContact OH-NH1 3Å; Y245-R270 VanDerWaalsContact OH-NH1 3.13Å; V268-R270 VanDerWaalsContact C-N 3.25Å; V268-R270 PolarHBondContact O-N 2.93Å; V268-R270 VanDerWaalsContact O-N 3.14Å; R270-A274 WeakPolarHBondContact O-CA 3.18Å; R270-A274 PolarHBondContact O-N 3.3Å
271	G	83.7	Confident	88.4	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61	157.7	178.1	0	0	0	0	0	113.2	V268 A274 L275 G276 Y277	V268-G271 PolarHBondContact O-N 3.04Å; V268-G271 VanDerWaalsContact O-N 3.13Å; G271-A274 PolarHBondContact O-N 2.75Å; G271-L275 PolarHBondContact O-N 3.15Å; G271-G276 PolarHBondContact O-N 3.4Å; G271-Y277 VanDerWaalsContact CA-CE1 3.47Å
272	D	85.6	Confident	88.8	Confident	82 Å²	82	25.1 Å²	25.1	44%	0.439	12%	0.12	S	C	.	.	H	α-helix	trans	48.6	61.2	179.5	-165.5	26.2	0	0	0	113.2	A274 L275 Y277	D272-A274 VanDerWaalsContact C-N 3.32Å; D272-A274 PolarHBondContact O-N 2.93Å; D272-L275 WeakPolarHBondContact O-CB 3.26Å; D272-L275 WeakPolarHBondContact O-CG 3.02Å; D272-L275 PolarHBondContact O-N 3.24Å; D272-Y277 HydrophobicContact CB-CD1 4.39Å
273	K	85.2	Confident	88.6	Confident	172 Å²	172	24 Å²	24	75%	0.748	12%	0.116	S	C	*	.	H	α-helix	trans	58.8	39.2	-179.4	-52.4	170.6	-174.4	166.4	0	113.1	L275 M297	K273-L275 VanDerWaalsContact C-N 3.26Å; K273-L275 PolarHBondContact O-N 3.18Å; K273-M297 HydrophobicContact CB-CE 4.22Å; K273-M297 WeakPolarHBondContact O-CE 3.13Å
274	A	85.3	Confident	88.3	Confident	28 Å²	28	26.1 Å²	26.1	23%	0.231	13%	0.134	C	C	.	.	H	α-helix	trans	64.7	18.6	-178	0	0	0	0	0	115.9	R270 G271 D272 M297 A298	R270-A274 WeakPolarHBondContact O-CA 3.18Å; R270-A274 PolarHBondContact O-N 3.3Å; G271-A274 PolarHBondContact O-N 2.75Å; D272-A274 VanDerWaalsContact C-N 3.32Å; D272-A274 PolarHBondContact O-N 2.93Å; A274-M297 CarbonylContact O-C 3.53Å; A274-M297 WeakPolarHBondContact O-CA 3.38Å; A274-A298 PolarHBondContact O-N 2.96Å
275	L	87.9	Confident	88	Confident	42 Å²	42	30 Å²	30	22%	0.22	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-34.1	161	-73.8	168.5	0	0	0	110.9	G271 D272 K273 M297	G271-L275 PolarHBondContact O-N 3.15Å; D272-L275 WeakPolarHBondContact O-CB 3.26Å; D272-L275 WeakPolarHBondContact O-CG 3.02Å; D272-L275 PolarHBondContact O-N 3.24Å; K273-L275 VanDerWaalsContact C-N 3.26Å; K273-L275 PolarHBondContact O-N 3.18Å; L275-M297 HydrophobicContact CD2-CB 4.44Å; L275-M297 HydrophobicContact CD2-CG 3.55Å; L275-M297 HydrophobicContact CG-CG 3.93Å
276	G	89.8	Confident	87.7	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.158	C	C	.	.			trans	78.4	141.7	-174.1	0	0	0	0	0	111.1	V268 P269 G271 G294	V268-G276 VanDerWaalsContact O-CA 3.3Å; V268-G276 WeakPolarHBondContact O-CA 3.3Å; P269-G276 WeakPolarHBondContact O-CA 3.22Å; G271-G276 PolarHBondContact O-N 3.4Å; G276-G294 PolarHBondContact O-N 2.7Å
277	Y	90.7	Very high	87.6	Confident	29 Å²	29	36.1 Å²	36.1	11%	0.114	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	161.9	173.1	66.8	-94.6	0	0	0	111.7	V268 G271 D272 N279 F292	V268-Y277 CarbonylContact C-O 3.44Å; V268-Y277 VanDerWaalsContact CA-O 3.29Å; V268-Y277 WeakPolarHBondContact CA-O 3.45Å; V268-Y277 HydrophobicContact CB-CD1 4.18Å; V268-Y277 HydrophobicContact CB-CD2 3.97Å; V268-Y277 HydrophobicContact CB-CE1 4.01Å; V268-Y277 HydrophobicContact CB-CE2 3.78Å; V268-Y277 HydrophobicContact CB-CG 4.15Å; V268-Y277 VanDerWaalsContact CB-O 3.29Å; V268-Y277 WeakPolarHBondContact CB-O 3.36Å; V268-Y277 HydrophobicContact CG1-CD1 4.32Å; V268-Y277 HydrophobicContact CG1-CE1 3.75Å; V268-Y277 HydrophobicContact CG1-CE2 4.14Å; V268-Y277 HydrophobicContact CG2-CD2 3.93Å; V268-Y277 HydrophobicContact CG2-CE2 3.52Å; V268-Y277 PolarHBondContact N-O 2.98Å; V268-Y277 PolarHBondContact O-N 2.7Å; G271-Y277 VanDerWaalsContact CA-CE1 3.47Å; D272-Y277 HydrophobicContact CB-CD1 4.39Å; Y277-N279 HydrophobicContact CD2-CB 4.39Å; Y277-N279 HydrophobicContact CE2-CB 4.22Å; Y277-F292 CarbonylContact C-O 3.57Å; Y277-F292 WeakPolarHBondContact CA-O 3.5Å; Y277-F292 WeakPolarHBondContact CB-O 3.47Å
278	V	92	Very high	87.4	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.5	172.4	174.3	0	0	0	0	108.1	V265 T266 N291 F292 F301 V305 I320	V265-V278 HydrophobicContact CG1-CG1 3.51Å; T266-V278 CarbonylContact O-C 3.24Å; T266-V278 WeakPolarHBondContact O-CA 3.39Å; T266-V278 WeakPolarHBondContact O-CG1 3.2Å; V278-N291 CarbonylContact O-C 3.54Å; V278-N291 WeakPolarHBondContact O-CA 3.17Å; V278-F292 HydrophobicContact CB-CB 4.36Å; V278-F292 HydrophobicContact CB-CD2 4.13Å; V278-F292 HydrophobicContact CG1-CD2 4.22Å; V278-F292 PolarHBondContact N-O 3.09Å; V278-F292 PolarHBondContact O-N 3.21Å; V278-F301 HydrophobicContact CG2-CD1 4.43Å; V278-F301 HydrophobicContact CG2-CE1 4.07Å; V278-V305 HydrophobicContact CG1-CG1 4Å; V278-V305 HydrophobicContact CG2-CG1 3.82Å; V278-I320 HydrophobicContact CB-CD1 3.65Å; V278-I320 HydrophobicContact CB-CG1 4.38Å; V278-I320 HydrophobicContact CG1-CD1 4.01Å; V278-I320 HydrophobicContact CG1-CG1 4.47Å; V278-I320 HydrophobicContact CG2-CB 4.35Å; V278-I320 HydrophobicContact CG2-CD1 3.57Å; V278-I320 HydrophobicContact CG2-CG1 3.9Å; V278-I320 HydrophobicContact CG2-CG2 3.53Å
279	N	90.6	Very high	87.2	Confident	10 Å²	10	42.2 Å²	42.2	5%	0.053	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	137.5	-178.2	-163.4	-8.8	0	0	0	110.4	T266 Y277 F281 S288 I290 N291	T266-N279 HydrophobicContact CG2-CB 4.33Å; T266-N279 PolarHBondContact N-O 2.79Å; T266-N279 PolarHBondContact O-N 2.94Å; Y277-N279 HydrophobicContact CD2-CB 4.39Å; Y277-N279 HydrophobicContact CE2-CB 4.22Å; N279-F281 HydrophobicContact CB-CD2 4.49Å; N279-F281 HydrophobicContact CB-CE2 3.87Å; N279-F281 HydrophobicContact CB-CZ 4.33Å; N279-F281 VanDerWaalsContact ND2-CZ 3.26Å; N279-F281 WeakPolarHBondContact ND2-CZ 3.42Å; N279-S288 VanDerWaalsContact CG-OG 3.25Å; N279-S288 PolarHBondContact ND2-OG 3.44Å; N279-S288 PolarHBondContact OD1-OG 3.15Å; N279-I290 WeakPolarHBondContact CA-O 3.48Å; N279-I290 PolarHBondContact OD1-O 3.22Å; N279-I290 VanDerWaalsContact OD1-O 3.04Å; N279-N291 WeakPolarHBondContact CB-OD1 3.49Å; N279-N291 PolarHBondContact ND2-OD1 3.39Å; N279-N291 PolarHBondContact OD1-OD1 3.41Å; N279-N291 VanDerWaalsContact OD1-OD1 3.07Å
280	I	90.5	Very high	87.2	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	121.4	170.6	-54.9	-174	0	0	0	108.7	F256 D263 Y264 V265 M289 I290 F292 V318 F349 F351	F256-I280 HydrophobicContact CD1-CD1 4.42Å; F256-I280 HydrophobicContact CD2-CD1 4.22Å; F256-I280 HydrophobicContact CD2-CG2 3.93Å; F256-I280 HydrophobicContact CE1-CD1 4.38Å; F256-I280 HydrophobicContact CE2-CD1 4.19Å; F256-I280 HydrophobicContact CE2-CG2 4.27Å; F256-I280 HydrophobicContact CG-CD1 4.35Å; F256-I280 HydrophobicContact CZ-CD1 4.27Å; D263-I280 HydrophobicContact CB-CG2 4.19Å; Y264-I280 CarbonylContact O-C 3.57Å; Y264-I280 WeakPolarHBondContact O-CA 3.22Å; V265-I280 HydrophobicContact CG1-CG1 4.3Å; V265-I280 HydrophobicContact CG2-CD1 4.41Å; V265-I280 HydrophobicContact CG2-CG1 4.09Å; V265-I280 HydrophobicContact CG2-CG2 4.48Å; I280-M289 PolarHBondContact O-N 3.42Å; I280-I290 PolarHBondContact N-O 3.33Å; I280-F292 HydrophobicContact CD1-CE2 3.77Å; I280-F292 HydrophobicContact CD1-CZ 4.22Å; I280-F292 HydrophobicContact CG1-CE2 4.04Å; I280-V318 HydrophobicContact CD1-CG2 4.36Å; I280-F349 HydrophobicContact CG2-CD1 4.46Å; I280-F349 HydrophobicContact CG2-CE1 4.03Å; I280-F351 HydrophobicContact CD1-CE2 4.24Å; I280-F351 HydrophobicContact CD1-CZ 3.88Å
281	F	88.8	Confident	87.3	Confident	14 Å²	14	44 Å²	44	6%	0.061	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	137.3	175.3	-66.3	-86.8	0	0	0	111.1	L208 T234 L246 D263 Y264 T266 N279 G283 M286 E287	L208-F281 HydrophobicContact CD1-CD2 3.74Å; L208-F281 HydrophobicContact CD1-CE2 3.9Å; T234-F281 HydrophobicContact CG2-CD1 4.34Å; T234-F281 HydrophobicContact CG2-CE1 3.82Å; T234-F281 HydrophobicContact CG2-CZ 3.91Å; L246-F281 HydrophobicContact CD1-CE2 4.07Å; L246-F281 HydrophobicContact CD1-CZ 4.33Å; L246-F281 HydrophobicContact CD2-CZ 4.44Å; D263-F281 WeakPolarHBondContact CB-O 3.3Å; Y264-F281 HydrophobicContact CD2-CB 4.27Å; Y264-F281 PolarHBondContact N-O 3.09Å; Y264-F281 PolarHBondContact O-N 2.83Å; T266-F281 HydrophobicContact CG2-CD2 3.85Å; T266-F281 HydrophobicContact CG2-CE2 3.46Å; T266-F281 VanDerWaalsContact CG2-CE2 3.46Å; N279-F281 HydrophobicContact CB-CD2 4.49Å; N279-F281 HydrophobicContact CB-CE2 3.87Å; N279-F281 HydrophobicContact CB-CZ 4.33Å; N279-F281 VanDerWaalsContact ND2-CZ 3.26Å; N279-F281 WeakPolarHBondContact ND2-CZ 3.42Å; F281-G283 PolarHBondContact O-N 2.7Å; F281-M286 HydrophobicContact CB-SD 4.07Å; F281-M286 HydrophobicContact CD1-CG 4.35Å; F281-M286 WeakPolarHBondContact CD1-O 3.4Å; F281-M286 HydrophobicContact CG-SD 4.39Å; F281-E287 CarbonylContact C-O 3.58Å; F281-E287 VanDerWaalsContact CA-O 3.25Å; F281-E287 WeakPolarHBondContact CA-O 3Å
282	N	88.4	Confident	87.6	Confident	25 Å²	25	44.7 Å²	44.7	13%	0.134	24%	0.236	C	C	.	.			trans	-65.4	131.5	177.1	-179.6	-32.5	0	0	0	111.5	D263 A284 N285 M286 E287 M289	D263-N282 VanDerWaalsContact OD1-CA 3.31Å; D263-N282 WeakPolarHBondContact OD1-CA 3.23Å; N282-A284 PolarHBondContact O-N 3.17Å; N282-A284 WeakPolarHBondContact OD1-CB 3.39Å; N282-A284 PolarHBondContact OD1-N 3.19Å; N282-N285 WeakPolarHBondContact CB-OD1 3.39Å; N282-M286 WeakPolarHBondContact O-CA 3.28Å; N282-M286 PolarHBondContact O-N 3.03Å; N282-E287 PolarHBondContact N-O 3.38Å; N282-M289 HydrophobicContact CB-CG 4.05Å; N282-M289 HydrophobicContact CB-SD 4.19Å
283	G	82.8	Confident	87.9	Confident	5 Å²	5	44.7 Å²	44.7	5%	0.052	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-25.8	-178	0	0	0	0	0	115.1	L232 E262 D263 F281	L232-G283 WeakPolarHBondContact CD1-O 3.41Å; E262-G283 WeakPolarHBondContact O-CA 3.47Å; D263-G283 PolarHBondContact OD1-N 2.89Å; F281-G283 PolarHBondContact O-N 2.7Å
284	A	83.3	Confident	88.1	Confident	45 Å²	45	36.9 Å²	36.9	37%	0.372	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-39.4	-175.7	0	0	0	0	0	114.2	K261 N282	K261-A284 HydrophobicContact CD-CB 4.28Å; N282-A284 PolarHBondContact O-N 3.17Å; N282-A284 WeakPolarHBondContact OD1-CB 3.39Å; N282-A284 PolarHBondContact OD1-N 3.19Å
285	N	83.9	Confident	88.2	Confident	81 Å²	81	40.1 Å²	40.1	43%	0.433	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-129.8	-2.3	-169.8	70.1	-6.9	0	0	0	114.6	N282 E287	N282-N285 WeakPolarHBondContact CB-OD1 3.39Å; N285-E287 PolarHBondContact ND2-OE2 3.32Å; N285-E287 PolarHBondContact O-N 3.03Å; N285-E287 VanDerWaalsContact OD1-CB 3.25Å; N285-E287 WeakPolarHBondContact OD1-CB 3.47Å; N285-E287 PolarHBondContact OD1-N 2.9Å
286	M	85.4	Confident	88.3	Confident	16 Å²	16	40.1 Å²	40.1	8%	0.079	23%	0.228	C	C	.	.			trans	58.6	30.7	-176.7	-155.6	76.2	84.8	0	0	113.4	L208 L232 T234 Y264 F281 N282	L208-M286 HydrophobicContact CB-CE 4.46Å; L208-M286 HydrophobicContact CB-SD 4.47Å; L232-M286 HydrophobicContact CB-CB 4.39Å; L232-M286 HydrophobicContact CB-CE 3.73Å; L232-M286 VanDerWaalsContact O-CE 3.28Å; L232-M286 WeakPolarHBondContact O-CE 3.39Å; T234-M286 HydrophobicContact CG2-CG 3.83Å; Y264-M286 HydrophobicContact CD2-CE 4.13Å; Y264-M286 HydrophobicContact CD2-SD 3.48Å; Y264-M286 WeakPolarHBondContact CD2-SD 3.48Å; Y264-M286 HydrophobicContact CE2-CE 3.9Å; Y264-M286 HydrophobicContact CE2-SD 3.75Å; Y264-M286 HydrophobicContact CG-SD 4.29Å; F281-M286 HydrophobicContact CB-SD 4.07Å; F281-M286 HydrophobicContact CD1-CG 4.35Å; F281-M286 WeakPolarHBondContact CD1-O 3.4Å; F281-M286 HydrophobicContact CG-SD 4.39Å; N282-M286 WeakPolarHBondContact O-CA 3.28Å; N282-M286 PolarHBondContact O-N 3.03Å
287	E	86.9	Confident	88.3	Confident	113 Å²	113	45.4 Å²	45.4	53%	0.528	25%	0.254	S	S	.	.			trans	-83.3	139.8	173.1	-172.9	172.1	-168.5	0	0	110.9	F281 N282 N285 M289	F281-E287 CarbonylContact C-O 3.58Å; F281-E287 VanDerWaalsContact CA-O 3.25Å; F281-E287 WeakPolarHBondContact CA-O 3Å; N282-E287 PolarHBondContact N-O 3.38Å; N285-E287 PolarHBondContact ND2-OE2 3.32Å; N285-E287 PolarHBondContact O-N 3.03Å; N285-E287 VanDerWaalsContact OD1-CB 3.25Å; N285-E287 WeakPolarHBondContact OD1-CB 3.47Å; N285-E287 PolarHBondContact OD1-N 2.9Å; E287-M289 PolarHBondContact O-N 3.32Å
288	S	87.1	Confident	88.3	Confident	50 Å²	50	47 Å²	47	35%	0.35	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	122.3	178.2	174.2	0	0	0	0	109.9	N279	N279-S288 VanDerWaalsContact CG-OG 3.25Å; N279-S288 PolarHBondContact ND2-OG 3.44Å; N279-S288 PolarHBondContact OD1-OG 3.15Å
289	M	87.3	Confident	88.2	Confident	80 Å²	80	47 Å²	47	39%	0.394	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-52.1	-177.3	-59.2	-57.2	-64.7	0	0	111.3	I280 N282 E287 F349	I280-M289 PolarHBondContact O-N 3.42Å; N282-M289 HydrophobicContact CB-CG 4.05Å; N282-M289 HydrophobicContact CB-SD 4.19Å; E287-M289 PolarHBondContact O-N 3.32Å; M289-F349 HydrophobicContact CB-CD1 4.15Å; M289-F349 HydrophobicContact CB-CE1 3.98Å; M289-F349 HydrophobicContact CB-CE2 4.43Å; M289-F349 HydrophobicContact CB-CG 4.46Å; M289-F349 HydrophobicContact CB-CZ 4.13Å; M289-F349 HydrophobicContact CE-CD2 4.01Å; M289-F349 HydrophobicContact CE-CE2 3.58Å; M289-F349 HydrophobicContact CE-CZ 4.12Å; M289-F349 HydrophobicContact CG-CE1 4.02Å; M289-F349 HydrophobicContact CG-CE2 4.18Å; M289-F349 HydrophobicContact CG-CZ 3.75Å
290	I	87.7	Confident	88.3	Confident	44 Å²	44	49.8 Å²	49.8	23%	0.226	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	141.8	-174.5	-68	-158.2	0	0	0	111.5	N279 I280 F292 F349 F351	N279-I290 WeakPolarHBondContact CA-O 3.48Å; N279-I290 PolarHBondContact OD1-O 3.22Å; N279-I290 VanDerWaalsContact OD1-O 3.04Å; I280-I290 PolarHBondContact N-O 3.33Å; I290-F292 HydrophobicContact CG2-CE1 4.22Å; I290-F292 HydrophobicContact CG2-CE2 4.19Å; I290-F292 HydrophobicContact CG2-CZ 4.03Å; I290-F349 HydrophobicContact CD1-CB 3.43Å; I290-F349 VanDerWaalsContact CD1-CB 3.43Å; I290-F349 HydrophobicContact CD1-CG 4.48Å; I290-F349 WeakPolarHBondContact CD1-O 3.34Å; I290-F349 HydrophobicContact CG1-CB 4Å; I290-F351 HydrophobicContact CD1-CD2 4.31Å; I290-F351 HydrophobicContact CD1-CE2 4.14Å
291	N	90.6	Very high	88.4	Confident	87 Å²	87	50.1 Å²	50.1	47%	0.465	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.8	171.9	-65.8	-48.3	0	0	0	110.8	V278 N279	V278-N291 CarbonylContact O-C 3.54Å; V278-N291 WeakPolarHBondContact O-CA 3.17Å; N279-N291 WeakPolarHBondContact CB-OD1 3.49Å; N279-N291 PolarHBondContact ND2-OD1 3.39Å; N279-N291 PolarHBondContact OD1-OD1 3.41Å; N279-N291 VanDerWaalsContact OD1-OD1 3.07Å
292	F	90.5	Very high	88.4	Confident	15 Å²	15	49.5 Å²	49.5	7%	0.066	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	121.7	167.7	-55.5	-79.1	0	0	0	109.3	Y277 V278 I280 I290 F301 I320 Y343 F351	Y277-F292 CarbonylContact C-O 3.57Å; Y277-F292 WeakPolarHBondContact CA-O 3.5Å; Y277-F292 WeakPolarHBondContact CB-O 3.47Å; V278-F292 HydrophobicContact CB-CB 4.36Å; V278-F292 HydrophobicContact CB-CD2 4.13Å; V278-F292 HydrophobicContact CG1-CD2 4.22Å; V278-F292 PolarHBondContact N-O 3.09Å; V278-F292 PolarHBondContact O-N 3.21Å; I280-F292 HydrophobicContact CD1-CE2 3.77Å; I280-F292 HydrophobicContact CD1-CZ 4.22Å; I280-F292 HydrophobicContact CG1-CE2 4.04Å; I290-F292 HydrophobicContact CG2-CE1 4.22Å; I290-F292 HydrophobicContact CG2-CE2 4.19Å; I290-F292 HydrophobicContact CG2-CZ 4.03Å; F292-F301 HydrophobicContact CB-CE1 4.15Å; F292-F301 HydrophobicContact CB-CZ 4.34Å; F292-F301 WeakPolarHBondContact O-CE1 3.46Å; F292-I320 HydrophobicContact CB-CD1 3.87Å; F292-I320 HydrophobicContact CD2-CD1 3.89Å; F292-I320 HydrophobicContact CG-CD1 3.95Å; F292-Y343 AromaticContact CD1-CD1 3.73Å; F292-Y343 HydrophobicContact CD1-CD1 3.73Å; F292-Y343 HydrophobicContact CD1-CD2 4.3Å; F292-Y343 AromaticContact CD1-CE1 3.58Å; F292-Y343 HydrophobicContact CD1-CE1 3.58Å; F292-Y343 HydrophobicContact CD1-CE2 4.2Å; F292-Y343 HydrophobicContact CD1-CG 4.08Å; F292-Y343 AromaticContact CD1-CZ 3.83Å; F292-Y343 AromaticContact CE1-CD1 3.63Å; F292-Y343 HydrophobicContact CE1-CD1 3.63Å; F292-Y343 HydrophobicContact CE1-CD2 4.41Å; F292-Y343 AromaticContact CE1-CE1 3.99Å; F292-Y343 HydrophobicContact CE1-CE1 3.99Å; F292-Y343 AromaticContact CE1-CG 3.85Å; F292-Y343 HydrophobicContact CE1-CG 3.85Å; F292-Y343 HydrophobicContact CG-CE2 4.48Å; F292-Y343 HydrophobicContact CZ-CG 4.47Å; F292-F351 HydrophobicContact CE1-CB 4.45Å; F292-F351 HydrophobicContact CE1-CD1 4.49Å; F292-F351 AromaticContact CE1-CD2 3.82Å; F292-F351 HydrophobicContact CE1-CD2 3.82Å; F292-F351 HydrophobicContact CE1-CE2 4.18Å; F292-F351 AromaticContact CE1-CG 3.99Å; F292-F351 HydrophobicContact CE1-CG 3.99Å; F292-F351 HydrophobicContact CZ-CD1 4.22Å; F292-F351 AromaticContact CZ-CD2 3.65Å; F292-F351 HydrophobicContact CZ-CD2 3.65Å; F292-F351 HydrophobicContact CZ-CE1 4.11Å; F292-F351 AromaticContact CZ-CE2 3.53Å; F292-F351 HydrophobicContact CZ-CE2 3.53Å; F292-F351 HydrophobicContact CZ-CG 4.01Å; F292-F351 AromaticContact CZ-CZ 3.77Å; F292-F351 HydrophobicContact CZ-CZ 3.77Å
293	T	91.2	Very high	88.5	Confident	82 Å²	82	50 Å²	50	50%	0.503	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	140.6	179.1	47.5	0	0	0	0	111.9
294	G	89.1	Confident	88.9	Confident	8 Å²	8	50.1 Å²	50.1	8%	0.082	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-70.6	154.2	173.9	0	0	0	0	0	112.4	G276	G276-G294 PolarHBondContact O-N 2.7Å
295	S	87.8	Confident	89.3	Confident	97 Å²	97	48.6 Å²	48.6	68%	0.678	27%	0.269	S	S	*	.	S	Bend	trans	-86.8	-19.2	-179.2	58.7	0	0	0	0	114
296	Q	89.9	Confident	89.7	Confident	41 Å²	41	45.1 Å²	45.1	19%	0.192	25%	0.251	C	S	.	.	S	Bend	trans	-134.4	131.5	-172.5	-175.5	179.6	103.2	0	0	111.5	A299 F325 M326	Q296-A299 HydrophobicContact CB-CB 4.18Å; Q296-A299 WeakPolarHBondContact O-CB 3.49Å; Q296-F325 HydrophobicContact CB-CD2 4.16Å; Q296-F325 HydrophobicContact CB-CE2 4.09Å; Q296-M326 PolarHBondContact NE2-O 3.14Å
297	M	90.4	Very high	89.9	Confident	112 Å²	112	45.3 Å²	45.3	55%	0.552	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	144.7	176.4	-61.9	172.5	79.9	0	0	111	K273 A274 L275 A299	K273-M297 HydrophobicContact CB-CE 4.22Å; K273-M297 WeakPolarHBondContact O-CE 3.13Å; A274-M297 CarbonylContact O-C 3.53Å; A274-M297 WeakPolarHBondContact O-CA 3.38Å; L275-M297 HydrophobicContact CD2-CB 4.44Å; L275-M297 HydrophobicContact CD2-CG 3.55Å; L275-M297 HydrophobicContact CG-CG 3.93Å; M297-A299 PolarHBondContact O-N 2.95Å; M297-A299 VanDerWaalsContact O-N 3.14Å
298	A	89.9	Confident	90.1	Very high	61 Å²	61	40.5 Å²	40.5	50%	0.504	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	7.6	-179.2	0	0	0	0	0	115.7	A274 Y300	A274-A298 PolarHBondContact O-N 2.96Å; A298-Y300 PolarHBondContact O-N 3.15Å
299	A	91	Very high	90.3	Very high	2 Å²	2	39 Å²	39	2%	0.017	22%	0.222	C	C	.	.	S	Bend	trans	-71.1	-8.9	173.3	0	0	0	0	0	113.4	Q296 M297 F301 A322 L324 F325	Q296-A299 HydrophobicContact CB-CB 4.18Å; Q296-A299 WeakPolarHBondContact O-CB 3.49Å; M297-A299 PolarHBondContact O-N 2.95Å; M297-A299 VanDerWaalsContact O-N 3.14Å; A299-F301 VanDerWaalsContact C-N 3.34Å; A299-A322 HydrophobicContact CB-CB 4.38Å; A299-A322 CarbonylContact O-C 3.48Å; A299-L324 PolarHBondContact O-N 3.48Å; A299-F325 HydrophobicContact CB-CB 4.18Å; A299-F325 HydrophobicContact CB-CD2 4.26Å
300	Y	91.5	Very high	90.4	Very high	68 Å²	68	35.2 Å²	35.2	27%	0.267	20%	0.203	S	C	.	.			trans	59.2	43.3	-176.8	-97.1	-110.8	0	0	0	112.1	P269 A298 G302 Y303 L324	P269-Y300 HydrophobicContact CB-CD1 3.78Å; P269-Y300 HydrophobicContact CB-CE1 4.34Å; P269-Y300 HydrophobicContact CB-CG 4.27Å; P269-Y300 HydrophobicContact CG-CD1 4.37Å; A298-Y300 PolarHBondContact O-N 3.15Å; Y300-G302 PolarHBondContact O-N 3.44Å; Y300-Y303 HydrophobicContact CD1-CD2 4.05Å; Y300-Y303 WeakPolarHBondContact O-CB 3.41Å; Y300-Y303 PolarHBondContact O-N 3.1Å; Y300-L324 HydrophobicContact CD2-CD1 3.76Å; Y300-L324 HydrophobicContact CE2-CD1 4.33Å; Y300-L324 HydrophobicContact CG-CD1 4.19Å
301	F	92.7	Very high	90.5	Very high	7 Å²	7	34 Å²	34	3%	0.031	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	121.9	177.1	-177	-92.5	0	0	0	110.9	P269 V278 F292 A299 I320 A322 Y343	P269-F301 WeakPolarHBondContact CA-O 3.37Å; V278-F301 HydrophobicContact CG2-CD1 4.43Å; V278-F301 HydrophobicContact CG2-CE1 4.07Å; F292-F301 HydrophobicContact CB-CE1 4.15Å; F292-F301 HydrophobicContact CB-CZ 4.34Å; F292-F301 WeakPolarHBondContact O-CE1 3.46Å; A299-F301 VanDerWaalsContact C-N 3.34Å; F301-I320 HydrophobicContact CD1-CG2 4.09Å; F301-I320 HydrophobicContact CD2-CG2 3.98Å; F301-I320 HydrophobicContact CE1-CD1 4.03Å; F301-I320 HydrophobicContact CE1-CG2 3.74Å; F301-I320 HydrophobicContact CE2-CB 4.08Å; F301-I320 HydrophobicContact CE2-CG2 3.61Å; F301-I320 HydrophobicContact CG-CG2 4.21Å; F301-I320 HydrophobicContact CZ-CB 3.93Å; F301-I320 HydrophobicContact CZ-CD1 3.7Å; F301-I320 HydrophobicContact CZ-CG1 4.4Å; F301-I320 HydrophobicContact CZ-CG2 3.5Å; F301-I320 VanDerWaalsContact CZ-CG2 3.5Å; F301-A322 HydrophobicContact CB-CB 4.27Å; F301-A322 HydrophobicContact CD2-CB 4.1Å; F301-Y343 HydrophobicContact CZ-CE2 4.33Å
302	G	89.3	Confident	90.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.2	21.7	-170	0	0	0	0	0	113.4	G267 Y300 G321	G267-G302 WeakPolarHBondContact CA-O 3.24Å; Y300-G302 PolarHBondContact O-N 3.44Å; G302-G321 PolarHBondContact N-O 2.92Å
303	Y	90.8	Very high	90.2	Very high	36 Å²	36	34.8 Å²	34.8	14%	0.141	21%	0.206	C	C	.	.	S	Bend	trans	-69	-43	169.7	-177.4	-93.5	0	0	0	111.6	Y249 Y300 G321 P323 S368 Y432	Y249-Y303 WeakPolarHBondContact CB-O 3.44Å; Y249-Y303 HydrophobicContact CD1-CD1 4.17Å; Y249-Y303 AromaticContact CD1-CE1 3.91Å; Y249-Y303 HydrophobicContact CD1-CE1 3.91Å; Y249-Y303 HydrophobicContact CD1-CE2 4.42Å; Y249-Y303 WeakPolarHBondContact CD1-O 3.32Å; Y249-Y303 HydrophobicContact CD2-CD2 4.35Å; Y249-Y303 AromaticContact CD2-CE2 3.76Å; Y249-Y303 HydrophobicContact CD2-CE2 3.76Å; Y249-Y303 AromaticContact CD2-CZ 3.87Å; Y249-Y303 HydrophobicContact CE1-CD1 4.27Å; Y249-Y303 AromaticContact CE1-CE1 3.58Å; Y249-Y303 HydrophobicContact CE1-CE1 3.58Å; Y249-Y303 HydrophobicContact CE1-CE2 4.47Å; Y249-Y303 AromaticContact CE1-CZ 3.71Å; Y249-Y303 HydrophobicContact CE2-CE1 4.29Å; Y249-Y303 AromaticContact CE2-CE2 3.84Å; Y249-Y303 HydrophobicContact CE2-CE2 3.84Å; Y249-Y303 AromaticContact CE2-CZ 3.53Å; Y249-Y303 WeakPolarHBondContact CE2-OH 3.43Å; Y249-Y303 HydrophobicContact CG-CD2 4.31Å; Y249-Y303 HydrophobicContact CG-CE1 4.4Å; Y249-Y303 HydrophobicContact CG-CE2 4.1Å; Y249-Y303 AromaticContact CZ-CE1 3.81Å; Y249-Y303 AromaticContact CZ-CZ 3.45Å; Y249-Y303 VanDerWaalsContact CZ-CZ 3.45Å; Y249-Y303 PolarHBondContact OH-OH 3.29Å; Y249-Y303 VanDerWaalsContact OH-OH 3.12Å; Y300-Y303 HydrophobicContact CD1-CD2 4.05Å; Y300-Y303 WeakPolarHBondContact O-CB 3.41Å; Y300-Y303 PolarHBondContact O-N 3.1Å; Y303-G321 PolarHBondContact N-O 3.14Å; Y303-P323 HydrophobicContact CD1-CG 3.87Å; Y303-P323 HydrophobicContact CD2-CG 4.36Å; Y303-P323 HydrophobicContact CG-CG 3.73Å; Y303-S368 VanDerWaalsContact CD1-O 3.22Å; Y303-S368 WeakPolarHBondContact CD1-O 3.31Å; Y303-S368 WeakPolarHBondContact CE1-O 3.35Å; Y303-Y432 PolarHBondContact OH-OH 2.83Å
304	S	91.6	Very high	89.9	Confident	7 Å²	7	33.7 Å²	33.7	5%	0.049	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	139.6	172.1	61.9	0	0	0	0	109.4	G321 G367 I370	S304-G321 PolarHBondContact O-N 2.89Å; S304-G367 PolarHBondContact OG-O 2.97Å; S304-I370 WeakPolarHBondContact OG-CD1 3.37Å; S304-I370 WeakPolarHBondContact OG-CG1 3.46Å
305	V	91.8	Very high	89.8	Confident	14 Å²	14	35.8 Å²	35.8	9%	0.085	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	143.8	170.1	-58	0	0	0	0	109.4	S250 T252 V265 V278 L319 I320	S250-V305 VanDerWaalsContact CB-CG2 3.44Å; S250-V305 WeakPolarHBondContact O-CG2 3.37Å; S250-V305 WeakPolarHBondContact OG-CG2 3.35Å; S250-V305 PolarHBondContact OG-N 2.92Å; T252-V305 HydrophobicContact CG2-CB 4.32Å; T252-V305 HydrophobicContact CG2-CG2 3.6Å; V265-V305 HydrophobicContact CG1-CG2 4.24Å; V278-V305 HydrophobicContact CG1-CG1 4Å; V278-V305 HydrophobicContact CG2-CG1 3.82Å; V305-L319 VanDerWaalsContact CA-O 3.27Å; V305-L319 WeakPolarHBondContact CA-O 3.2Å; V305-I320 HydrophobicContact CG1-CG1 4.34Å; V305-I320 HydrophobicContact CG1-CG2 4.5Å
306	A	90.8	Very high	89.9	Confident	8 Å²	8	32.6 Å²	32.6	7%	0.066	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	143.9	171.1	0	0	0	0	0	108.8	L319 I370	A306-L319 HydrophobicContact CB-CB 4.43Å; A306-L319 PolarHBondContact N-O 2.82Å; A306-L319 PolarHBondContact O-N 3.29Å; A306-I370 HydrophobicContact CB-CB 4.04Å; A306-I370 HydrophobicContact CB-CG2 3.6Å
307	A	90.5	Very high	90	Very high	19 Å²	19	30.6 Å²	30.6	16%	0.157	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	120.7	175.9	0	0	0	0	0	108.7	T252 F256 V316 D317	T252-A307 HydrophobicContact CG2-CB 3.71Å; T252-A307 PolarHBondContact OG1-N 3.04Å; F256-A307 HydrophobicContact CZ-CB 4.48Å; A307-V316 HydrophobicContact CB-CG1 3.71Å; A307-D317 WeakPolarHBondContact CA-O 3.28Å
308	S	90.1	Very high	90.1	Very high	12 Å²	12	25.3 Å²	25.3	8%	0.084	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	138	176.8	-175.4	0	0	0	0	109.3	V310 D317	S308-V310 PolarHBondContact O-N 3.34Å; S308-D317 PolarHBondContact N-O 2.95Å; S308-D317 VanDerWaalsContact O-CB 3.25Å; S308-D317 WeakPolarHBondContact O-CB 3.36Å; S308-D317 PolarHBondContact O-N 2.77Å
309	D	91.4	Very high	90.3	Very high	20 Å²	20	22.4 Å²	22.4	11%	0.107	14%	0.135	C	C	.	.			trans	-72.7	97.7	170.6	159.7	29.7	0	0	0	109.4	N311 S312 D313 F315 K382	D309-N311 PolarHBondContact OD1-OD1 3.12Å; D309-S312 WeakPolarHBondContact OD1-CA 3.47Å; D309-S312 PolarHBondContact OD1-N 2.91Å; D309-D313 PolarHBondContact OD1-N 2.8Å; D309-F315 WeakPolarHBondContact CA-O 3.24Å; D309-F315 WeakPolarHBondContact CB-O 3.48Å; D309-K382 WeakPolarHBondContact O-CB 3.43Å; D309-K382 VanDerWaalsContact O-CD 3.26Å; D309-K382 WeakPolarHBondContact O-CD 3.18Å; D309-K382 WeakPolarHBondContact O-CG 3.47Å; D309-K382 IonicContact OD2-NZ 2.96Å; D309-K382 PolarHBondContact OD2-NZ 3.49Å
310	V	90.8	Very high	90.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.134	C	C	.	.	S	Bend	trans	-91.4	-26	-172.5	-69	0	0	0	0	112.7	S308 D317 L319 L344 V384 I409	S308-V310 PolarHBondContact O-N 3.34Å; V310-D317 HydrophobicContact CG2-CB 4.08Å; V310-D317 WeakPolarHBondContact CG2-OD2 3.41Å; V310-D317 PolarHBondContact N-OD2 3.41Å; V310-L319 HydrophobicContact CG1-CD1 4.45Å; V310-L344 HydrophobicContact CG2-CD2 3.73Å; V310-V384 HydrophobicContact CG1-CG1 3.91Å; V310-I409 HydrophobicContact CB-CD1 4.28Å; V310-I409 HydrophobicContact CB-CG1 3.97Å; V310-I409 HydrophobicContact CG1-CD1 3.9Å; V310-I409 HydrophobicContact CG1-CG1 4.14Å; V310-I409 HydrophobicContact CG2-CD1 4.13Å; V310-I409 HydrophobicContact CG2-CG1 3.75Å
311	N	89.6	Confident	90.5	Very high	17 Å²	17	19 Å²	19	9%	0.091	12%	0.121	C	C	.	.	S	Bend	trans	-94.5	-2.1	177.9	67.2	-9.7	0	0	0	113.3	D309 D313 D317 Y381	D309-N311 PolarHBondContact OD1-OD1 3.12Å; N311-D313 VanDerWaalsContact C-N 3.25Å; N311-D313 PolarHBondContact ND2-OD2 2.7Å; N311-D313 PolarHBondContact O-N 3.28Å; N311-D313 PolarHBondContact OD1-N 3.5Å; N311-D313 PolarHBondContact OD1-OD1 2.86Å; N311-D313 VanDerWaalsContact OD1-OD1 3.13Å; N311-D313 PolarHBondContact OD1-OD2 3.44Å; N311-D317 PolarHBondContact OD1-OD2 3.29Å; N311-Y381 WeakPolarHBondContact O-CD1 3.41Å; N311-Y381 VanDerWaalsContact O-CE1 3.25Å; N311-Y381 WeakPolarHBondContact O-CE1 3.25Å
312	S	87.6	Confident	90.6	Very high	49 Å²	49	18.8 Å²	18.8	34%	0.343	12%	0.121	S	C	.	.			trans	56.7	36.6	178.5	-63.1	0	0	0	0	113.7	D309 G380	D309-S312 WeakPolarHBondContact OD1-CA 3.47Å; D309-S312 PolarHBondContact OD1-N 2.91Å; S312-G380 WeakPolarHBondContact CB-O 3.34Å; S312-G380 PolarHBondContact OG-O 3.25Å
313	D	86.4	Confident	90.9	Very high	70 Å²	70	19 Å²	19	37%	0.374	12%	0.122	S	C	.	.	S	Bend	trans	-89	-6.3	173.4	70.7	6.6	0	0	0	113.1	D309 N311 F315	D309-D313 PolarHBondContact OD1-N 2.8Å; N311-D313 VanDerWaalsContact C-N 3.25Å; N311-D313 PolarHBondContact ND2-OD2 2.7Å; N311-D313 PolarHBondContact O-N 3.28Å; N311-D313 PolarHBondContact OD1-N 3.5Å; N311-D313 PolarHBondContact OD1-OD1 2.86Å; N311-D313 VanDerWaalsContact OD1-OD1 3.13Å; N311-D313 PolarHBondContact OD1-OD2 3.44Å; D313-F315 WeakPolarHBondContact OD1-CA 3.39Å; D313-F315 WeakPolarHBondContact OD1-CB 3.34Å; D313-F315 PolarHBondContact OD1-N 3.37Å
314	G	85.3	Confident	91	Very high	60 Å²	60	19.4 Å²	19.4	62%	0.619	13%	0.126	S	C	*	.	S	Bend	trans	94.1	-8	-179.3	0	0	0	0	0	114.2
315	F	87.7	Confident	91.2	Very high	52 Å²	52	20 Å²	20	23%	0.228	13%	0.128	C	C	.	.	S	Bend	trans	-94.8	143.8	173.5	-59.8	-73.3	0	0	0	111.1	E258 D309 D313 G347	E258-F315 HydrophobicContact CG-CE1 4.3Å; E258-F315 WeakPolarHBondContact OE1-CE1 3.04Å; D309-F315 WeakPolarHBondContact CA-O 3.24Å; D309-F315 WeakPolarHBondContact CB-O 3.48Å; D313-F315 WeakPolarHBondContact OD1-CA 3.39Å; D313-F315 WeakPolarHBondContact OD1-CB 3.34Å; D313-F315 PolarHBondContact OD1-N 3.37Å; F315-G347 VanDerWaalsContact CE1-CA 3.45Å
316	V	89	Confident	91.2	Very high	29 Å²	29	22.5 Å²	22.5	18%	0.176	14%	0.14	C	C	.	.	P	Polyproline II helix	trans	-80.6	125.1	178.6	-176.5	0	0	0	0	110.1	F256 A307 S345	F256-V316 HydrophobicContact CD1-CB 4.48Å; F256-V316 HydrophobicContact CE1-CB 4.08Å; F256-V316 HydrophobicContact CE1-CG1 4.09Å; F256-V316 VanDerWaalsContact CE1-O 3.25Å; F256-V316 WeakPolarHBondContact CE1-O 3.45Å; F256-V316 HydrophobicContact CZ-CG1 4.15Å; A307-V316 HydrophobicContact CB-CG1 3.71Å; V316-S345 WeakPolarHBondContact O-CB 3.5Å
317	D	91.9	Very high	91.3	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	156.3	174.7	-50.6	-56.3	0	0	0	111.6	A307 S308 V310 N311 L344 S345	A307-D317 WeakPolarHBondContact CA-O 3.28Å; S308-D317 PolarHBondContact N-O 2.95Å; S308-D317 VanDerWaalsContact O-CB 3.25Å; S308-D317 WeakPolarHBondContact O-CB 3.36Å; S308-D317 PolarHBondContact O-N 2.77Å; V310-D317 HydrophobicContact CG2-CB 4.08Å; V310-D317 WeakPolarHBondContact CG2-OD2 3.41Å; V310-D317 PolarHBondContact N-OD2 3.41Å; N311-D317 PolarHBondContact OD1-OD2 3.29Å; D317-L344 HydrophobicContact CB-CD2 4.19Å; D317-L344 VanDerWaalsContact OD1-CA 3.23Å; D317-L344 WeakPolarHBondContact OD1-CA 3.13Å; D317-S345 PolarHBondContact OD1-N 3.18Å
318	V	92.3	Very high	91.1	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	126.2	-178	-172.9	0	0	0	0	110.8	F256 V265 I280 I320 Y343 F351	F256-V318 HydrophobicContact CD1-CG2 4.45Å; F256-V318 HydrophobicContact CE1-CG2 3.35Å; F256-V318 HydrophobicContact CZ-CG2 3.54Å; V265-V318 HydrophobicContact CG1-CG1 4.27Å; I280-V318 HydrophobicContact CD1-CG2 4.36Å; V318-I320 HydrophobicContact CG1-CD1 4.23Å; V318-I320 HydrophobicContact CG1-CG1 3.89Å; V318-Y343 PolarHBondContact N-O 3.12Å; V318-Y343 PolarHBondContact O-N 3.4Å; V318-F351 HydrophobicContact CG2-CE1 4.05Å; V318-F351 HydrophobicContact CG2-CZ 4.36Å
319	L	93.6	Very high	90.7	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	129.9	172.7	-64.7	85.6	0	0	0	109.7	V305 A306 V310 V340 S341 V342 I370 V384 I409	V305-L319 VanDerWaalsContact CA-O 3.27Å; V305-L319 WeakPolarHBondContact CA-O 3.2Å; A306-L319 HydrophobicContact CB-CB 4.43Å; A306-L319 PolarHBondContact N-O 2.82Å; A306-L319 PolarHBondContact O-N 3.29Å; V310-L319 HydrophobicContact CG1-CD1 4.45Å; L319-V340 HydrophobicContact CB-CG1 4.45Å; L319-S341 WeakPolarHBondContact CA-O 3.5Å; L319-V342 HydrophobicContact CD2-CG2 4.28Å; L319-V342 HydrophobicContact CG-CG1 4.34Å; L319-V342 HydrophobicContact CG-CG2 4.25Å; L319-I370 HydrophobicContact CB-CD1 4.2Å; L319-I370 HydrophobicContact CB-CG2 4.2Å; L319-I370 HydrophobicContact CD2-CG2 4.02Å; L319-V384 HydrophobicContact CD2-CB 4.2Å; L319-V384 HydrophobicContact CD2-CG1 3.92Å; L319-V384 HydrophobicContact CD2-CG2 3.97Å; L319-I409 HydrophobicContact CD2-CD1 3.63Å; L319-I409 HydrophobicContact CG-CD1 4.28Å
320	I	94.1	Very high	90.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	124.3	-176.7	-55.4	174.5	0	0	0	110	V278 F292 F301 V305 V318 V340 S341 Y343	V278-I320 HydrophobicContact CB-CD1 3.65Å; V278-I320 HydrophobicContact CB-CG1 4.38Å; V278-I320 HydrophobicContact CG1-CD1 4.01Å; V278-I320 HydrophobicContact CG1-CG1 4.47Å; V278-I320 HydrophobicContact CG2-CB 4.35Å; V278-I320 HydrophobicContact CG2-CD1 3.57Å; V278-I320 HydrophobicContact CG2-CG1 3.9Å; V278-I320 HydrophobicContact CG2-CG2 3.53Å; F292-I320 HydrophobicContact CB-CD1 3.87Å; F292-I320 HydrophobicContact CD2-CD1 3.89Å; F292-I320 HydrophobicContact CG-CD1 3.95Å; F301-I320 HydrophobicContact CD1-CG2 4.09Å; F301-I320 HydrophobicContact CD2-CG2 3.98Å; F301-I320 HydrophobicContact CE1-CD1 4.03Å; F301-I320 HydrophobicContact CE1-CG2 3.74Å; F301-I320 HydrophobicContact CE2-CB 4.08Å; F301-I320 HydrophobicContact CE2-CG2 3.61Å; F301-I320 HydrophobicContact CG-CG2 4.21Å; F301-I320 HydrophobicContact CZ-CB 3.93Å; F301-I320 HydrophobicContact CZ-CD1 3.7Å; F301-I320 HydrophobicContact CZ-CG1 4.4Å; F301-I320 HydrophobicContact CZ-CG2 3.5Å; F301-I320 VanDerWaalsContact CZ-CG2 3.5Å; V305-I320 HydrophobicContact CG1-CG1 4.34Å; V305-I320 HydrophobicContact CG1-CG2 4.5Å; V318-I320 HydrophobicContact CG1-CD1 4.23Å; V318-I320 HydrophobicContact CG1-CG1 3.89Å; I320-V340 CarbonylContact O-C 3.42Å; I320-V340 VanDerWaalsContact O-CA 3.29Å; I320-V340 WeakPolarHBondContact O-CA 3.07Å; I320-S341 PolarHBondContact N-O 2.89Å; I320-S341 PolarHBondContact O-N 2.92Å; I320-Y343 HydrophobicContact CD1-CD2 3.93Å; I320-Y343 HydrophobicContact CD1-CE2 3.69Å; I320-Y343 HydrophobicContact CG1-CD2 4.4Å; I320-Y343 HydrophobicContact CG1-CE2 4.37Å
321	G	94.1	Very high	90	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	136.6	177.5	0	0	0	0	0	113.4	G302 Y303 S304	G302-G321 PolarHBondContact N-O 2.92Å; Y303-G321 PolarHBondContact N-O 3.14Å; S304-G321 PolarHBondContact O-N 2.89Å
322	A	95	Very high	89.7	Confident	2 Å²	2	45.8 Å²	45.8	2%	0.017	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	79.1	172	0	0	0	0	0	109.1	A299 F301 L324 F325 G338 Q339	A299-A322 HydrophobicContact CB-CB 4.38Å; A299-A322 CarbonylContact O-C 3.48Å; F301-A322 HydrophobicContact CB-CB 4.27Å; F301-A322 HydrophobicContact CD2-CB 4.1Å; A322-L324 VanDerWaalsContact C-N 3.26Å; A322-L324 PolarHBondContact O-N 3.28Å; A322-F325 HydrophobicContact CB-CB 4.23Å; A322-F325 VanDerWaalsContact O-CB 3.29Å; A322-F325 WeakPolarHBondContact O-CB 3.48Å; A322-F325 PolarHBondContact O-N 3.27Å; A322-G338 WeakPolarHBondContact O-CA 3.33Å; A322-Q339 WeakPolarHBondContact CA-O 3.25Å; A322-Q339 PolarHBondContact N-O 3.41Å; A322-Q339 PolarHBondContact O-N 2.84Å
323	P	94	Very high	89.8	Confident	4 Å²	4	50.3 Å²	50.3	3%	0.026	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-23.8	-169.3	23.5	-33.4	0	0	0	114.4	Y303 G338 R365 Y366	Y303-P323 HydrophobicContact CD1-CG 3.87Å; Y303-P323 HydrophobicContact CD2-CG 4.36Å; Y303-P323 HydrophobicContact CG-CG 3.73Å; P323-G338 WeakPolarHBondContact O-CA 3.37Å; P323-R365 HydrophobicContact CB-CB 4.01Å; P323-R365 WeakPolarHBondContact O-CA 3.17Å; P323-Y366 WeakPolarHBondContact CA-O 3.49Å
324	L	94.3	Very high	89.9	Confident	45 Å²	45	51.6 Å²	51.6	24%	0.236	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	14.1	-179	-55.6	-179.4	0	0	0	112.5	A299 Y300 A322 M326 E336 R365	A299-L324 PolarHBondContact O-N 3.48Å; Y300-L324 HydrophobicContact CD2-CD1 3.76Å; Y300-L324 HydrophobicContact CE2-CD1 4.33Å; Y300-L324 HydrophobicContact CG-CD1 4.19Å; A322-L324 VanDerWaalsContact C-N 3.26Å; A322-L324 PolarHBondContact O-N 3.28Å; L324-M326 PolarHBondContact O-N 2.88Å; L324-E336 VanDerWaalsContact CD2-OE1 3.24Å; L324-E336 WeakPolarHBondContact CD2-OE1 3.47Å; L324-R365 HydrophobicContact CD2-CG 4.18Å
325	F	94.9	Very high	90.1	Very high	20 Å²	20	53.3 Å²	53.3	9%	0.088	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-62.2	131.8	178.7	-178.8	-94.2	0	0	0	111.5	Q296 A299 A322 D327 E336 V337 G338 Q339	Q296-F325 HydrophobicContact CB-CD2 4.16Å; Q296-F325 HydrophobicContact CB-CE2 4.09Å; A299-F325 HydrophobicContact CB-CB 4.18Å; A299-F325 HydrophobicContact CB-CD2 4.26Å; A322-F325 HydrophobicContact CB-CB 4.23Å; A322-F325 VanDerWaalsContact O-CB 3.29Å; A322-F325 WeakPolarHBondContact O-CB 3.48Å; A322-F325 PolarHBondContact O-N 3.27Å; F325-D327 HydrophobicContact CE1-CB 4.06Å; F325-E336 WeakPolarHBondContact O-CA 3.35Å; F325-V337 PolarHBondContact O-N 2.99Å; F325-G338 PolarHBondContact O-N 2.88Å; F325-Q339 HydrophobicContact CB-CB 3.74Å; F325-Q339 HydrophobicContact CD1-CB 3.63Å; F325-Q339 HydrophobicContact CD1-CG 4.48Å; F325-Q339 HydrophobicContact CD2-CB 4.31Å; F325-Q339 HydrophobicContact CE1-CB 4.32Å; F325-Q339 HydrophobicContact CG-CB 3.63Å
326	M	92.5	Very high	90.4	Very high	66 Å²	66	52.5 Å²	52.5	33%	0.325	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	119.7	175.4	-61.3	178.9	-74.1	0	0	111.3	Q296 L324 L334 R335 E336	Q296-M326 PolarHBondContact NE2-O 3.14Å; L324-M326 PolarHBondContact O-N 2.88Å; M326-L334 HydrophobicContact CB-CB 4.17Å; M326-L334 HydrophobicContact CB-CD2 4.19Å; M326-L334 HydrophobicContact CE-CD1 4.35Å; M326-L334 HydrophobicContact SD-CB 4.09Å; M326-L334 HydrophobicContact SD-CD1 4.45Å; M326-R335 CarbonylContact C-O 3.52Å; M326-R335 VanDerWaalsContact CA-O 3.23Å; M326-R335 WeakPolarHBondContact CA-O 3.36Å; M326-E336 HydrophobicContact CG-CB 4.18Å
327	D	91.3	Very high	90.5	Very high	72 Å²	72	51.7 Å²	51.7	39%	0.385	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	156.8	171	-166.1	16.7	0	0	0	110.9	F325 G329 L334 R335 V337 T358	F325-D327 HydrophobicContact CE1-CB 4.06Å; D327-G329 PolarHBondContact O-N 3.35Å; D327-L334 WeakPolarHBondContact O-CA 3.24Å; D327-R335 PolarHBondContact N-O 2.91Å; D327-R335 PolarHBondContact O-N 3.36Å; D327-V337 HydrophobicContact CB-CG2 3.59Å; D327-T358 HydrophobicContact CB-CG2 4.15Å
328	R	87.7	Confident	90.6	Very high	187 Å²	187	51.7 Å²	51.7	71%	0.706	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	108.6	173	-72.8	-175.7	-179.9	174.9	1.5	109	K333 L334	R328-K333 WeakPolarHBondContact CA-O 3.48Å; R328-L334 HydrophobicContact CG-CD2 3.93Å
329	G	81.8	Confident	90.8	Very high	20 Å²	20	52.2 Å²	52.2	21%	0.206	27%	0.271	C	S	.	.			trans	-61.9	172.3	173.8	0	0	0	0	0	112.5	D327 D331 G332 K333	D327-G329 PolarHBondContact O-N 3.35Å; G329-D331 PolarHBondContact O-N 3.48Å; G329-G332 WeakPolarHBondContact O-CA 3.16Å; G329-G332 PolarHBondContact O-N 2.84Å; G329-K333 PolarHBondContact N-O 3.46Å
330	T	82.8	Confident	90.8	Very high	153 Å²	153	52.2 Å²	52.2	94%	0.939	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-19.3	176.6	56	0	0	0	0	113.6	G332	T330-G332 VanDerWaalsContact C-N 3.3Å
331	D	84.1	Confident	90.9	Very high	78 Å²	78	52.4 Å²	52.4	42%	0.417	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	0.2	174	60.3	-16.4	0	0	0	113.7	G329 K333 R335	G329-D331 PolarHBondContact O-N 3.48Å; D331-K333 PolarHBondContact O-N 3.28Å; D331-K333 PolarHBondContact OD1-N 2.65Å; D331-R335 IonicContact OD1-CZ 3.01Å; D331-R335 IonicContact OD1-NE 2.8Å; D331-R335 PolarHBondContact OD1-NE 3.06Å; D331-R335 IonicContact OD1-NH2 2.95Å; D331-R335 PolarHBondContact OD1-NH2 3.31Å; D331-R335 IonicContact OD2-CZ 3.9Å; D331-R335 IonicContact OD2-NE 3.5Å; D331-R335 IonicContact OD2-NH2 2.63Å; D331-R335 PolarHBondContact OD2-NH2 2.87Å
332	G	84.4	Confident	90.8	Very high	54 Å²	54	52.4 Å²	52.4	56%	0.557	27%	0.272	S	S	*	.	S	Bend	trans	74.3	2.7	-177.8	0	0	0	0	0	114.4	G329 T330	G329-G332 WeakPolarHBondContact O-CA 3.16Å; G329-G332 PolarHBondContact O-N 2.84Å; T330-G332 VanDerWaalsContact C-N 3.3Å
333	K	88.5	Confident	90.7	Very high	145 Å²	145	53.5 Å²	53.5	63%	0.63	28%	0.276	S	S	*	.			trans	-88	148.2	177.9	-69.1	-175.9	178.6	179.4	0	111	R328 G329 D331	R328-K333 WeakPolarHBondContact CA-O 3.48Å; G329-K333 PolarHBondContact N-O 3.46Å; D331-K333 PolarHBondContact O-N 3.28Å; D331-K333 PolarHBondContact OD1-N 2.65Å
334	L	87.9	Confident	90.6	Very high	97 Å²	97	54 Å²	54	51%	0.508	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	130.2	171.9	-67.4	173.4	0	0	0	109.9	M326 D327 R328	M326-L334 HydrophobicContact CB-CB 4.17Å; M326-L334 HydrophobicContact CB-CD2 4.19Å; M326-L334 HydrophobicContact CE-CD1 4.35Å; M326-L334 HydrophobicContact SD-CB 4.09Å; M326-L334 HydrophobicContact SD-CD1 4.45Å; D327-L334 WeakPolarHBondContact O-CA 3.24Å; R328-L334 HydrophobicContact CG-CD2 3.93Å
335	R	91	Very high	90.3	Very high	96 Å²	96	51.9 Å²	51.9	36%	0.362	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	122.2	176.9	-62.4	178.4	-178.5	-170.4	-4.5	108.4	M326 D327 D331 V337 V362	M326-R335 CarbonylContact C-O 3.52Å; M326-R335 VanDerWaalsContact CA-O 3.23Å; M326-R335 WeakPolarHBondContact CA-O 3.36Å; D327-R335 PolarHBondContact N-O 2.91Å; D327-R335 PolarHBondContact O-N 3.36Å; D331-R335 IonicContact OD1-CZ 3.01Å; D331-R335 IonicContact OD1-NE 2.8Å; D331-R335 PolarHBondContact OD1-NE 3.06Å; D331-R335 IonicContact OD1-NH2 2.95Å; D331-R335 PolarHBondContact OD1-NH2 3.31Å; D331-R335 IonicContact OD2-CZ 3.9Å; D331-R335 IonicContact OD2-NE 3.5Å; D331-R335 IonicContact OD2-NH2 2.63Å; D331-R335 PolarHBondContact OD2-NH2 2.87Å; R335-V337 HydrophobicContact CB-CG1 4.38Å; R335-V337 PolarHBondContact O-N 2.8Å; R335-V337 VanDerWaalsContact O-N 3.14Å; R335-V362 HydrophobicContact CB-CG1 4.31Å; R335-V362 HydrophobicContact CB-CG2 4.16Å
336	E	93.1	Very high	89.8	Confident	34 Å²	34	58 Å²	58	16%	0.159	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	110	174.4	-178.1	-171.3	140.3	0	0	108.8	L324 F325 M326 V362 Y363 R365	L324-E336 VanDerWaalsContact CD2-OE1 3.24Å; L324-E336 WeakPolarHBondContact CD2-OE1 3.47Å; F325-E336 WeakPolarHBondContact O-CA 3.35Å; M326-E336 HydrophobicContact CG-CB 4.18Å; E336-V362 CarbonylContact O-C 3.6Å; E336-V362 WeakPolarHBondContact O-CA 3.38Å; E336-Y363 HydrophobicContact CB-CD1 3.81Å; E336-Y363 HydrophobicContact CB-CE1 3.85Å; E336-Y363 HydrophobicContact CG-CD1 4.23Å; E336-Y363 PolarHBondContact O-N 3.09Å; E336-Y363 WeakPolarHBondContact OE2-CD1 3.39Å; E336-R365 IonicContact OE1-NE 3.24Å
337	V	91.8	Very high	89.1	Confident	12 Å²	12	55.4 Å²	55.4	7%	0.073	28%	0.28	C	S	.	.			trans	-120.4	-23.2	-179.7	-69.3	0	0	0	0	112.2	F325 D327 R335 T358 G359 Y366	F325-V337 PolarHBondContact O-N 2.99Å; D327-V337 HydrophobicContact CB-CG2 3.59Å; R335-V337 HydrophobicContact CB-CG1 4.38Å; R335-V337 PolarHBondContact O-N 2.8Å; R335-V337 VanDerWaalsContact O-N 3.14Å; V337-T358 HydrophobicContact CB-CG2 4.48Å; V337-T358 HydrophobicContact CG2-CG2 3.49Å; V337-T358 VanDerWaalsContact CG2-CG2 3.49Å; V337-G359 WeakPolarHBondContact CB-O 3.11Å; V337-Y366 WeakPolarHBondContact O-CB 3.24Å; V337-Y366 PolarHBondContact O-N 2.97Å
338	G	94.3	Very high	88.4	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.291	C	S	.	.			trans	80.4	151.3	-171.8	0	0	0	0	0	112.4	A322 P323 F325 G359 Y366	A322-G338 WeakPolarHBondContact O-CA 3.33Å; P323-G338 WeakPolarHBondContact O-CA 3.37Å; F325-G338 PolarHBondContact O-N 2.88Å; G338-G359 PolarHBondContact O-N 2.8Å; G338-Y366 CarbonylContact C-O 3.55Å; G338-Y366 WeakPolarHBondContact CA-O 3.35Å
339	Q	94.7	Very high	88.1	Confident	12 Å²	12	47.3 Å²	47.3	6%	0.056	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	146.7	-178.5	179.7	170.7	84.9	0	0	110.5	A322 F325 L357 T358 Y366	A322-Q339 WeakPolarHBondContact CA-O 3.25Å; A322-Q339 PolarHBondContact N-O 3.41Å; A322-Q339 PolarHBondContact O-N 2.84Å; F325-Q339 HydrophobicContact CB-CB 3.74Å; F325-Q339 HydrophobicContact CD1-CB 3.63Å; F325-Q339 HydrophobicContact CD1-CG 4.48Å; F325-Q339 HydrophobicContact CD2-CB 4.31Å; F325-Q339 HydrophobicContact CE1-CB 4.32Å; F325-Q339 HydrophobicContact CG-CB 3.63Å; Q339-L357 CarbonylContact C-O 3.45Å; Q339-L357 WeakPolarHBondContact CA-O 3.18Å; Q339-T358 PolarHBondContact NE2-OG1 3.46Å; Q339-Y366 PolarHBondContact N-O 3.24Å
340	V	95.4	Very high	88.2	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.9	168.9	177.1	0	0	0	0	108.7	L319 I320 L357 Y366 I370 I386	L319-V340 HydrophobicContact CB-CG1 4.45Å; I320-V340 CarbonylContact O-C 3.42Å; I320-V340 VanDerWaalsContact O-CA 3.29Å; I320-V340 WeakPolarHBondContact O-CA 3.07Å; V340-L357 HydrophobicContact CB-CB 4.31Å; V340-L357 PolarHBondContact N-O 2.84Å; V340-L357 PolarHBondContact O-N 2.92Å; V340-Y366 HydrophobicContact CB-CE1 4.2Å; V340-Y366 HydrophobicContact CG2-CD1 4.14Å; V340-Y366 HydrophobicContact CG2-CE1 3.78Å; V340-I370 HydrophobicContact CG1-CD1 3.79Å; V340-I370 HydrophobicContact CG2-CD1 4.1Å; V340-I370 HydrophobicContact CG2-CG1 4.49Å; V340-I386 HydrophobicContact CB-CD1 4.23Å; V340-I386 HydrophobicContact CG1-CD1 4.13Å; V340-I386 HydrophobicContact CG2-CD1 4.14Å; V340-I386 HydrophobicContact CG2-CG2 3.8Å
341	S	94.4	Very high	88.3	Confident	4 Å²	4	43.7 Å²	43.7	3%	0.028	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	127.1	175.2	-60.1	0	0	0	0	109.6	L319 I320 L356	L319-S341 WeakPolarHBondContact CA-O 3.5Å; I320-S341 PolarHBondContact N-O 2.89Å; I320-S341 PolarHBondContact O-N 2.92Å; S341-L356 WeakPolarHBondContact OG-CD2 3.46Å
342	V	94.1	Very high	88.4	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	117.7	179.2	-175.6	0	0	0	0	108.5	L319 L344 P354 Q355 L357 I409	L319-V342 HydrophobicContact CD2-CG2 4.28Å; L319-V342 HydrophobicContact CG-CG1 4.34Å; L319-V342 HydrophobicContact CG-CG2 4.25Å; V342-L344 HydrophobicContact CG1-CD2 4.22Å; V342-P354 CarbonylContact O-C 3.32Å; V342-P354 VanDerWaalsContact O-CA 3.28Å; V342-P354 WeakPolarHBondContact O-CA 3.37Å; V342-Q355 HydrophobicContact CB-CB 4.26Å; V342-Q355 PolarHBondContact N-O 2.99Å; V342-Q355 PolarHBondContact O-N 2.85Å; V342-L357 HydrophobicContact CG2-CD1 3.99Å; V342-L357 HydrophobicContact CG2-CG 4.39Å; V342-I409 HydrophobicContact CB-CD1 4.46Å; V342-I409 HydrophobicContact CG1-CD1 3.77Å; V342-I409 HydrophobicContact CG1-CG1 4.12Å; V342-I409 HydrophobicContact CG2-CD1 3.83Å
343	Y	92.4	Very high	88.4	Confident	25 Å²	25	45.6 Å²	45.6	10%	0.098	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	106.2	178.7	-66.7	-91.8	0	0	0	109.1	F292 F301 V318 I320 P354	F292-Y343 AromaticContact CD1-CD1 3.73Å; F292-Y343 HydrophobicContact CD1-CD1 3.73Å; F292-Y343 HydrophobicContact CD1-CD2 4.3Å; F292-Y343 AromaticContact CD1-CE1 3.58Å; F292-Y343 HydrophobicContact CD1-CE1 3.58Å; F292-Y343 HydrophobicContact CD1-CE2 4.2Å; F292-Y343 HydrophobicContact CD1-CG 4.08Å; F292-Y343 AromaticContact CD1-CZ 3.83Å; F292-Y343 AromaticContact CE1-CD1 3.63Å; F292-Y343 HydrophobicContact CE1-CD1 3.63Å; F292-Y343 HydrophobicContact CE1-CD2 4.41Å; F292-Y343 AromaticContact CE1-CE1 3.99Å; F292-Y343 HydrophobicContact CE1-CE1 3.99Å; F292-Y343 AromaticContact CE1-CG 3.85Å; F292-Y343 HydrophobicContact CE1-CG 3.85Å; F292-Y343 HydrophobicContact CG-CE2 4.48Å; F292-Y343 HydrophobicContact CZ-CG 4.47Å; F301-Y343 HydrophobicContact CZ-CE2 4.33Å; V318-Y343 PolarHBondContact N-O 3.12Å; V318-Y343 PolarHBondContact O-N 3.4Å; I320-Y343 HydrophobicContact CD1-CD2 3.93Å; I320-Y343 HydrophobicContact CD1-CE2 3.69Å; I320-Y343 HydrophobicContact CG1-CD2 4.4Å; I320-Y343 HydrophobicContact CG1-CE2 4.37Å; Y343-P354 HydrophobicContact CD1-CB 3.89Å; Y343-P354 HydrophobicContact CD1-CG 4.45Å; Y343-P354 HydrophobicContact CD2-CB 4.48Å; Y343-P354 HydrophobicContact CE1-CB 3.57Å; Y343-P354 HydrophobicContact CE1-CG 3.77Å; Y343-P354 HydrophobicContact CE2-CB 4.17Å; Y343-P354 HydrophobicContact CG-CB 4.35Å
344	L	91	Very high	88.4	Confident	14 Å²	14	41.3 Å²	41.3	7%	0.073	23%	0.226	C	C	.	.			trans	-77.8	130.5	175.9	-59.4	176.7	0	0	0	110.2	V310 D317 V342 F351 Q352	V310-L344 HydrophobicContact CG2-CD2 3.73Å; D317-L344 HydrophobicContact CB-CD2 4.19Å; D317-L344 VanDerWaalsContact OD1-CA 3.23Å; D317-L344 WeakPolarHBondContact OD1-CA 3.13Å; V342-L344 HydrophobicContact CG1-CD2 4.22Å; L344-F351 CarbonylContact O-C 3.55Å; L344-F351 WeakPolarHBondContact O-CA 3.3Å; L344-Q352 HydrophobicContact CB-CB 4.3Å; L344-Q352 HydrophobicContact CB-CG 4.04Å; L344-Q352 WeakPolarHBondContact O-CG 3.43Å; L344-Q352 PolarHBondContact O-N 3.25Å
345	S	88.2	Confident	88.5	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.007	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-80.3	154	-179.8	-173.7	0	0	0	0	111.4	V316 D317 G347	V316-S345 WeakPolarHBondContact O-CB 3.5Å; D317-S345 PolarHBondContact OD1-N 3.18Å; S345-G347 PolarHBondContact OG-N 2.82Å
346	R	83.9	Confident	88.6	Confident	147 Å²	147	39.3 Å²	39.3	56%	0.555	22%	0.22	S	C	*	.			trans	-122.8	12.6	168.3	-67.3	-174	174.7	161.6	8	111.8	S350 Q352	R346-S350 PolarHBondContact N-O 2.97Å; R346-Q352 HydrophobicContact CG-CG 3.89Å; R346-Q352 VanDerWaalsContact NE-CD 3.32Å; R346-Q352 VanDerWaalsContact NE-CG 3.34Å; R346-Q352 VanDerWaalsContact NE-NE2 3.14Å; R346-Q352 VanDerWaalsContact NH2-CD 3.33Å
347	G	77.7	Confident	88.5	Confident	12 Å²	12	37.9 Å²	37.9	12%	0.124	21%	0.214	C	C	.	.	S	Bend	trans	81	158.5	-172.6	0	0	0	0	0	113.8	F315 S345 F349 S350	F315-G347 VanDerWaalsContact CE1-CA 3.45Å; S345-G347 PolarHBondContact OG-N 2.82Å; G347-F349 VanDerWaalsContact C-N 3.3Å; G347-F349 PolarHBondContact O-N 2.86Å; G347-S350 WeakPolarHBondContact O-CB 3.25Å; G347-S350 PolarHBondContact O-N 2.83Å
348	G	77.6	Confident	88.5	Confident	60 Å²	60	40.2 Å²	40.2	62%	0.619	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.3	35.4	176.7	0	0	0	0	0	113.9	F256 S350	F256-G348 PolarHBondContact O-N 2.91Å; G348-S350 PolarHBondContact O-N 2.92Å
349	F	80.8	Confident	88.3	Confident	29 Å²	29	40.6 Å²	40.6	13%	0.127	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	17.1	-173	-51.9	-79.5	0	0	0	115.2	F256 N257 I280 M289 I290 G347 F351	F256-F349 HydrophobicContact CB-CD1 3.79Å; F256-F349 HydrophobicContact CB-CE1 3.72Å; N257-F349 HydrophobicContact CB-CE2 3.63Å; N257-F349 HydrophobicContact CB-CZ 3.65Å; I280-F349 HydrophobicContact CG2-CD1 4.46Å; I280-F349 HydrophobicContact CG2-CE1 4.03Å; M289-F349 HydrophobicContact CB-CD1 4.15Å; M289-F349 HydrophobicContact CB-CE1 3.98Å; M289-F349 HydrophobicContact CB-CE2 4.43Å; M289-F349 HydrophobicContact CB-CG 4.46Å; M289-F349 HydrophobicContact CB-CZ 4.13Å; M289-F349 HydrophobicContact CE-CD2 4.01Å; M289-F349 HydrophobicContact CE-CE2 3.58Å; M289-F349 HydrophobicContact CE-CZ 4.12Å; M289-F349 HydrophobicContact CG-CE1 4.02Å; M289-F349 HydrophobicContact CG-CE2 4.18Å; M289-F349 HydrophobicContact CG-CZ 3.75Å; I290-F349 HydrophobicContact CD1-CB 3.43Å; I290-F349 VanDerWaalsContact CD1-CB 3.43Å; I290-F349 HydrophobicContact CD1-CG 4.48Å; I290-F349 WeakPolarHBondContact CD1-O 3.34Å; I290-F349 HydrophobicContact CG1-CB 4Å; G347-F349 VanDerWaalsContact C-N 3.3Å; G347-F349 PolarHBondContact O-N 2.86Å; F349-F351 VanDerWaalsContact O-CD2 3.32Å; F349-F351 WeakPolarHBondContact O-CD2 3.37Å; F349-F351 WeakPolarHBondContact O-CE2 3.41Å
350	S	83.9	Confident	87.8	Confident	62 Å²	62	44.3 Å²	44.3	43%	0.434	27%	0.265	S	S	.	.			trans	-87.8	132.9	173.3	-170.9	0	0	0	0	110.7	R346 G347 G348	R346-S350 PolarHBondContact N-O 2.97Å; G347-S350 WeakPolarHBondContact O-CB 3.25Å; G347-S350 PolarHBondContact O-N 2.83Å; G348-S350 PolarHBondContact O-N 2.92Å
351	F	86	Confident	87.4	Confident	35 Å²	35	47.5 Å²	47.5	15%	0.154	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-123.4	149	-179.1	-64.5	-86.3	0	0	0	111.9	F256 I280 I290 F292 V318 L344 F349	F256-F351 HydrophobicContact CD1-CE1 4.36Å; F256-F351 AromaticContact CD1-CZ 3.98Å; F256-F351 HydrophobicContact CD1-CZ 3.98Å; F256-F351 HydrophobicContact CE1-CE1 4.46Å; F256-F351 HydrophobicContact CE1-CZ 4.32Å; I280-F351 HydrophobicContact CD1-CE2 4.24Å; I280-F351 HydrophobicContact CD1-CZ 3.88Å; I290-F351 HydrophobicContact CD1-CD2 4.31Å; I290-F351 HydrophobicContact CD1-CE2 4.14Å; F292-F351 HydrophobicContact CE1-CB 4.45Å; F292-F351 HydrophobicContact CE1-CD1 4.49Å; F292-F351 AromaticContact CE1-CD2 3.82Å; F292-F351 HydrophobicContact CE1-CD2 3.82Å; F292-F351 HydrophobicContact CE1-CE2 4.18Å; F292-F351 AromaticContact CE1-CG 3.99Å; F292-F351 HydrophobicContact CE1-CG 3.99Å; F292-F351 HydrophobicContact CZ-CD1 4.22Å; F292-F351 AromaticContact CZ-CD2 3.65Å; F292-F351 HydrophobicContact CZ-CD2 3.65Å; F292-F351 HydrophobicContact CZ-CE1 4.11Å; F292-F351 AromaticContact CZ-CE2 3.53Å; F292-F351 HydrophobicContact CZ-CE2 3.53Å; F292-F351 HydrophobicContact CZ-CG 4.01Å; F292-F351 AromaticContact CZ-CZ 3.77Å; F292-F351 HydrophobicContact CZ-CZ 3.77Å; V318-F351 HydrophobicContact CG2-CE1 4.05Å; V318-F351 HydrophobicContact CG2-CZ 4.36Å; L344-F351 CarbonylContact O-C 3.55Å; L344-F351 WeakPolarHBondContact O-CA 3.3Å; F349-F351 VanDerWaalsContact O-CD2 3.32Å; F349-F351 WeakPolarHBondContact O-CD2 3.37Å; F349-F351 WeakPolarHBondContact O-CE2 3.41Å
352	Q	85.8	Confident	87.2	Confident	62 Å²	62	50 Å²	50	29%	0.29	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-74.7	162.1	172	-49.7	-152.8	18.7	0	0	111	L344 R346	L344-Q352 HydrophobicContact CB-CB 4.3Å; L344-Q352 HydrophobicContact CB-CG 4.04Å; L344-Q352 WeakPolarHBondContact O-CG 3.43Å; L344-Q352 PolarHBondContact O-N 3.25Å; R346-Q352 HydrophobicContact CG-CG 3.89Å; R346-Q352 VanDerWaalsContact NE-CD 3.32Å; R346-Q352 VanDerWaalsContact NE-CG 3.34Å; R346-Q352 VanDerWaalsContact NE-NE2 3.14Å; R346-Q352 VanDerWaalsContact NH2-CD 3.33Å
353	P	84.5	Confident	87.1	Confident	111 Å²	111	57.2 Å²	57.2	72%	0.721	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-51.5	134.6	167.2	-25.4	35.1	0	0	0	110.7
354	P	88.7	Confident	87	Confident	54 Å²	54	56.1 Å²	56.1	35%	0.351	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-67.8	137.6	-171.1	24.6	-32.6	0	0	0	111.7	V342 Y343 L356	V342-P354 CarbonylContact O-C 3.32Å; V342-P354 VanDerWaalsContact O-CA 3.28Å; V342-P354 WeakPolarHBondContact O-CA 3.37Å; Y343-P354 HydrophobicContact CD1-CB 3.89Å; Y343-P354 HydrophobicContact CD1-CG 4.45Å; Y343-P354 HydrophobicContact CD2-CB 4.48Å; Y343-P354 HydrophobicContact CE1-CB 3.57Å; Y343-P354 HydrophobicContact CE1-CG 3.77Å; Y343-P354 HydrophobicContact CE2-CB 4.17Å; Y343-P354 HydrophobicContact CG-CB 4.35Å; P354-L356 HydrophobicContact CB-CD2 4.47Å
355	Q	90.1	Very high	87.1	Confident	55 Å²	55	60.3 Å²	60.3	26%	0.257	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	130.6	164.7	-176.3	-178.2	0.3	0	0	109	V342 I409	V342-Q355 HydrophobicContact CB-CB 4.26Å; V342-Q355 PolarHBondContact N-O 2.99Å; V342-Q355 PolarHBondContact O-N 2.85Å; Q355-I409 PolarHBondContact NE2-O 2.84Å; Q355-I409 PolarHBondContact OE1-O 2.93Å
356	L	92	Very high	87.4	Confident	96 Å²	96	60.6 Å²	60.6	50%	0.503	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	124	-176.1	-57.5	175.5	0	0	0	110.5	S341 P354	S341-L356 WeakPolarHBondContact OG-CD2 3.46Å; P354-L356 HydrophobicContact CB-CD2 4.47Å
357	L	92.3	Very high	87.8	Confident	5 Å²	5	53.6 Å²	53.6	3%	0.026	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	113.9	173.4	-57.7	176.5	0	0	0	108.5	Q339 V340 V342 Y366 I386 I409	Q339-L357 CarbonylContact C-O 3.45Å; Q339-L357 WeakPolarHBondContact CA-O 3.18Å; V340-L357 HydrophobicContact CB-CB 4.31Å; V340-L357 PolarHBondContact N-O 2.84Å; V340-L357 PolarHBondContact O-N 2.92Å; V342-L357 HydrophobicContact CG2-CD1 3.99Å; V342-L357 HydrophobicContact CG2-CG 4.39Å; L357-Y366 HydrophobicContact CB-CE1 4.15Å; L357-Y366 WeakPolarHBondContact O-CE1 3.41Å; L357-I386 HydrophobicContact CD1-CD1 3.79Å; L357-I409 HydrophobicContact CD1-CG2 4.26Å
358	T	91.7	Very high	88.5	Confident	60 Å²	60	53.2 Å²	53.2	37%	0.368	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	137.2	-177.1	-53.7	0	0	0	0	110.6	D327 V337 Q339	D327-T358 HydrophobicContact CB-CG2 4.15Å; V337-T358 HydrophobicContact CB-CG2 4.48Å; V337-T358 HydrophobicContact CG2-CG2 3.49Å; V337-T358 VanDerWaalsContact CG2-CG2 3.49Å; Q339-T358 PolarHBondContact NE2-OG1 3.46Å
359	G	88.4	Confident	89.2	Confident	9 Å²	9	51.1 Å²	51.1	9%	0.093	28%	0.28	C	S	.	.			trans	-65	151.9	176	0	0	0	0	0	112.7	V337 G338	V337-G359 WeakPolarHBondContact CB-O 3.11Å; G338-G359 PolarHBondContact O-N 2.8Å
360	A	84.8	Confident	89.8	Confident	90 Å²	90	50.5 Å²	50.5	74%	0.744	28%	0.278	S	S	*	.	S	Bend	trans	-91.3	-24.7	179.6	0	0	0	0	0	113.7
361	E	87.5	Confident	90.2	Very high	66 Å²	66	47.9 Å²	47.9	31%	0.308	26%	0.26	S	S	.	.	S	Bend	trans	-108.7	142	-171.2	-69.8	-175.2	-176.3	0	0	112.6	A364 G391 G392	E361-A364 HydrophobicContact CB-CB 3.67Å; E361-G391 WeakPolarHBondContact OE2-CA 3.24Å; E361-G392 PolarHBondContact OE2-N 2.98Å
362	V	90.9	Very high	90.5	Very high	57 Å²	57	47.6 Å²	47.6	35%	0.345	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	135.4	-178.5	-167.8	0	0	0	0	110.3	R335 E336 A364	R335-V362 HydrophobicContact CB-CG1 4.31Å; R335-V362 HydrophobicContact CB-CG2 4.16Å; E336-V362 CarbonylContact O-C 3.6Å; E336-V362 WeakPolarHBondContact O-CA 3.38Å; V362-A364 PolarHBondContact O-N 3.2Å; V362-A364 VanDerWaalsContact O-N 3.16Å
363	Y	90.4	Very high	90.7	Very high	151 Å²	151	44.6 Å²	44.6	59%	0.592	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	12.3	-177.7	-53.4	-59.1	0	0	0	115.1	E336 R365	E336-Y363 HydrophobicContact CB-CD1 3.81Å; E336-Y363 HydrophobicContact CB-CE1 3.85Å; E336-Y363 HydrophobicContact CG-CD1 4.23Å; E336-Y363 PolarHBondContact O-N 3.09Å; E336-Y363 WeakPolarHBondContact OE2-CD1 3.39Å; Y363-R365 PolarHBondContact O-N 2.92Å
364	A	90.4	Very high	90.9	Very high	2 Å²	2	39.7 Å²	39.7	2%	0.017	22%	0.219	C	C	.	.	S	Bend	trans	-74.3	-18.3	178.9	0	0	0	0	0	112.9	E361 V362 A388 Y390	E361-A364 HydrophobicContact CB-CB 3.67Å; V362-A364 PolarHBondContact O-N 3.2Å; V362-A364 VanDerWaalsContact O-N 3.16Å; A364-A388 HydrophobicContact CB-CB 3.96Å; A364-A388 CarbonylContact O-C 3.44Å; A364-A388 VanDerWaalsContact O-CA 3.29Å; A364-A388 WeakPolarHBondContact O-CA 3.49Å; A364-A388 WeakPolarHBondContact O-CB 3.37Å; A364-Y390 PolarHBondContact O-N 2.8Å
365	R	93.3	Very high	90.9	Very high	102 Å²	102	39.2 Å²	39.2	39%	0.385	21%	0.214	S	C	.	.			trans	58.2	53	-178.5	-60	-169.2	-177.1	170.8	2.3	113.7	P323 L324 E336 Y363 G367 S368 Y390	P323-R365 HydrophobicContact CB-CB 4.01Å; P323-R365 WeakPolarHBondContact O-CA 3.17Å; L324-R365 HydrophobicContact CD2-CG 4.18Å; E336-R365 IonicContact OE1-NE 3.24Å; Y363-R365 PolarHBondContact O-N 2.92Å; R365-G367 PolarHBondContact O-N 2.91Å; R365-S368 WeakPolarHBondContact CB-OG 3.16Å; R365-S368 PolarHBondContact O-N 3.01Å; R365-S368 PolarHBondContact O-OG 3.29Å; R365-Y390 HydrophobicContact CB-CD2 4.18Å; R365-Y390 HydrophobicContact CG-CD2 4.04Å; R365-Y390 HydrophobicContact CG-CE2 4.49Å
366	Y	94.7	Very high	90.9	Very high	8 Å²	8	36.6 Å²	36.6	3%	0.031	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	127.3	175.9	-178.3	-98.7	0	0	0	111.2	P323 V337 G338 Q339 V340 L357 I386 S387 A388 Y400 H402	P323-Y366 WeakPolarHBondContact CA-O 3.49Å; V337-Y366 WeakPolarHBondContact O-CB 3.24Å; V337-Y366 PolarHBondContact O-N 2.97Å; G338-Y366 CarbonylContact C-O 3.55Å; G338-Y366 WeakPolarHBondContact CA-O 3.35Å; Q339-Y366 PolarHBondContact N-O 3.24Å; V340-Y366 HydrophobicContact CB-CE1 4.2Å; V340-Y366 HydrophobicContact CG2-CD1 4.14Å; V340-Y366 HydrophobicContact CG2-CE1 3.78Å; L357-Y366 HydrophobicContact CB-CE1 4.15Å; L357-Y366 WeakPolarHBondContact O-CE1 3.41Å; Y366-I386 HydrophobicContact CD1-CG2 4.34Å; Y366-I386 HydrophobicContact CD2-CG2 3.97Å; Y366-I386 HydrophobicContact CE1-CG2 3.92Å; Y366-I386 HydrophobicContact CE2-CB 4.05Å; Y366-I386 HydrophobicContact CE2-CG2 3.5Å; Y366-I386 VanDerWaalsContact CE2-CG2 3.5Å; Y366-I386 HydrophobicContact CG-CG2 4.36Å; Y366-I386 VanDerWaalsContact CZ-CG2 3.48Å; Y366-I386 VanDerWaalsContact OH-CD1 3.26Å; Y366-I386 WeakPolarHBondContact OH-CD1 3.43Å; Y366-S387 WeakPolarHBondContact CA-O 3.33Å; Y366-A388 HydrophobicContact CD2-CB 4.43Å; Y366-Y400 AromaticContact CD2-CD2 3.77Å; Y366-Y400 HydrophobicContact CD2-CD2 3.77Å; Y366-Y400 AromaticContact CD2-CE2 3.85Å; Y366-Y400 HydrophobicContact CD2-CE2 3.85Å; Y366-Y400 AromaticContact CE2-CD2 3.6Å; Y366-Y400 HydrophobicContact CE2-CD2 3.6Å; Y366-Y400 HydrophobicContact CE2-CE2 4.09Å; Y366-Y400 HydrophobicContact CE2-CG 4.02Å; Y366-H402 PolarHBondContact OH-NE2 2.76Å; Y366-H402 VanDerWaalsContact OH-NE2 3.08Å
367	G	92.9	Very high	90.6	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.9	25.5	-173.9	0	0	0	0	0	113.9	S304 R365 S387	S304-G367 PolarHBondContact OG-O 2.97Å; R365-G367 PolarHBondContact O-N 2.91Å; G367-S387 PolarHBondContact N-O 2.93Å
368	S	92.1	Very high	90.2	Very high	4 Å²	4	38.2 Å²	38.2	3%	0.028	20%	0.201	C	C	.	.	S	Bend	trans	-73.2	-37.2	171.6	-66.8	0	0	0	0	112.2	Y303 R365 P389	Y303-S368 VanDerWaalsContact CD1-O 3.22Å; Y303-S368 WeakPolarHBondContact CD1-O 3.31Å; Y303-S368 WeakPolarHBondContact CE1-O 3.35Å; R365-S368 WeakPolarHBondContact CB-OG 3.16Å; R365-S368 PolarHBondContact O-N 3.01Å; R365-S368 PolarHBondContact O-OG 3.29Å; S368-P389 WeakPolarHBondContact OG-CD 3.48Å
369	S	92	Very high	89.8	Confident	16 Å²	16	37.9 Å²	37.9	11%	0.112	20%	0.198	C	C	.	.			trans	-140.7	137	174	179.5	0	0	0	0	108.4	S387 G431 Y432 M434	S369-S387 WeakPolarHBondContact CA-OG 3.42Å; S369-S387 WeakPolarHBondContact CB-OG 3.48Å; S369-S387 PolarHBondContact N-OG 2.71Å; S369-S387 PolarHBondContact O-N 2.76Å; S369-S387 PolarHBondContact O-OG 3.25Å; S369-G431 WeakPolarHBondContact CB-O 3.07Å; S369-Y432 WeakPolarHBondContact CB-O 3.31Å; S369-M434 WeakPolarHBondContact O-CE 3.37Å
370	I	93.8	Very high	89.6	Confident	15 Å²	15	39.6 Å²	39.6	8%	0.077	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	127.3	177.5	-55.8	168.7	0	0	0	106	S304 A306 L319 V340 A385 I386	S304-I370 WeakPolarHBondContact OG-CD1 3.37Å; S304-I370 WeakPolarHBondContact OG-CG1 3.46Å; A306-I370 HydrophobicContact CB-CB 4.04Å; A306-I370 HydrophobicContact CB-CG2 3.6Å; L319-I370 HydrophobicContact CB-CD1 4.2Å; L319-I370 HydrophobicContact CB-CG2 4.2Å; L319-I370 HydrophobicContact CD2-CG2 4.02Å; V340-I370 HydrophobicContact CG1-CD1 3.79Å; V340-I370 HydrophobicContact CG2-CD1 4.1Å; V340-I370 HydrophobicContact CG2-CG1 4.49Å; I370-A385 WeakPolarHBondContact CA-O 3.03Å; I370-I386 HydrophobicContact CG1-CG1 4.48Å; I370-I386 HydrophobicContact CG2-CG1 4.43Å
371	A	92.2	Very high	89.9	Confident	7 Å²	7	38.5 Å²	38.5	6%	0.058	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130.2	177.1	0	0	0	0	0	110.2	A385 M434	A371-A385 HydrophobicContact CB-CB 4.47Å; A371-A385 PolarHBondContact N-O 2.92Å; A371-A385 PolarHBondContact O-N 2.95Å; A371-M434 HydrophobicContact CB-CB 3.71Å; A371-M434 HydrophobicContact CB-CE 4.3Å
372	A	91.7	Very high	90.1	Very high	29 Å²	29	38.7 Å²	38.7	24%	0.24	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	125.7	169.2	0	0	0	0	0	108.9	G436	A372-G436 CarbonylContact O-C 3.59Å
373	L	90.1	Very high	90.2	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	-13.4	-179.6	-58	177.5	0	0	0	112	L376 D383 A385 I401 S437 P446 L448	L373-L376 HydrophobicContact CB-CD1 4.45Å; L373-L376 HydrophobicContact CD1-CD2 3.94Å; L373-D383 HydrophobicContact CB-CB 4.39Å; L373-D383 WeakPolarHBondContact CB-O 3.24Å; L373-D383 HydrophobicContact CD1-CB 4.47Å; L373-D383 PolarHBondContact N-O 2.86Å; L373-A385 HydrophobicContact CD1-CB 3.93Å; L373-A385 HydrophobicContact CD2-CB 3.89Å; L373-A385 HydrophobicContact CG-CB 4.05Å; L373-I401 HydrophobicContact CD1-CD1 3.85Å; L373-I401 HydrophobicContact CD1-CG2 3.99Å; L373-S437 WeakPolarHBondContact O-CA 3.49Å; L373-S437 PolarHBondContact O-N 2.79Å; L373-P446 VanDerWaalsContact O-CB 3.26Å; L373-P446 WeakPolarHBondContact O-CB 3.35Å; L373-P446 WeakPolarHBondContact O-CG 3.46Å; L373-L448 HydrophobicContact CD2-CB 4.25Å; L373-L448 HydrophobicContact CD2-CD1 3.6Å; L373-L448 HydrophobicContact CD2-CD2 4.24Å; L373-L448 HydrophobicContact CD2-CG 4.22Å
374	G	88.3	Confident	90.3	Very high	7 Å²	7	28.8 Å²	28.8	7%	0.072	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	70.3	-160.5	-162.8	0	0	0	0	0	110	L376 D383	G374-L376 PolarHBondContact O-N 2.89Å; G374-D383 PolarHBondContact O-N 3.41Å
375	D	89.9	Confident	90.5	Very high	44 Å²	44	28.7 Å²	28.7	24%	0.235	15%	0.146	C	C	.	.			trans	-81.7	99.1	179	-174.1	-10.8	0	0	0	109.7	R378 D379 G380 Y381 P446	D375-R378 VanDerWaalsContact CG-CA 3.43Å; D375-R378 WeakPolarHBondContact OD1-CA 3.43Å; D375-R378 PolarHBondContact OD1-N 2.79Å; D375-R378 WeakPolarHBondContact OD2-CA 3.49Å; D375-D379 PolarHBondContact OD1-N 3.16Å; D375-G380 WeakPolarHBondContact OD2-CA 3.48Å; D375-G380 PolarHBondContact OD2-N 3.31Å; D375-G380 VanDerWaalsContact OD2-N 3.15Å; D375-Y381 WeakPolarHBondContact CA-O 3.46Å; D375-Y381 VanDerWaalsContact CB-O 3.28Å; D375-Y381 WeakPolarHBondContact CB-O 3.35Å; D375-P446 WeakPolarHBondContact O-CD 3.47Å; D375-P446 VanDerWaalsContact O-CG 3.3Å; D375-P446 WeakPolarHBondContact O-CG 3.28Å
376	L	89.3	Confident	90.6	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.128	C	C	.	.	S	Bend	trans	-81.5	-26.3	-170.3	-165.4	70.4	0	0	0	112	N25 L26 L373 G374 D383 I401 Y445 P446 A463	N25-L376 VanDerWaalsContact ND2-C 3.27Å; N25-L376 WeakPolarHBondContact ND2-CD2 3.43Å; N25-L376 WeakPolarHBondContact ND2-CG 3.49Å; N25-L376 PolarHBondContact ND2-O 2.73Å; N25-L376 WeakPolarHBondContact OD1-CD2 3.38Å; L26-L376 HydrophobicContact CD1-CD2 4.28Å; L26-L376 HydrophobicContact CD2-CD1 4.11Å; L26-L376 HydrophobicContact CD2-CD2 4.5Å; L26-L376 HydrophobicContact CG-CD2 4.11Å; L373-L376 HydrophobicContact CB-CD1 4.45Å; L373-L376 HydrophobicContact CD1-CD2 3.94Å; G374-L376 PolarHBondContact O-N 2.89Å; L376-D383 WeakPolarHBondContact CA-OD2 3.24Å; L376-D383 HydrophobicContact CB-CB 4.17Å; L376-D383 WeakPolarHBondContact CB-OD2 3.22Å; L376-D383 PolarHBondContact N-OD2 3.28Å; L376-I401 HydrophobicContact CD2-CG2 3.9Å; L376-Y445 VanDerWaalsContact O-CD1 3.29Å; L376-Y445 WeakPolarHBondContact O-CD1 3.34Å; L376-P446 HydrophobicContact CD1-CG 4.08Å; L376-P446 WeakPolarHBondContact CD1-O 3.3Å; L376-A463 HydrophobicContact CD1-CB 4.09Å
377	D	85.1	Confident	90.6	Very high	8 Å²	8	23.5 Å²	23.5	4%	0.043	13%	0.127	C	C	.	.	S	Bend	trans	-115.2	-3.6	-178.4	66.4	-15.5	0	0	0	114.5	F24 D379 V466 W606	F24-D377 HydrophobicContact CE1-CB 3.51Å; F24-D377 HydrophobicContact CZ-CB 3.63Å; F24-D377 WeakPolarHBondContact CZ-OD2 3.45Å; D377-D379 VanDerWaalsContact C-N 3.32Å; D377-D379 VanDerWaalsContact OD1-CG 3.26Å; D377-D379 PolarHBondContact OD1-N 2.79Å; D377-V466 HydrophobicContact CB-CG2 4.07Å; D377-W606 WeakPolarHBondContact OD2-CH2 3.39Å; D377-W606 WeakPolarHBondContact OD2-CZ3 3.33Å
378	R	84	Confident	90.7	Very high	127 Å²	127	23.5 Å²	23.5	48%	0.479	13%	0.127	S	C	.	.	S	Bend	trans	62.6	36.8	-177.1	-68.5	-172.3	170	-119.3	5.1	113	D375 G380 G444 Y445	D375-R378 VanDerWaalsContact CG-CA 3.43Å; D375-R378 WeakPolarHBondContact OD1-CA 3.43Å; D375-R378 PolarHBondContact OD1-N 2.79Å; D375-R378 WeakPolarHBondContact OD2-CA 3.49Å; R378-G380 VanDerWaalsContact C-N 3.28Å; R378-G444 PolarHBondContact NE-O 3.31Å; R378-G444 PolarHBondContact NH2-O 3.08Å; R378-Y445 HydrophobicContact CB-CE1 4.08Å; R378-Y445 HydrophobicContact CG-CD1 4.09Å; R378-Y445 HydrophobicContact CG-CE1 3.79Å
379	D	83.2	Confident	90.7	Very high	54 Å²	54	23.3 Å²	23.3	29%	0.289	13%	0.125	S	C	.	.	S	Bend	trans	-80.8	-11.4	173.4	77.8	-8.2	0	0	0	113	D375 D377 Y381 W606	D375-D379 PolarHBondContact OD1-N 3.16Å; D377-D379 VanDerWaalsContact C-N 3.32Å; D377-D379 VanDerWaalsContact OD1-CG 3.26Å; D377-D379 PolarHBondContact OD1-N 2.79Å; D379-Y381 WeakPolarHBondContact OD1-CA 3.26Å; D379-Y381 WeakPolarHBondContact OD1-CB 3.37Å; D379-Y381 PolarHBondContact OD1-N 3.28Å; D379-W606 HydrophobicContact CB-CZ3 4.44Å
380	G	86	Confident	90.6	Very high	44 Å²	44	24.5 Å²	24.5	45%	0.454	13%	0.128	S	C	.	.	S	Bend	trans	100.4	-1	-179	0	0	0	0	0	114.1	S312 D375 R378	S312-G380 WeakPolarHBondContact CB-O 3.34Å; S312-G380 PolarHBondContact OG-O 3.25Å; D375-G380 WeakPolarHBondContact OD2-CA 3.48Å; D375-G380 PolarHBondContact OD2-N 3.31Å; D375-G380 VanDerWaalsContact OD2-N 3.15Å; R378-G380 VanDerWaalsContact C-N 3.28Å
381	Y	90.6	Very high	90.3	Very high	67 Å²	67	23.8 Å²	23.8	26%	0.263	12%	0.124	S	C	.	.	S	Bend	trans	-112.2	158.4	173.9	-59.4	-75.6	0	0	0	110.6	N311 D375 D379 A406	N311-Y381 WeakPolarHBondContact O-CD1 3.41Å; N311-Y381 VanDerWaalsContact O-CE1 3.25Å; N311-Y381 WeakPolarHBondContact O-CE1 3.25Å; D375-Y381 WeakPolarHBondContact CA-O 3.46Å; D375-Y381 VanDerWaalsContact CB-O 3.28Å; D375-Y381 WeakPolarHBondContact CB-O 3.35Å; D379-Y381 WeakPolarHBondContact OD1-CA 3.26Å; D379-Y381 WeakPolarHBondContact OD1-CB 3.37Å; D379-Y381 PolarHBondContact OD1-N 3.28Å; Y381-A406 HydrophobicContact CE1-CB 4.18Å
382	K	91	Very high	90	Very high	70 Å²	70	23.8 Å²	23.8	30%	0.304	13%	0.125	S	C	.	.			trans	-97.4	139.5	177.5	-58.2	-176.9	-166.9	128.2	0	110.4	D309 G404	D309-K382 WeakPolarHBondContact O-CB 3.43Å; D309-K382 VanDerWaalsContact O-CD 3.26Å; D309-K382 WeakPolarHBondContact O-CD 3.18Å; D309-K382 WeakPolarHBondContact O-CG 3.47Å; D309-K382 IonicContact OD2-NZ 2.96Å; D309-K382 PolarHBondContact OD2-NZ 3.49Å; K382-G404 WeakPolarHBondContact O-CA 3.29Å
383	D	92.5	Very high	89.4	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	159.9	-176.3	-53.4	-44.6	0	0	0	112.3	L373 G374 L376 N403 G404	L373-D383 HydrophobicContact CB-CB 4.39Å; L373-D383 WeakPolarHBondContact CB-O 3.24Å; L373-D383 HydrophobicContact CD1-CB 4.47Å; L373-D383 PolarHBondContact N-O 2.86Å; G374-D383 PolarHBondContact O-N 3.41Å; L376-D383 WeakPolarHBondContact CA-OD2 3.24Å; L376-D383 HydrophobicContact CB-CB 4.17Å; L376-D383 WeakPolarHBondContact CB-OD2 3.22Å; L376-D383 PolarHBondContact N-OD2 3.28Å; D383-N403 WeakPolarHBondContact OD1-CA 3.26Å; D383-N403 PolarHBondContact OD1-ND2 2.77Å; D383-N403 PolarHBondContact OD2-ND2 2.68Å; D383-G404 PolarHBondContact OD1-N 3.27Å
384	V	93.8	Very high	88.9	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.006	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	143.7	-179.1	-58.5	0	0	0	0	112	V310 L319 H402 I409	V310-V384 HydrophobicContact CG1-CG1 3.91Å; L319-V384 HydrophobicContact CD2-CB 4.2Å; L319-V384 HydrophobicContact CD2-CG1 3.92Å; L319-V384 HydrophobicContact CD2-CG2 3.97Å; V384-H402 HydrophobicContact CG2-CB 3.92Å; V384-H402 PolarHBondContact N-O 3.12Å; V384-H402 PolarHBondContact O-N 3.32Å; V384-I409 HydrophobicContact CG1-CD1 4.41Å; V384-I409 HydrophobicContact CG2-CD1 3.85Å; V384-I409 HydrophobicContact CG2-CG2 4.4Å
385	A	94.6	Very high	88.7	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	130.6	169.2	0	0	0	0	0	110.3	I370 A371 L373 V399 Y400 I401 M434 L448	I370-A385 WeakPolarHBondContact CA-O 3.03Å; A371-A385 HydrophobicContact CB-CB 4.47Å; A371-A385 PolarHBondContact N-O 2.92Å; A371-A385 PolarHBondContact O-N 2.95Å; L373-A385 HydrophobicContact CD1-CB 3.93Å; L373-A385 HydrophobicContact CD2-CB 3.89Å; L373-A385 HydrophobicContact CG-CB 4.05Å; A385-V399 HydrophobicContact CB-CG1 4.06Å; A385-Y400 CarbonylContact C-O 3.54Å; A385-Y400 WeakPolarHBondContact CA-O 3.43Å; A385-I401 HydrophobicContact CB-CD1 3.82Å; A385-M434 HydrophobicContact CB-CE 4.12Å; A385-M434 HydrophobicContact CB-SD 4.26Å; A385-M434 WeakPolarHBondContact O-CE 3.49Å; A385-L448 HydrophobicContact CB-CD2 4.4Å
386	I	95.4	Very high	88.5	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	129	175.7	-58.5	170.8	0	0	0	108.8	V340 L357 Y366 I370 Y400	V340-I386 HydrophobicContact CB-CD1 4.23Å; V340-I386 HydrophobicContact CG1-CD1 4.13Å; V340-I386 HydrophobicContact CG2-CD1 4.14Å; V340-I386 HydrophobicContact CG2-CG2 3.8Å; L357-I386 HydrophobicContact CD1-CD1 3.79Å; Y366-I386 HydrophobicContact CD1-CG2 4.34Å; Y366-I386 HydrophobicContact CD2-CG2 3.97Å; Y366-I386 HydrophobicContact CE1-CG2 3.92Å; Y366-I386 HydrophobicContact CE2-CB 4.05Å; Y366-I386 HydrophobicContact CE2-CG2 3.5Å; Y366-I386 VanDerWaalsContact CE2-CG2 3.5Å; Y366-I386 HydrophobicContact CG-CG2 4.36Å; Y366-I386 VanDerWaalsContact CZ-CG2 3.48Å; Y366-I386 VanDerWaalsContact OH-CD1 3.26Å; Y366-I386 WeakPolarHBondContact OH-CD1 3.43Å; I370-I386 HydrophobicContact CG1-CG1 4.48Å; I370-I386 HydrophobicContact CG2-CG1 4.43Å; I386-Y400 PolarHBondContact N-O 2.8Å; I386-Y400 PolarHBondContact O-N 2.71Å
387	S	94.2	Very high	88.5	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	150	-177.8	59.8	0	0	0	0	113.5	Y366 G367 S369 G431	Y366-S387 WeakPolarHBondContact CA-O 3.33Å; G367-S387 PolarHBondContact N-O 2.93Å; S369-S387 WeakPolarHBondContact CA-OG 3.42Å; S369-S387 WeakPolarHBondContact CB-OG 3.48Å; S369-S387 PolarHBondContact N-OG 2.71Å; S369-S387 PolarHBondContact O-N 2.76Å; S369-S387 PolarHBondContact O-OG 3.25Å; S387-G431 WeakPolarHBondContact CB-O 3.05Å; S387-G431 PolarHBondContact OG-O 2.9Å
388	A	94.9	Very high	88.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	84.5	164.3	0	0	0	0	0	108.2	A364 Y366 Y390 G391 L398 Y400	A364-A388 HydrophobicContact CB-CB 3.96Å; A364-A388 CarbonylContact O-C 3.44Å; A364-A388 VanDerWaalsContact O-CA 3.29Å; A364-A388 WeakPolarHBondContact O-CA 3.49Å; A364-A388 WeakPolarHBondContact O-CB 3.37Å; Y366-A388 HydrophobicContact CD2-CB 4.43Å; A388-Y390 PolarHBondContact O-N 3.37Å; A388-G391 PolarHBondContact O-N 2.89Å; A388-L398 CarbonylContact C-O 3.5Å; A388-L398 PolarHBondContact N-O 2.81Å; A388-L398 PolarHBondContact O-N 3.04Å; A388-Y400 HydrophobicContact CB-CE2 3.79Å
389	P	92.1	Very high	89.3	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-11.3	-164.6	24.5	-33.6	0	0	0	115.3	S368 G397 F430	S368-P389 WeakPolarHBondContact OG-CD 3.48Å; P389-G397 VanDerWaalsContact O-CA 3.24Å; P389-G397 WeakPolarHBondContact O-CA 3.48Å; P389-F430 WeakPolarHBondContact CA-O 3.45Å
390	Y	90.9	Very high	89.8	Confident	41 Å²	41	29.3 Å²	29.3	16%	0.161	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.1	11.6	177.9	-51.5	-76.4	0	0	0	112.5	A364 R365 A388 H395 P427 S429	A364-Y390 PolarHBondContact O-N 2.8Å; R365-Y390 HydrophobicContact CB-CD2 4.18Å; R365-Y390 HydrophobicContact CG-CD2 4.04Å; R365-Y390 HydrophobicContact CG-CE2 4.49Å; A388-Y390 PolarHBondContact O-N 3.37Å; Y390-H395 PolarHBondContact O-ND1 2.99Å; Y390-P427 HydrophobicContact CD1-CB 3.81Å; Y390-P427 HydrophobicContact CD1-CG 4.16Å; Y390-P427 HydrophobicContact CE1-CB 3.85Å; Y390-P427 HydrophobicContact CE1-CG 4.12Å; Y390-S429 WeakPolarHBondContact CE1-OG 3.21Å
391	G	86.6	Confident	90.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.137	C	C	.	.			trans	-78.9	174.3	175.8	0	0	0	0	0	113.8	E361 A388 H395 N396 G397	E361-G391 WeakPolarHBondContact OE2-CA 3.24Å; A388-G391 PolarHBondContact O-N 2.89Å; G391-H395 CarbonylContact O-C 3.51Å; G391-H395 WeakPolarHBondContact O-CA 3.38Å; G391-N396 PolarHBondContact O-N 3.35Å; G391-G397 WeakPolarHBondContact O-CA 3.31Å; G391-G397 PolarHBondContact O-N 3.07Å
392	G	86.3	Confident	90.3	Very high	8 Å²	8	24.3 Å²	24.3	8%	0.082	13%	0.125	C	C	.	.	S	Bend	trans	91.2	165.3	-178.7	0	0	0	0	0	113.3	E361 D394 H395	E361-G392 PolarHBondContact OE2-N 2.98Å; G392-D394 PolarHBondContact O-N 3.08Å; G392-D394 VanDerWaalsContact O-N 3.11Å; G392-H395 PolarHBondContact O-N 2.93Å; G392-H395 VanDerWaalsContact O-N 3.09Å
393	P	78.8	Confident	90.2	Very high	103 Å²	103	21.2 Å²	21.2	67%	0.669	11%	0.112	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-27.1	-175	22.3	-33.3	0	0	0	114.2
394	D	79.6	Confident	90.1	Very high	110 Å²	110	21.3 Å²	21.3	59%	0.588	11%	0.114	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.8	10.7	-179.5	-58.1	-48.3	0	0	0	113.1	G392 N396	G392-D394 PolarHBondContact O-N 3.08Å; G392-D394 VanDerWaalsContact O-N 3.11Å; D394-N396 PolarHBondContact O-N 2.03Å; D394-N396 PolarHBondContact O-OD1 2.8Å
395	H	84.1	Confident	89.7	Confident	109 Å²	109	25.9 Å²	25.9	51%	0.505	13%	0.134	S	C	.	.	S	Bend	trans	56.5	28.5	-172.6	-55.7	-67.9	0	0	0	114.5	Y390 G391 G392 G397	Y390-H395 PolarHBondContact O-ND1 2.99Å; G391-H395 CarbonylContact O-C 3.51Å; G391-H395 WeakPolarHBondContact O-CA 3.38Å; G392-H395 PolarHBondContact O-N 2.93Å; G392-H395 VanDerWaalsContact O-N 3.09Å; H395-G397 VanDerWaalsContact C-N 3.25Å; H395-G397 PolarHBondContact O-N 3.26Å
396	N	84.7	Confident	89.3	Confident	22 Å²	22	28.4 Å²	28.4	12%	0.118	16%	0.156	C	C	.	.			trans	-77.3	-9.9	179.6	-68.2	-18.6	0	0	0	113.3	G391 D394 G419 W421 F430	G391-N396 PolarHBondContact O-N 3.35Å; D394-N396 PolarHBondContact O-N 2.03Å; D394-N396 PolarHBondContact O-OD1 2.8Å; N396-G419 VanDerWaalsContact CB-O 3.27Å; N396-G419 WeakPolarHBondContact CB-O 3.32Å; N396-W421 PolarHBondContact OD1-O 3.42Å; N396-F430 WeakPolarHBondContact O-CB 3.44Å
397	G	90.1	Very high	88.7	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.184	C	C	.	.			trans	96.8	146.4	178.4	0	0	0	0	0	114	P389 G391 H395 G419	P389-G397 VanDerWaalsContact O-CA 3.24Å; P389-G397 WeakPolarHBondContact O-CA 3.48Å; G391-G397 WeakPolarHBondContact O-CA 3.31Å; G391-G397 PolarHBondContact O-N 3.07Å; H395-G397 VanDerWaalsContact C-N 3.25Å; H395-G397 PolarHBondContact O-N 3.26Å; G397-G419 PolarHBondContact O-N 2.95Å
398	L	92.4	Very high	88.3	Confident	11 Å²	11	32.5 Å²	32.5	6%	0.058	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	147.6	179.6	-62.1	174.9	0	0	0	110.8	A388 Y400 V416 L417 Q418	A388-L398 CarbonylContact C-O 3.5Å; A388-L398 PolarHBondContact N-O 2.81Å; A388-L398 PolarHBondContact O-N 3.04Å; L398-Y400 HydrophobicContact CB-CE2 3.97Å; L398-Y400 VanDerWaalsContact CD1-OH 3.31Å; L398-Y400 WeakPolarHBondContact CD1-OH 3.41Å; L398-V416 HydrophobicContact CB-CG1 4.34Å; L398-V416 HydrophobicContact CD2-CG1 4.1Å; L398-L417 CarbonylContact C-O 3.53Å; L398-L417 WeakPolarHBondContact CA-O 3.44Å; L398-Q418 HydrophobicContact CD2-CB 4.02Å; L398-Q418 HydrophobicContact CD2-CG 3.94Å
399	V	94.3	Very high	87.9	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	123.1	169.6	177.9	0	0	0	0	108.8	A385 I401 V416 L417 F430 M434 V450	A385-V399 HydrophobicContact CB-CG1 4.06Å; V399-I401 HydrophobicContact CG1-CD1 4.27Å; V399-V416 CarbonylContact O-C 3.59Å; V399-V416 WeakPolarHBondContact O-CA 3.29Å; V399-L417 HydrophobicContact CB-CB 4.19Å; V399-L417 HydrophobicContact CB-CD1 4.4Å; V399-L417 HydrophobicContact CG1-CD1 4.45Å; V399-L417 PolarHBondContact N-O 2.78Å; V399-L417 PolarHBondContact O-N 3Å; V399-F430 HydrophobicContact CB-CE1 4.39Å; V399-F430 HydrophobicContact CG2-CD1 4.14Å; V399-F430 HydrophobicContact CG2-CE1 3.71Å; V399-F430 HydrophobicContact CG2-CZ 4.39Å; V399-M434 HydrophobicContact CB-SD 4.28Å; V399-M434 HydrophobicContact CG1-SD 3.51Å; V399-M434 VanDerWaalsContact CG1-SD 3.51Å; V399-M434 HydrophobicContact CG2-SD 3.71Å; V399-V450 HydrophobicContact CG2-CG1 4.14Å
400	Y	93.4	Very high	87.7	Confident	29 Å²	29	35.7 Å²	35.7	11%	0.114	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	131.3	179.7	-59.6	-91.5	0	0	0	109.5	Y366 A385 I386 A388 L398 A413 V416	Y366-Y400 AromaticContact CD2-CD2 3.77Å; Y366-Y400 HydrophobicContact CD2-CD2 3.77Å; Y366-Y400 AromaticContact CD2-CE2 3.85Å; Y366-Y400 HydrophobicContact CD2-CE2 3.85Å; Y366-Y400 AromaticContact CE2-CD2 3.6Å; Y366-Y400 HydrophobicContact CE2-CD2 3.6Å; Y366-Y400 HydrophobicContact CE2-CE2 4.09Å; Y366-Y400 HydrophobicContact CE2-CG 4.02Å; A385-Y400 CarbonylContact C-O 3.54Å; A385-Y400 WeakPolarHBondContact CA-O 3.43Å; I386-Y400 PolarHBondContact N-O 2.8Å; I386-Y400 PolarHBondContact O-N 2.71Å; A388-Y400 HydrophobicContact CB-CE2 3.79Å; L398-Y400 HydrophobicContact CB-CE2 3.97Å; L398-Y400 VanDerWaalsContact CD1-OH 3.31Å; L398-Y400 WeakPolarHBondContact CD1-OH 3.41Å; Y400-A413 HydrophobicContact CD1-CB 4Å; Y400-V416 HydrophobicContact CD1-CG1 4.14Å; Y400-V416 HydrophobicContact CD1-CG2 3.67Å; Y400-V416 HydrophobicContact CE1-CG1 4.02Å; Y400-V416 HydrophobicContact CE1-CG2 3.92Å
401	I	93.4	Very high	87.4	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	123.8	173.9	-50.9	-59.6	0	0	0	107.8	L26 L373 L376 A385 V399 A413 S414 Q415 L448	L26-I401 HydrophobicContact CD1-CD1 3.88Å; L26-I401 HydrophobicContact CD1-CG1 4.09Å; L373-I401 HydrophobicContact CD1-CD1 3.85Å; L373-I401 HydrophobicContact CD1-CG2 3.99Å; L376-I401 HydrophobicContact CD2-CG2 3.9Å; A385-I401 HydrophobicContact CB-CD1 3.82Å; V399-I401 HydrophobicContact CG1-CD1 4.27Å; I401-A413 CarbonylContact O-C 3.59Å; I401-A413 VanDerWaalsContact O-CA 3.24Å; I401-A413 WeakPolarHBondContact O-CA 3.44Å; I401-A413 WeakPolarHBondContact O-CB 3.34Å; I401-S414 PolarHBondContact O-N 3.22Å; I401-S414 PolarHBondContact O-OG 3.37Å; I401-Q415 HydrophobicContact CB-CB 4.2Å; I401-Q415 HydrophobicContact CG1-CB 4.17Å; I401-Q415 PolarHBondContact N-O 3.18Å; I401-L448 HydrophobicContact CD1-CD2 4.03Å
402	H	92.3	Very high	87.4	Confident	6 Å²	6	41.9 Å²	41.9	3%	0.028	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	127.7	176.9	-69.5	-97.1	0	0	0	109.5	Y366 V384 I409 D410	Y366-H402 PolarHBondContact OH-NE2 2.76Å; Y366-H402 VanDerWaalsContact OH-NE2 3.08Å; V384-H402 HydrophobicContact CG2-CB 3.92Å; V384-H402 PolarHBondContact N-O 3.12Å; V384-H402 PolarHBondContact O-N 3.32Å; H402-I409 HydrophobicContact CB-CG2 3.54Å; H402-D410 PolarHBondContact ND1-O 2.87Å
403	N	90.6	Very high	87.6	Confident	5 Å²	5	43.1 Å²	43.1	3%	0.027	26%	0.256	C	S	.	.			trans	-82.9	146.4	178.3	-70.8	98.7	0	0	0	112.2	D383 D410 S414 W606	D383-N403 WeakPolarHBondContact OD1-CA 3.26Å; D383-N403 PolarHBondContact OD1-ND2 2.77Å; D383-N403 PolarHBondContact OD2-ND2 2.68Å; N403-D410 PolarHBondContact O-N 2.04Å; N403-S414 WeakPolarHBondContact OD1-CB 3.02Å; N403-S414 PolarHBondContact OD1-OG 3.19Å; N403-W606 HydrophobicContact CB-CH2 4.3Å; N403-W606 HydrophobicContact CB-CZ2 4.39Å
404	G	89.3	Confident	88	Confident	3 Å²	3	39.2 Å²	39.2	3%	0.031	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	157.6	169.9	0	0	0	0	0	111.9	K382 D383	K382-G404 WeakPolarHBondContact O-CA 3.29Å; D383-G404 PolarHBondContact OD1-N 3.27Å
405	H	86	Confident	88.5	Confident	96 Å²	96	34.1 Å²	34.1	44%	0.444	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	161.8	174.7	-168.1	-90.8	0	0	0	109.2	S407 G408	H405-S407 PolarHBondContact ND1-N 2.8Å; H405-S407 PolarHBondContact ND1-OG 2.81Å; H405-S407 VanDerWaalsContact ND1-OG 3.09Å; H405-S407 PolarHBondContact O-N 2.72Å; H405-G408 CarbonylContact C-O 3.57Å; H405-G408 WeakPolarHBondContact CA-O 3.05Å; H405-G408 PolarHBondContact N-O 2.87Å; H405-G408 PolarHBondContact O-N 2.85Å
406	A	84.9	Confident	88.9	Confident	54 Å²	54	31.6 Å²	31.6	45%	0.446	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-23.4	176.4	0	0	0	0	0	114.6	Y381	Y381-A406 HydrophobicContact CE1-CB 4.18Å
407	S	82.9	Confident	89.2	Confident	85 Å²	85	30.5 Å²	30.5	59%	0.594	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.4	5.6	-178.7	54.3	0	0	0	0	114	H405	H405-S407 PolarHBondContact ND1-N 2.8Å; H405-S407 PolarHBondContact ND1-OG 2.81Å; H405-S407 VanDerWaalsContact ND1-OG 3.09Å; H405-S407 PolarHBondContact O-N 2.72Å
408	G	85.8	Confident	89.2	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	119.6	-140.6	-173.8	0	0	0	0	0	112.2	H405	H405-G408 CarbonylContact C-O 3.57Å; H405-G408 WeakPolarHBondContact CA-O 3.05Å; H405-G408 PolarHBondContact N-O 2.87Å; H405-G408 PolarHBondContact O-N 2.85Å
409	I	88.3	Confident	88.9	Confident	6 Å²	6	34.3 Å²	34.3	3%	0.031	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	144.5	-178	-60.4	-174.5	0	0	0	109.5	V310 L319 V342 Q355 L357 V384 H402 S411	V310-I409 HydrophobicContact CB-CD1 4.28Å; V310-I409 HydrophobicContact CB-CG1 3.97Å; V310-I409 HydrophobicContact CG1-CD1 3.9Å; V310-I409 HydrophobicContact CG1-CG1 4.14Å; V310-I409 HydrophobicContact CG2-CD1 4.13Å; V310-I409 HydrophobicContact CG2-CG1 3.75Å; L319-I409 HydrophobicContact CD2-CD1 3.63Å; L319-I409 HydrophobicContact CG-CD1 4.28Å; V342-I409 HydrophobicContact CB-CD1 4.46Å; V342-I409 HydrophobicContact CG1-CD1 3.77Å; V342-I409 HydrophobicContact CG1-CG1 4.12Å; V342-I409 HydrophobicContact CG2-CD1 3.83Å; Q355-I409 PolarHBondContact NE2-O 2.84Å; Q355-I409 PolarHBondContact OE1-O 2.93Å; L357-I409 HydrophobicContact CD1-CG2 4.26Å; V384-I409 HydrophobicContact CG1-CD1 4.41Å; V384-I409 HydrophobicContact CG2-CD1 3.85Å; V384-I409 HydrophobicContact CG2-CG2 4.4Å; H402-I409 HydrophobicContact CB-CG2 3.54Å; I409-S411 PolarHBondContact O-N 2.87Å
410	D	86.6	Confident	88.4	Confident	62 Å²	62	40.5 Å²	40.5	33%	0.332	24%	0.235	S	C	.	.			trans	-67.6	128.2	171.4	-165.8	-11.2	0	0	0	110.8	H402 N403 T412	H402-D410 PolarHBondContact ND1-O 2.87Å; N403-D410 PolarHBondContact O-N 2.04Å; D410-T412 PolarHBondContact O-N 3.25Å; D410-T412 PolarHBondContact OD1-N 2.75Å; D410-T412 PolarHBondContact OD1-OG1 3.1Å; D410-T412 PolarHBondContact OD2-OG1 2.74Å
411	S	85.3	Confident	87.9	Confident	81 Å²	81	41 Å²	41	57%	0.566	24%	0.237	S	C	*	.	S	Bend	trans	-59.7	-28.1	174.1	63.8	0	0	0	0	112.9	I409	I409-S411 PolarHBondContact O-N 2.87Å
412	T	87.1	Confident	86.9	Confident	89 Å²	89	45 Å²	45	55%	0.546	27%	0.269	S	S	.	.	S	Bend	trans	-96.4	128.2	178.5	62.3	0	0	0	0	111.3	D410 S414	D410-T412 PolarHBondContact O-N 3.25Å; D410-T412 PolarHBondContact OD1-N 2.75Å; D410-T412 PolarHBondContact OD1-OG1 3.1Å; D410-T412 PolarHBondContact OD2-OG1 2.74Å; T412-S414 PolarHBondContact O-N 3.01Å
413	A	88.9	Confident	85.8	Confident	35 Å²	35	46.8 Å²	46.8	29%	0.289	28%	0.282	S	S	.	.			trans	-69.6	129.9	175.3	0	0	0	0	0	110.4	Y400 I401 V416	Y400-A413 HydrophobicContact CD1-CB 4Å; I401-A413 CarbonylContact O-C 3.59Å; I401-A413 VanDerWaalsContact O-CA 3.24Å; I401-A413 WeakPolarHBondContact O-CA 3.44Å; I401-A413 WeakPolarHBondContact O-CB 3.34Å; A413-V416 HydrophobicContact CB-CG2 4.49Å
414	S	88.3	Confident	84.6	Confident	20 Å²	20	53 Å²	53	14%	0.14	33%	0.327	C	S	.	.	S	Bend	trans	-75.1	-32.5	178.8	59	0	0	0	0	112.2	I401 N403 T412	I401-S414 PolarHBondContact O-N 3.22Å; I401-S414 PolarHBondContact O-OG 3.37Å; N403-S414 WeakPolarHBondContact OD1-CB 3.02Å; N403-S414 PolarHBondContact OD1-OG 3.19Å; T412-S414 PolarHBondContact O-N 3.01Å
415	Q	89.5	Confident	83.8	Confident	4 Å²	4	62.8 Å²	62.8	2%	0.019	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	146.4	178.8	-177.5	167.4	-1	0	0	111.2	F24 N25 L26 I401 L417	F24-Q415 HydrophobicContact CB-CB 3.91Å; N25-Q415 VanDerWaalsContact N-OE1 3.12Å; L26-Q415 VanDerWaalsContact N-OE1 3.09Å; L26-Q415 PolarHBondContact O-NE2 2.91Å; I401-Q415 HydrophobicContact CB-CB 4.2Å; I401-Q415 HydrophobicContact CG1-CB 4.17Å; I401-Q415 PolarHBondContact N-O 3.18Å; Q415-L417 HydrophobicContact CG-CD2 4.26Å
416	V	92	Very high	83.6	Confident	55 Å²	55	61.5 Å²	61.5	33%	0.333	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	120.1	173.4	-172.9	0	0	0	0	109.1	L398 V399 Y400 A413	L398-V416 HydrophobicContact CB-CG1 4.34Å; L398-V416 HydrophobicContact CD2-CG1 4.1Å; V399-V416 CarbonylContact O-C 3.59Å; V399-V416 WeakPolarHBondContact O-CA 3.29Å; Y400-V416 HydrophobicContact CD1-CG1 4.14Å; Y400-V416 HydrophobicContact CD1-CG2 3.67Å; Y400-V416 HydrophobicContact CE1-CG1 4.02Å; Y400-V416 HydrophobicContact CE1-CG2 3.92Å; A413-V416 HydrophobicContact CB-CG2 4.49Å
417	L	91.1	Very high	83.6	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	131.9	174.6	-52.2	174.7	0	0	0	109.4	L26 V28 L398 V399 Q415 F430 L448 Y461	L26-L417 HydrophobicContact CB-CD2 4.36Å; L26-L417 HydrophobicContact CD1-CD1 3.96Å; V28-L417 HydrophobicContact CG2-CD2 3.59Å; L398-L417 CarbonylContact C-O 3.53Å; L398-L417 WeakPolarHBondContact CA-O 3.44Å; V399-L417 HydrophobicContact CB-CB 4.19Å; V399-L417 HydrophobicContact CB-CD1 4.4Å; V399-L417 HydrophobicContact CG1-CD1 4.45Å; V399-L417 PolarHBondContact N-O 2.78Å; V399-L417 PolarHBondContact O-N 3Å; Q415-L417 HydrophobicContact CG-CD2 4.26Å; L417-F430 HydrophobicContact CB-CE1 4.28Å; L417-F430 HydrophobicContact CB-CZ 4.46Å; L417-L448 HydrophobicContact CD1-CD2 3.94Å; L417-Y461 HydrophobicContact CD1-CD1 4.4Å; L417-Y461 HydrophobicContact CD1-CD2 4.03Å; L417-Y461 HydrophobicContact CD1-CE2 4.13Å; L417-Y461 HydrophobicContact CD1-CG 4.17Å; L417-Y461 HydrophobicContact CD2-CD1 4.3Å; L417-Y461 HydrophobicContact CD2-CE1 4.26Å
418	Q	90.4	Very high	83.6	Confident	89 Å²	89	57.8 Å²	57.8	42%	0.416	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	133.2	-178.7	-173.8	178.8	6.2	0	0	111.4	L398 K420	L398-Q418 HydrophobicContact CD2-CB 4.02Å; L398-Q418 HydrophobicContact CD2-CG 3.94Å; Q418-K420 PolarHBondContact O-N 2.93Å
419	G	86	Confident	83.8	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.01	33%	0.329	C	S	.	.			trans	-63.5	124.8	170.8	0	0	0	0	0	111.7	N396 G397	N396-G419 VanDerWaalsContact CB-O 3.27Å; N396-G419 WeakPolarHBondContact CB-O 3.32Å; G397-G419 PolarHBondContact O-N 2.95Å
420	K	85.4	Confident	84	Confident	130 Å²	130	57.5 Å²	57.5	57%	0.565	33%	0.327	S	S	*	.			trans	-94.5	-4.3	177.8	-66.2	179.1	-177.7	169.5	0	113.2	V28 Q418	V28-K420 PolarHBondContact O-NZ 3.09Å; V28-K420 VanDerWaalsContact O-NZ 3.12Å; Q418-K420 PolarHBondContact O-N 2.93Å
421	W	81.4	Confident	84.2	Confident	41 Å²	41	54.6 Å²	54.6	16%	0.155	31%	0.311	C	S	.	.			trans	-106.4	130.9	-172.4	-47	-84.7	0	0	0	110.1	V33 N396 A428 F430 A455 K457 V459	V33-W421 HydrophobicContact CG1-CZ2 4.37Å; V33-W421 HydrophobicContact CG2-CZ2 3.92Å; N396-W421 PolarHBondContact OD1-O 3.42Å; W421-A428 VanDerWaalsContact O-CB 3.25Å; W421-A428 WeakPolarHBondContact O-CB 3.26Å; W421-F430 HydrophobicContact CE3-CD2 4.11Å; W421-F430 HydrophobicContact CH2-CE2 4.25Å; W421-F430 AromaticContact CZ3-CD2 3.55Å; W421-F430 HydrophobicContact CZ3-CD2 3.55Å; W421-F430 AromaticContact CZ3-CE2 3.6Å; W421-F430 HydrophobicContact CZ3-CE2 3.6Å; W421-F430 HydrophobicContact CZ3-CG 4.39Å; W421-F430 HydrophobicContact CZ3-CZ 4.47Å; W421-A455 HydrophobicContact CB-CB 4.13Å; W421-K457 VanDerWaalsContact CD1-CD 3.5Å; W421-K457 HydrophobicContact CD2-CD 4.43Å; W421-K457 HydrophobicContact CG-CD 3.94Å; W421-V459 HydrophobicContact CH2-CB 4.19Å; W421-V459 HydrophobicContact CH2-CG1 4.02Å; W421-V459 HydrophobicContact CH2-CG2 3.24Å; W421-V459 HydrophobicContact CZ2-CG1 4.46Å; W421-V459 HydrophobicContact CZ2-CG2 3.6Å; W421-V459 HydrophobicContact CZ3-CG2 3.74Å
422	A	72.6	Confident	84.5	Confident	82 Å²	82	52.4 Å²	52.4	68%	0.678	29%	0.291	S	S	*	.			trans	-103	151.2	167.7	0	0	0	0	0	109
423	S	69.7	Low	84.7	Confident	44 Å²	44	48.9 Å²	48.9	31%	0.308	27%	0.27	S	S	.	.			trans	-124.7	146.7	173.5	170.6	0	0	0	0	109.9	M426 G454	S423-M426 WeakPolarHBondContact CB-O 3.47Å; S423-M426 PolarHBondContact OG-O 3.42Å; S423-G454 WeakPolarHBondContact CB-O 3.16Å; S423-G454 PolarHBondContact OG-O 3.37Å
424	S	64.8	Low	84.9	Confident	137 Å²	137	48.1 Å²	48.1	96%	0.958	26%	0.26	S	S	*	.	S	Bend	trans	-87.4	-18.1	-171.3	-52.8	0	0	0	0	113.9
425	Y	72.9	Confident	85.1	Confident	208 Å²	208	48.2 Å²	48.2	82%	0.816	26%	0.26	S	S	*	.	S	Bend	trans	-112.4	-29.4	-174.8	178.9	-98.3	0	0	0	113.4
426	M	81.9	Confident	85	Confident	69 Å²	69	48.4 Å²	48.4	34%	0.34	26%	0.263	S	S	.	.	S	Bend	trans	-148.5	154.9	-178	-167.2	161.9	-164.5	0	0	109.2	S423 F453	S423-M426 WeakPolarHBondContact CB-O 3.47Å; S423-M426 PolarHBondContact OG-O 3.42Å; M426-F453 HydrophobicContact SD-CE2 4.32Å
427	P	84.3	Confident	84.7	Confident	60 Å²	60	49.3 Å²	49.3	39%	0.39	27%	0.272	S	S	.	.			trans	-54.3	146.1	171.6	-25.8	35	0	0	0	111.2	Y390 S429 G454	Y390-P427 HydrophobicContact CD1-CB 3.81Å; Y390-P427 HydrophobicContact CD1-CG 4.16Å; Y390-P427 HydrophobicContact CE1-CB 3.85Å; Y390-P427 HydrophobicContact CE1-CG 4.12Å; P427-S429 PolarHBondContact O-N 3.49Å; P427-S429 VanDerWaalsContact O-N 3.15Å; P427-S429 PolarHBondContact O-OG 2.92Å; P427-G454 WeakPolarHBondContact O-CA 3.13Å
428	A	83.3	Confident	84.5	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.008	28%	0.283	C	S	.	.			trans	-61	-26.3	-177.7	0	0	0	0	0	112.8	W421 F430 A452 G454 A455	W421-A428 VanDerWaalsContact O-CB 3.25Å; W421-A428 WeakPolarHBondContact O-CB 3.26Å; A428-F430 VanDerWaalsContact C-N 3.26Å; A428-F430 PolarHBondContact O-N 2.77Å; A428-A452 CarbonylContact O-C 3.59Å; A428-A452 WeakPolarHBondContact O-CA 3.1Å; A428-G454 PolarHBondContact O-N 3.39Å; A428-A455 HydrophobicContact CB-CB 4.08Å
429	S	89.4	Confident	84.4	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.273	C	S	.	.			trans	54.2	41.5	178.6	-62.1	0	0	0	0	112.8	Y390 P427 G431 Y432	Y390-S429 WeakPolarHBondContact CE1-OG 3.21Å; P427-S429 PolarHBondContact O-N 3.49Å; P427-S429 VanDerWaalsContact O-N 3.15Å; P427-S429 PolarHBondContact O-OG 2.92Å; S429-G431 PolarHBondContact O-N 2.93Å; S429-Y432 WeakPolarHBondContact O-CB 3.44Å; S429-Y432 PolarHBondContact O-N 2.83Å; S429-Y432 VanDerWaalsContact O-N 3.14Å
430	F	92.7	Very high	84.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	121.9	176.4	176.1	-101	0	0	0	110.3	P389 N396 V399 L417 W421 A428 V450 A452 V459 Y461	P389-F430 WeakPolarHBondContact CA-O 3.45Å; N396-F430 WeakPolarHBondContact O-CB 3.44Å; V399-F430 HydrophobicContact CB-CE1 4.39Å; V399-F430 HydrophobicContact CG2-CD1 4.14Å; V399-F430 HydrophobicContact CG2-CE1 3.71Å; V399-F430 HydrophobicContact CG2-CZ 4.39Å; L417-F430 HydrophobicContact CB-CE1 4.28Å; L417-F430 HydrophobicContact CB-CZ 4.46Å; W421-F430 HydrophobicContact CE3-CD2 4.11Å; W421-F430 HydrophobicContact CH2-CE2 4.25Å; W421-F430 AromaticContact CZ3-CD2 3.55Å; W421-F430 HydrophobicContact CZ3-CD2 3.55Å; W421-F430 AromaticContact CZ3-CE2 3.6Å; W421-F430 HydrophobicContact CZ3-CE2 3.6Å; W421-F430 HydrophobicContact CZ3-CG 4.39Å; W421-F430 HydrophobicContact CZ3-CZ 4.47Å; A428-F430 VanDerWaalsContact C-N 3.26Å; A428-F430 PolarHBondContact O-N 2.77Å; F430-V450 HydrophobicContact CD1-CG1 4.38Å; F430-V450 HydrophobicContact CD2-CB 4.46Å; F430-V450 HydrophobicContact CD2-CG1 3.7Å; F430-V450 HydrophobicContact CE1-CG1 4.11Å; F430-V450 HydrophobicContact CE2-CB 3.74Å; F430-V450 HydrophobicContact CE2-CG1 3.37Å; F430-V450 HydrophobicContact CE2-CG2 4.48Å; F430-V450 HydrophobicContact CG-CG1 4.19Å; F430-V450 HydrophobicContact CZ-CB 3.98Å; F430-V450 HydrophobicContact CZ-CG1 3.6Å; F430-V450 HydrophobicContact CZ-CG2 4.24Å; F430-A452 HydrophobicContact CB-CB 4.26Å; F430-A452 HydrophobicContact CD2-CB 4.22Å; F430-V459 HydrophobicContact CE2-CB 4.49Å; F430-V459 HydrophobicContact CE2-CG2 4.28Å; F430-Y461 HydrophobicContact CE2-CE2 4.04Å; F430-Y461 AromaticContact CZ-CE2 3.72Å; F430-Y461 HydrophobicContact CZ-CE2 3.72Å; F430-Y461 AromaticContact CZ-CZ 3.91Å; F430-Y461 VanDerWaalsContact CZ-OH 3.31Å; F430-Y461 WeakPolarHBondContact CZ-OH 3.24Å
431	G	90.8	Very high	84.1	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	99.7	0.4	-175.9	0	0	0	0	0	114.2	S369 S387 S429 S433 G451	S369-G431 WeakPolarHBondContact CB-O 3.07Å; S387-G431 WeakPolarHBondContact CB-O 3.05Å; S387-G431 PolarHBondContact OG-O 2.9Å; S429-G431 PolarHBondContact O-N 2.93Å; G431-S433 VanDerWaalsContact C-N 3.27Å; G431-S433 PolarHBondContact O-N 2.8Å; G431-G451 PolarHBondContact N-O 2.96Å
432	Y	91.4	Very high	84.1	Confident	36 Å²	36	48.3 Å²	48.3	14%	0.141	28%	0.276	C	S	.	.	S	Bend	trans	-62.6	-33.9	178.4	-169.8	-100.6	0	0	0	113.4	F44 Y249 Y303 S369 S429 F453	F44-Y432 HydrophobicContact CD2-CD1 4.43Å; F44-Y432 HydrophobicContact CD2-CE1 4.07Å; F44-Y432 HydrophobicContact CE2-CD1 4.32Å; F44-Y432 AromaticContact CE2-CE1 3.53Å; F44-Y432 HydrophobicContact CE2-CE1 3.53Å; F44-Y432 AromaticContact CZ-CE1 3.9Å; F44-Y432 HydrophobicContact CZ-CE1 3.9Å; Y249-Y432 WeakPolarHBondContact OH-CE1 3.45Å; Y249-Y432 PolarHBondContact OH-OH 2.97Å; Y303-Y432 PolarHBondContact OH-OH 2.83Å; S369-Y432 WeakPolarHBondContact CB-O 3.31Å; S429-Y432 WeakPolarHBondContact O-CB 3.44Å; S429-Y432 PolarHBondContact O-N 2.83Å; S429-Y432 VanDerWaalsContact O-N 3.14Å; Y432-F453 AromaticContact CD1-CD1 3.74Å; Y432-F453 HydrophobicContact CD1-CD1 3.74Å; Y432-F453 AromaticContact CD1-CE1 3.6Å; Y432-F453 HydrophobicContact CD1-CE1 3.6Å; Y432-F453 AromaticContact CD2-CE1 3.88Å; Y432-F453 HydrophobicContact CD2-CE1 3.88Å; Y432-F453 HydrophobicContact CE1-CD1 4.44Å; Y432-F453 HydrophobicContact CE1-CE1 4.07Å; Y432-F453 HydrophobicContact CE2-CE1 4.33Å; Y432-F453 AromaticContact CG-CD1 3.86Å; Y432-F453 HydrophobicContact CG-CD1 3.86Å; Y432-F453 AromaticContact CG-CE1 3.47Å; Y432-F453 HydrophobicContact CG-CE1 3.47Å; Y432-F453 VanDerWaalsContact CG-CE1 3.47Å
433	S	92.5	Very high	84.5	Confident	14 Å²	14	45.6 Å²	45.6	10%	0.098	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	136.2	170.4	67.2	0	0	0	0	110	G43 F44 G431 G451	G43-S433 PolarHBondContact O-OG 3.21Å; G43-S433 VanDerWaalsContact O-OG 3.1Å; F44-S433 VanDerWaalsContact O-CB 3.24Å; F44-S433 WeakPolarHBondContact O-CB 3.07Å; F44-S433 PolarHBondContact O-OG 3.35Å; G431-S433 VanDerWaalsContact C-N 3.27Å; G431-S433 PolarHBondContact O-N 2.8Å; S433-G451 PolarHBondContact O-N 3.32Å
434	M	93.3	Very high	85.1	Confident	19 Å²	19	44 Å²	44	9%	0.094	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	146.6	179	-60.1	-176.1	-58.5	0	0	109.9	S369 A371 A385 V399 L448 V449 V450	S369-M434 WeakPolarHBondContact O-CE 3.37Å; A371-M434 HydrophobicContact CB-CB 3.71Å; A371-M434 HydrophobicContact CB-CE 4.3Å; A385-M434 HydrophobicContact CB-CE 4.12Å; A385-M434 HydrophobicContact CB-SD 4.26Å; A385-M434 WeakPolarHBondContact O-CE 3.49Å; V399-M434 HydrophobicContact CB-SD 4.28Å; V399-M434 HydrophobicContact CG1-SD 3.51Å; V399-M434 VanDerWaalsContact CG1-SD 3.51Å; V399-M434 HydrophobicContact CG2-SD 3.71Å; M434-L448 HydrophobicContact CB-CD1 4.35Å; M434-V449 WeakPolarHBondContact CA-O 3.46Å; M434-V450 HydrophobicContact CG-CG1 4.29Å; M434-V450 HydrophobicContact CG-CG2 4.4Å
435	T	91.1	Very high	86.2	Confident	22 Å²	22	37.7 Å²	37.7	14%	0.135	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	145.9	168.4	-169.4	0	0	0	0	109.4	V46 D47 F48 L448 V449	V46-T435 HydrophobicContact CB-CG2 4.47Å; V46-T435 HydrophobicContact CG2-CG2 4.09Å; D47-T435 PolarHBondContact OD1-OG1 2.97Å; F48-T435 HydrophobicContact CD2-CG2 3.62Å; F48-T435 HydrophobicContact CE2-CG2 3.61Å; F48-T435 HydrophobicContact CG-CG2 4.46Å; F48-T435 HydrophobicContact CZ-CG2 4.43Å; T435-L448 VanDerWaalsContact O-CD1 3.23Å; T435-L448 WeakPolarHBondContact O-CD1 3.5Å; T435-V449 HydrophobicContact CG2-CB 3.92Å; T435-V449 HydrophobicContact CG2-CG2 4.48Å; T435-V449 PolarHBondContact N-O 3.14Å; T435-V449 VanDerWaalsContact N-O 3.12Å; T435-V449 PolarHBondContact O-N 3.43Å
436	G	87.4	Confident	87	Confident	8 Å²	8	28.5 Å²	28.5	8%	0.082	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	-160.4	-176.4	0	0	0	0	0	112.2	A372 T438	A372-G436 CarbonylContact O-C 3.59Å; G436-T438 PolarHBondContact O-N 3.29Å
437	S	85.4	Confident	87.5	Confident	74 Å²	74	25.2 Å²	25.2	52%	0.517	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	68.2	13	172	-154.8	0	0	0	0	116	L373	L373-S437 WeakPolarHBondContact O-CA 3.49Å; L373-S437 PolarHBondContact O-N 2.79Å
438	T	87.3	Confident	87.9	Confident	38 Å²	38	22.4 Å²	22.4	23%	0.233	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	125.3	177.9	-55.5	0	0	0	0	111.1	F48 G436 D447	F48-T438 HydrophobicContact CB-CG2 4.11Å; F48-T438 HydrophobicContact CD1-CG2 4.34Å; F48-T438 HydrophobicContact CD2-CG2 4.45Å; F48-T438 HydrophobicContact CG-CG2 4.08Å; G436-T438 PolarHBondContact O-N 3.29Å; T438-D447 PolarHBondContact O-N 3.14Å
439	D	88.3	Confident	88.4	Confident	39 Å²	39	22.3 Å²	22.3	21%	0.209	13%	0.127	C	C	.	.			trans	-81.5	112	171.1	177	-2.5	0	0	0	109.6	D441 Q442 N443 G444 Y445	D439-D441 PolarHBondContact OD1-N 3.35Å; D439-Q442 WeakPolarHBondContact OD1-CA 3.38Å; D439-Q442 PolarHBondContact OD1-N 3.47Å; D439-Q442 VanDerWaalsContact OD2-CA 3.3Å; D439-Q442 WeakPolarHBondContact OD2-CA 3.27Å; D439-N443 PolarHBondContact OD1-N 3.44Å; D439-N443 PolarHBondContact OD2-N 2.76Å; D439-G444 VanDerWaalsContact OD2-CA 3.28Å; D439-G444 WeakPolarHBondContact OD2-CA 3.45Å; D439-G444 PolarHBondContact OD2-N 3.13Å; D439-Y445 WeakPolarHBondContact CB-O 3.46Å
440	I	84.8	Confident	88.7	Confident	2 Å²	2	22.3 Å²	22.3	1%	0.01	13%	0.127	C	C	.	.	S	Bend	trans	-90.9	-30.8	-175.6	-150.3	174.8	0	0	0	112.7	F48 S57 V59 W85 D447 L460	F48-I440 HydrophobicContact CD1-CD1 4.26Å; F48-I440 HydrophobicContact CE1-CD1 4.14Å; S57-I440 VanDerWaalsContact CB-CG1 3.49Å; V59-I440 HydrophobicContact CG2-CD1 3.71Å; W85-I440 HydrophobicContact CB-CD1 3.63Å; W85-I440 HydrophobicContact CB-CG1 4.17Å; W85-I440 HydrophobicContact CG-CD1 4.28Å; W85-I440 HydrophobicContact CG-CG1 4.29Å; I440-D447 WeakPolarHBondContact CB-OD2 3.42Å; I440-D447 HydrophobicContact CG2-CB 4.45Å; I440-D447 WeakPolarHBondContact CG2-OD2 3.49Å; I440-D447 PolarHBondContact N-OD2 3.1Å; I440-L460 HydrophobicContact CD1-CD2 3.96Å; I440-L460 HydrophobicContact CG2-CD1 4.42Å; I440-L460 HydrophobicContact CG2-CD2 4.04Å
441	D	80.6	Confident	88.7	Confident	30 Å²	30	22.3 Å²	22.3	16%	0.16	13%	0.127	C	C	.	.	S	Bend	trans	-104.8	0.2	-173.1	74.6	-3.7	0	0	0	113.6	D439 N443 R462	D439-D441 PolarHBondContact OD1-N 3.35Å; D441-N443 PolarHBondContact O-N 2.92Å; D441-N443 WeakPolarHBondContact OD1-CB 3.28Å; D441-N443 PolarHBondContact OD1-N 3.27Å; D441-N443 VanDerWaalsContact OD1-N 3.1Å; D441-N443 PolarHBondContact OD1-ND2 3.32Å; D441-N443 PolarHBondContact OD1-OD1 3.01Å; D441-N443 PolarHBondContact OD2-ND2 2.99Å; D441-N443 VanDerWaalsContact OD2-ND2 3.1Å; D441-R462 WeakPolarHBondContact OD2-CD 3.33Å; D441-R462 IonicContact OD2-CZ 2.7Å; D441-R462 IonicContact OD2-NH1 3.99Å; D441-R462 PolarHBondContact OD2-NH1 3.41Å
442	Q	82.1	Confident	88.8	Confident	132 Å²	132	22.3 Å²	22.3	62%	0.617	13%	0.127	S	C	*	.	S	Bend	trans	62.8	27.8	179.6	-55.3	178	8.6	0	0	113	D439 G444	D439-Q442 WeakPolarHBondContact OD1-CA 3.38Å; D439-Q442 PolarHBondContact OD1-N 3.47Å; D439-Q442 VanDerWaalsContact OD2-CA 3.3Å; D439-Q442 WeakPolarHBondContact OD2-CA 3.27Å; Q442-G444 PolarHBondContact O-N 3.23Å
443	N	80.1	Confident	88.8	Confident	25 Å²	25	21 Å²	21	13%	0.134	12%	0.122	C	C	.	.	S	Bend	trans	-79.6	-7.8	176.3	74.5	22	0	0	0	112.9	D439 D441 Y445 A463	D439-N443 PolarHBondContact OD1-N 3.44Å; D439-N443 PolarHBondContact OD2-N 2.76Å; D441-N443 PolarHBondContact O-N 2.92Å; D441-N443 WeakPolarHBondContact OD1-CB 3.28Å; D441-N443 PolarHBondContact OD1-N 3.27Å; D441-N443 VanDerWaalsContact OD1-N 3.1Å; D441-N443 PolarHBondContact OD1-ND2 3.32Å; D441-N443 PolarHBondContact OD1-OD1 3.01Å; D441-N443 PolarHBondContact OD2-ND2 2.99Å; D441-N443 VanDerWaalsContact OD2-ND2 3.1Å; N443-Y445 WeakPolarHBondContact OD1-CA 3.25Å; N443-Y445 WeakPolarHBondContact OD1-CB 3.09Å; N443-Y445 PolarHBondContact OD1-N 3.01Å; N443-Y445 PolarHBondContact OD1-O 2.93Å; N443-A463 PolarHBondContact ND2-O 3.35Å
444	G	81.9	Confident	88.6	Confident	11 Å²	11	20.7 Å²	20.7	11%	0.113	12%	0.12	C	C	.	.	S	Bend	trans	95.2	-4	-179.2	0	0	0	0	0	114.7	R378 D439 Q442	R378-G444 PolarHBondContact NE-O 3.31Å; R378-G444 PolarHBondContact NH2-O 3.08Å; D439-G444 VanDerWaalsContact OD2-CA 3.28Å; D439-G444 WeakPolarHBondContact OD2-CA 3.45Å; D439-G444 PolarHBondContact OD2-N 3.13Å; Q442-G444 PolarHBondContact O-N 3.23Å
445	Y	88.2	Confident	88.4	Confident	4 Å²	4	20.5 Å²	20.5	2%	0.016	12%	0.122	C	C	.	.	S	Bend	trans	-113.3	143.1	179.1	-64.7	-91.5	0	0	0	109.8	L376 R378 D439 N443 A463 P465 V466 F510	L376-Y445 VanDerWaalsContact O-CD1 3.29Å; L376-Y445 WeakPolarHBondContact O-CD1 3.34Å; R378-Y445 HydrophobicContact CB-CE1 4.08Å; R378-Y445 HydrophobicContact CG-CD1 4.09Å; R378-Y445 HydrophobicContact CG-CE1 3.79Å; D439-Y445 WeakPolarHBondContact CB-O 3.46Å; N443-Y445 WeakPolarHBondContact OD1-CA 3.25Å; N443-Y445 WeakPolarHBondContact OD1-CB 3.09Å; N443-Y445 PolarHBondContact OD1-N 3.01Å; N443-Y445 PolarHBondContact OD1-O 2.93Å; Y445-A463 HydrophobicContact CG-CB 4.42Å; Y445-P465 HydrophobicContact CE2-CB 4.08Å; Y445-V466 HydrophobicContact CE1-CG2 4.38Å; Y445-V466 PolarHBondContact OH-N 2.97Å; Y445-F510 WeakPolarHBondContact CE2-O 3.29Å; Y445-F510 PolarHBondContact OH-O 3.42Å
446	P	90.9	Very high	88.4	Confident	15 Å²	15	20.1 Å²	20.1	10%	0.097	12%	0.119	C	C	.	.			trans	-72.2	145.2	177.2	28.6	-30.7	0	0	0	110.8	L373 D375 L376 A463	L373-P446 VanDerWaalsContact O-CB 3.26Å; L373-P446 WeakPolarHBondContact O-CB 3.35Å; L373-P446 WeakPolarHBondContact O-CG 3.46Å; D375-P446 WeakPolarHBondContact O-CD 3.47Å; D375-P446 VanDerWaalsContact O-CG 3.3Å; D375-P446 WeakPolarHBondContact O-CG 3.28Å; L376-P446 HydrophobicContact CD1-CG 4.08Å; L376-P446 WeakPolarHBondContact CD1-O 3.3Å; P446-A463 WeakPolarHBondContact O-CB 3.2Å
447	D	91.4	Very high	88.6	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	165.8	178.9	-58.1	-55.9	0	0	0	111.6	F48 T438 I440 L460 R462 A463	F48-D447 HydrophobicContact CZ-CB 4.5Å; T438-D447 PolarHBondContact O-N 3.14Å; I440-D447 WeakPolarHBondContact CB-OD2 3.42Å; I440-D447 HydrophobicContact CG2-CB 4.45Å; I440-D447 WeakPolarHBondContact CG2-OD2 3.49Å; I440-D447 PolarHBondContact N-OD2 3.1Å; D447-L460 HydrophobicContact CB-CD1 4.02Å; D447-R462 WeakPolarHBondContact OD1-CA 3.35Å; D447-A463 PolarHBondContact OD1-N 3.36Å
448	L	93.7	Very high	88.9	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	128.9	-177.7	174.7	59.6	0	0	0	111	L26 L373 A385 I401 L417 M434 T435 V450 Y461	L26-L448 HydrophobicContact CD1-CB 4.33Å; L26-L448 HydrophobicContact CD1-CD2 3.81Å; L26-L448 HydrophobicContact CD2-CB 4.36Å; L373-L448 HydrophobicContact CD2-CB 4.25Å; L373-L448 HydrophobicContact CD2-CD1 3.6Å; L373-L448 HydrophobicContact CD2-CD2 4.24Å; L373-L448 HydrophobicContact CD2-CG 4.22Å; A385-L448 HydrophobicContact CB-CD2 4.4Å; I401-L448 HydrophobicContact CD1-CD2 4.03Å; L417-L448 HydrophobicContact CD1-CD2 3.94Å; M434-L448 HydrophobicContact CB-CD1 4.35Å; T435-L448 VanDerWaalsContact O-CD1 3.23Å; T435-L448 WeakPolarHBondContact O-CD1 3.5Å; L448-V450 HydrophobicContact CD1-CG2 4.34Å; L448-V450 HydrophobicContact CD2-CG2 4.02Å; L448-V450 HydrophobicContact CG-CG2 3.88Å; L448-Y461 PolarHBondContact N-O 3.33Å; L448-Y461 PolarHBondContact O-N 2.9Å
449	V	93.5	Very high	89.1	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	130.4	169.4	179.4	0	0	0	0	109.7	V46 F48 V59 M434 T435 V459 L460	V46-V449 HydrophobicContact CB-CG1 3.81Å; V46-V449 HydrophobicContact CG1-CG1 3.99Å; V46-V449 HydrophobicContact CG2-CG1 4.05Å; F48-V449 HydrophobicContact CD1-CG2 4.39Å; F48-V449 HydrophobicContact CE1-CG2 3.57Å; F48-V449 HydrophobicContact CE2-CG2 4.29Å; F48-V449 HydrophobicContact CZ-CB 4.38Å; F48-V449 HydrophobicContact CZ-CG2 3.53Å; V59-V449 HydrophobicContact CG1-CG1 3.95Å; V59-V449 HydrophobicContact CG1-CG2 3.97Å; V59-V449 HydrophobicContact CG2-CG2 4.24Å; M434-V449 WeakPolarHBondContact CA-O 3.46Å; T435-V449 HydrophobicContact CG2-CB 3.92Å; T435-V449 HydrophobicContact CG2-CG2 4.48Å; T435-V449 PolarHBondContact N-O 3.14Å; T435-V449 VanDerWaalsContact N-O 3.12Å; T435-V449 PolarHBondContact O-N 3.43Å; V449-V459 CarbonylContact C-O 3.5Å; V449-V459 WeakPolarHBondContact CA-O 3.16Å; V449-L460 HydrophobicContact CG2-CB 4.29Å; V449-L460 HydrophobicContact CG2-CD1 3.58Å
450	V	94.9	Very high	89.2	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	125.7	178.8	-173.9	0	0	0	0	110.1	V399 F430 M434 L448 A458 V459 Y461	V399-V450 HydrophobicContact CG2-CG1 4.14Å; F430-V450 HydrophobicContact CD1-CG1 4.38Å; F430-V450 HydrophobicContact CD2-CB 4.46Å; F430-V450 HydrophobicContact CD2-CG1 3.7Å; F430-V450 HydrophobicContact CE1-CG1 4.11Å; F430-V450 HydrophobicContact CE2-CB 3.74Å; F430-V450 HydrophobicContact CE2-CG1 3.37Å; F430-V450 HydrophobicContact CE2-CG2 4.48Å; F430-V450 HydrophobicContact CG-CG1 4.19Å; F430-V450 HydrophobicContact CZ-CB 3.98Å; F430-V450 HydrophobicContact CZ-CG1 3.6Å; F430-V450 HydrophobicContact CZ-CG2 4.24Å; M434-V450 HydrophobicContact CG-CG1 4.29Å; M434-V450 HydrophobicContact CG-CG2 4.4Å; L448-V450 HydrophobicContact CD1-CG2 4.34Å; L448-V450 HydrophobicContact CD2-CG2 4.02Å; L448-V450 HydrophobicContact CG-CG2 3.88Å; V450-A458 CarbonylContact O-C 3.59Å; V450-A458 WeakPolarHBondContact O-CA 3.28Å; V450-V459 PolarHBondContact N-O 3.46Å; V450-V459 PolarHBondContact O-N 2.99Å; V450-Y461 HydrophobicContact CB-CE2 4.25Å; V450-Y461 HydrophobicContact CG2-CD2 3.96Å; V450-Y461 HydrophobicContact CG2-CE2 3.95Å
451	G	93.6	Very high	89.6	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	142.9	174.2	0	0	0	0	0	112.8	G43 G431 S433	G43-G451 WeakPolarHBondContact O-CA 3.45Å; G431-G451 PolarHBondContact N-O 2.96Å; S433-G451 PolarHBondContact O-N 3.32Å
452	A	93	Very high	90	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	71.8	173.6	0	0	0	0	0	109.1	A428 F430 G454 A455 D456 K457	A428-A452 CarbonylContact O-C 3.59Å; A428-A452 WeakPolarHBondContact O-CA 3.1Å; F430-A452 HydrophobicContact CB-CB 4.26Å; F430-A452 HydrophobicContact CD2-CB 4.22Å; A452-G454 VanDerWaalsContact C-N 3.26Å; A452-G454 PolarHBondContact O-N 3.07Å; A452-A455 CarbonylContact O-C 3.57Å; A452-A455 PolarHBondContact O-N 3Å; A452-A455 VanDerWaalsContact O-N 3.09Å; A452-D456 PolarHBondContact O-N 3.19Å; A452-K457 CarbonylContact C-O 3.54Å; A452-K457 WeakPolarHBondContact CA-O 3.4Å; A452-K457 PolarHBondContact N-O 3.23Å; A452-K457 PolarHBondContact O-N 3.46Å; A452-K457 VanDerWaalsContact O-N 3.17Å
453	F	90.8	Very high	90.3	Very high	9 Å²	9	7.6 Å²	7.6	4%	0.039	4%	0.044	C	C	.	.	G	3₁₀ helix	trans	-62.1	-30.3	-171.2	76.7	-93.4	0	0	0	113.7	Y41 F42 F44 M426 Y432 A455 D456	Y41-F453 HydrophobicContact CD1-CD2 4.19Å; Y41-F453 HydrophobicContact CD2-CD2 4.14Å; Y41-F453 HydrophobicContact CE2-CD2 4.48Å; Y41-F453 HydrophobicContact CE2-CE2 4.48Å; Y41-F453 AromaticContact CG-CD2 3.97Å; Y41-F453 HydrophobicContact CG-CD2 3.97Å; F42-F453 WeakPolarHBondContact O-CA 3.33Å; F44-F453 HydrophobicContact CB-CB 4.01Å; F44-F453 HydrophobicContact CD2-CB 4.42Å; F44-F453 HydrophobicContact CD2-CD1 4.26Å; F44-F453 HydrophobicContact CD2-CD2 4.35Å; F44-F453 HydrophobicContact CD2-CG 4.08Å; M426-F453 HydrophobicContact SD-CE2 4.32Å; Y432-F453 AromaticContact CD1-CD1 3.74Å; Y432-F453 HydrophobicContact CD1-CD1 3.74Å; Y432-F453 AromaticContact CD1-CE1 3.6Å; Y432-F453 HydrophobicContact CD1-CE1 3.6Å; Y432-F453 AromaticContact CD2-CE1 3.88Å; Y432-F453 HydrophobicContact CD2-CE1 3.88Å; Y432-F453 HydrophobicContact CE1-CD1 4.44Å; Y432-F453 HydrophobicContact CE1-CE1 4.07Å; Y432-F453 HydrophobicContact CE2-CE1 4.33Å; Y432-F453 AromaticContact CG-CD1 3.86Å; Y432-F453 HydrophobicContact CG-CD1 3.86Å; Y432-F453 AromaticContact CG-CE1 3.47Å; Y432-F453 HydrophobicContact CG-CE1 3.47Å; Y432-F453 VanDerWaalsContact CG-CE1 3.47Å; F453-A455 PolarHBondContact O-N 3.42Å; F453-D456 PolarHBondContact O-N 3.29Å
454	G	88.8	Confident	90.7	Very high	7 Å²	7	7.4 Å²	7.4	7%	0.072	4%	0.041	C	C	.	.	G	3₁₀ helix	trans	-71.2	-18.2	179.4	0	0	0	0	0	113.5	S423 P427 A428 A452	S423-G454 WeakPolarHBondContact CB-O 3.16Å; S423-G454 PolarHBondContact OG-O 3.37Å; P427-G454 WeakPolarHBondContact O-CA 3.13Å; A428-G454 PolarHBondContact O-N 3.39Å; A452-G454 VanDerWaalsContact C-N 3.26Å; A452-G454 PolarHBondContact O-N 3.07Å
455	A	89.2	Confident	90.9	Very high	14 Å²	14	7.5 Å²	7.5	12%	0.116	4%	0.04	C	C	.	.	G	3₁₀ helix	trans	-108.3	8.3	173.2	0	0	0	0	0	112.7	W421 A428 A452 F453 K457	W421-A455 HydrophobicContact CB-CB 4.13Å; A428-A455 HydrophobicContact CB-CB 4.08Å; A452-A455 CarbonylContact O-C 3.57Å; A452-A455 PolarHBondContact O-N 3Å; A452-A455 VanDerWaalsContact O-N 3.09Å; F453-A455 PolarHBondContact O-N 3.42Å; A455-K457 VanDerWaalsContact C-N 3.27Å; A455-K457 WeakPolarHBondContact O-CG 3.4Å; A455-K457 PolarHBondContact O-N 3.15Å
456	D	90.6	Very high	90.9	Very high	15 Å²	15	7.7 Å²	7.7	8%	0.08	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	41.5	-177.7	-60.7	-68.5	0	0	0	113.4	G36 G39 S40 Y41 F42 A452 F453	G36-D456 PolarHBondContact N-O 3.48Å; G39-D456 PolarHBondContact N-OD2 3.44Å; S40-D456 PolarHBondContact N-OD1 2.74Å; S40-D456 VanDerWaalsContact N-OD1 3.15Å; Y41-D456 VanDerWaalsContact CA-OD1 3.28Å; Y41-D456 WeakPolarHBondContact CA-OD1 3.01Å; Y41-D456 PolarHBondContact N-OD1 3.2Å; F42-D456 HydrophobicContact CB-CB 4.07Å; F42-D456 WeakPolarHBondContact CD1-O 3.27Å; F42-D456 PolarHBondContact N-OD1 3.29Å; F42-D456 VanDerWaalsContact N-OD1 3.15Å; F42-D456 CarbonylContact O-C 3.59Å; F42-D456 VanDerWaalsContact O-C 3.26Å; F42-D456 WeakPolarHBondContact O-CA 3.46Å; A452-D456 PolarHBondContact O-N 3.19Å; F453-D456 PolarHBondContact O-N 3.29Å
457	K	90.8	Very high	90.7	Very high	45 Å²	45	7 Å²	7	20%	0.196	4%	0.037	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	153.4	-176.5	-72.4	178.1	-159.5	-40.6	0	112.9	V33 Y34 T35 F42 W421 A452 A455	V33-K457 HydrophobicContact CG1-CD 4.07Å; V33-K457 HydrophobicContact CG1-CG 4.45Å; Y34-K457 VanDerWaalsContact O-CA 3.3Å; Y34-K457 WeakPolarHBondContact O-CA 3.49Å; T35-K457 PolarHBondContact OG1-NZ 2.65Å; F42-K457 PolarHBondContact O-N 2.74Å; F42-K457 VanDerWaalsContact O-N 3.1Å; W421-K457 VanDerWaalsContact CD1-CD 3.5Å; W421-K457 HydrophobicContact CD2-CD 4.43Å; W421-K457 HydrophobicContact CG-CD 3.94Å; A452-K457 CarbonylContact C-O 3.54Å; A452-K457 WeakPolarHBondContact CA-O 3.4Å; A452-K457 PolarHBondContact N-O 3.23Å; A452-K457 PolarHBondContact O-N 3.46Å; A452-K457 VanDerWaalsContact O-N 3.17Å; A455-K457 VanDerWaalsContact C-N 3.27Å; A455-K457 WeakPolarHBondContact O-CG 3.4Å; A455-K457 PolarHBondContact O-N 3.15Å
458	A	91.9	Very high	90.4	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	148.8	165	0	0	0	0	0	109.5	Y34 F42 V46 I61 V450	Y34-A458 PolarHBondContact N-O 2.85Å; Y34-A458 PolarHBondContact O-N 2.78Å; F42-A458 HydrophobicContact CE1-CB 4.23Å; V46-A458 HydrophobicContact CG1-CB 4.27Å; I61-A458 HydrophobicContact CD1-CB 3.56Å; I61-A458 HydrophobicContact CG1-CB 4.14Å; I61-A458 HydrophobicContact CG2-CB 4.38Å; V450-A458 CarbonylContact O-C 3.59Å; V450-A458 WeakPolarHBondContact O-CA 3.28Å
459	V	91.9	Very high	90.1	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	125.9	-169.8	-171.4	0	0	0	0	108.9	P31 F32 V33 W421 F430 V449 V450 Y461	P31-V459 HydrophobicContact CB-CG1 3.7Å; P31-V459 HydrophobicContact CG-CG1 4.32Å; F32-V459 CarbonylContact O-C 3.58Å; F32-V459 WeakPolarHBondContact O-CA 3.37Å; V33-V459 HydrophobicContact CG2-CG1 4.4Å; W421-V459 HydrophobicContact CH2-CB 4.19Å; W421-V459 HydrophobicContact CH2-CG1 4.02Å; W421-V459 HydrophobicContact CH2-CG2 3.24Å; W421-V459 HydrophobicContact CZ2-CG1 4.46Å; W421-V459 HydrophobicContact CZ2-CG2 3.6Å; W421-V459 HydrophobicContact CZ3-CG2 3.74Å; F430-V459 HydrophobicContact CE2-CB 4.49Å; F430-V459 HydrophobicContact CE2-CG2 4.28Å; V449-V459 CarbonylContact C-O 3.5Å; V449-V459 WeakPolarHBondContact CA-O 3.16Å; V450-V459 PolarHBondContact N-O 3.46Å; V450-V459 PolarHBondContact O-N 2.99Å; V459-Y461 HydrophobicContact CB-CE2 3.91Å; V459-Y461 HydrophobicContact CG1-CD2 4.05Å; V459-Y461 HydrophobicContact CG1-CE1 4.31Å; V459-Y461 HydrophobicContact CG1-CE2 3.49Å; V459-Y461 VanDerWaalsContact CG1-CE2 3.49Å
460	L	91.6	Very high	89.8	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	117	173.7	169.4	70.7	0	0	0	108.9	F32 Y34 F48 W85 I440 D447 V449	F32-L460 HydrophobicContact CB-CB 4.2Å; F32-L460 HydrophobicContact CB-CD2 4.45Å; F32-L460 HydrophobicContact CD2-CD2 4.25Å; F32-L460 PolarHBondContact N-O 3.46Å; F32-L460 VanDerWaalsContact N-O 3.08Å; F32-L460 PolarHBondContact O-N 2.75Å; Y34-L460 HydrophobicContact CE2-CB 3.93Å; F48-L460 HydrophobicContact CE1-CD1 4.17Å; F48-L460 HydrophobicContact CZ-CD1 4.46Å; W85-L460 HydrophobicContact CB-CD2 4.42Å; I440-L460 HydrophobicContact CD1-CD2 3.96Å; I440-L460 HydrophobicContact CG2-CD1 4.42Å; I440-L460 HydrophobicContact CG2-CD2 4.04Å; D447-L460 HydrophobicContact CB-CD1 4.02Å; V449-L460 HydrophobicContact CG2-CB 4.29Å; V449-L460 HydrophobicContact CG2-CD1 3.58Å
461	Y	91.4	Very high	89.6	Confident	2 Å²	2	15.4 Å²	15.4	1%	0.008	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	125.4	171.8	-67	-84.5	0	0	0	108.8	D27 P31 L417 F430 L448 V450 V459	D27-Y461 WeakPolarHBondContact O-CD1 3.31Å; P31-Y461 HydrophobicContact CB-CD1 4.05Å; P31-Y461 HydrophobicContact CB-CE1 3.94Å; P31-Y461 HydrophobicContact CG-CE1 4.34Å; L417-Y461 HydrophobicContact CD1-CD1 4.4Å; L417-Y461 HydrophobicContact CD1-CD2 4.03Å; L417-Y461 HydrophobicContact CD1-CE2 4.13Å; L417-Y461 HydrophobicContact CD1-CG 4.17Å; L417-Y461 HydrophobicContact CD2-CD1 4.3Å; L417-Y461 HydrophobicContact CD2-CE1 4.26Å; F430-Y461 HydrophobicContact CE2-CE2 4.04Å; F430-Y461 AromaticContact CZ-CE2 3.72Å; F430-Y461 HydrophobicContact CZ-CE2 3.72Å; F430-Y461 AromaticContact CZ-CZ 3.91Å; F430-Y461 VanDerWaalsContact CZ-OH 3.31Å; F430-Y461 WeakPolarHBondContact CZ-OH 3.24Å; L448-Y461 PolarHBondContact N-O 3.33Å; L448-Y461 PolarHBondContact O-N 2.9Å; V450-Y461 HydrophobicContact CB-CE2 4.25Å; V450-Y461 HydrophobicContact CG2-CD2 3.96Å; V450-Y461 HydrophobicContact CG2-CE2 3.95Å; V459-Y461 HydrophobicContact CB-CE2 3.91Å; V459-Y461 HydrophobicContact CG1-CD2 4.05Å; V459-Y461 HydrophobicContact CG1-CE1 4.31Å; V459-Y461 HydrophobicContact CG1-CE2 3.49Å; V459-Y461 VanDerWaalsContact CG1-CE2 3.49Å
462	R	89.2	Confident	89.4	Confident	13 Å²	13	18 Å²	18	5%	0.049	10%	0.104	C	C	.	.	P	Polyproline II helix	trans	-95.1	141.3	177.4	-65.3	-172.2	-62.6	152.5	-3.1	111.5	D27 D441 D447 T597	D27-R462 PolarHBondContact N-O 3.15Å; D441-R462 WeakPolarHBondContact OD2-CD 3.33Å; D441-R462 IonicContact OD2-CZ 2.7Å; D441-R462 IonicContact OD2-NH1 3.99Å; D441-R462 PolarHBondContact OD2-NH1 3.41Å; D447-R462 WeakPolarHBondContact OD1-CA 3.35Å; R462-T597 PolarHBondContact NH1-OG1 2.93Å
463	A	89.8	Confident	89.3	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.107	C	C	.	.	B	Isolated β-bridge	trans	-77.8	134	174.3	0	0	0	0	0	111	L26 L376 N443 Y445 P446 D447	L26-A463 HydrophobicContact CD2-CB 4.24Å; L376-A463 HydrophobicContact CD1-CB 4.09Å; N443-A463 PolarHBondContact ND2-O 3.35Å; Y445-A463 HydrophobicContact CG-CB 4.42Å; P446-A463 WeakPolarHBondContact O-CB 3.2Å; D447-A463 PolarHBondContact OD1-N 3.36Å
464	R	87.9	Confident	89.3	Confident	20 Å²	20	22 Å²	22	8%	0.075	13%	0.126	C	C	.	.	P	Polyproline II helix	trans	-88.3	142.4	179.3	-64.1	163.8	63.1	-173.1	1.1	109.5	S23 N25 D27 V466 L599 L600 P601 I602	S23-R464 PolarHBondContact OG-NH1 3.46Å; N25-R464 WeakPolarHBondContact O-CA 3.37Å; N25-R464 WeakPolarHBondContact O-CB 3.39Å; N25-R464 WeakPolarHBondContact O-CD 3.37Å; N25-R464 WeakPolarHBondContact O-CG 3.24Å; N25-R464 PolarHBondContact O-N 3.47Å; D27-R464 HydrophobicContact CB-CG 3.97Å; R464-V466 PolarHBondContact O-N 2.96Å; R464-L599 HydrophobicContact CG-CD1 3.86Å; R464-L599 HydrophobicContact CG-CG 4.34Å; R464-L600 WeakPolarHBondContact CB-O 3.5Å; R464-L600 WeakPolarHBondContact CG-O 3.37Å; R464-L600 PolarHBondContact NE-O 2.96Å; R464-P601 PolarHBondContact NH2-O 3.46Å; R464-I602 HydrophobicContact CB-CG2 4.31Å
465	P	86.5	Confident	89.4	Confident	13 Å²	13	21.9 Å²	21.9	8%	0.084	12%	0.124	C	C	.	.	P	Polyproline II helix	trans	-58.5	128.4	174.5	-24.6	33.4	0	0	0	112.2	Y445 P601 I602	Y445-P465 HydrophobicContact CE2-CB 4.08Å; P465-P601 HydrophobicContact CB-CB 4.34Å; P465-P601 CarbonylContact O-C 3.53Å; P465-P601 WeakPolarHBondContact O-CA 3.05Å; P465-P601 WeakPolarHBondContact O-CB 3.12Å; P465-I602 PolarHBondContact O-N 2.87Å
466	V	87.6	Confident	89.4	Confident	9 Å²	9	26.6 Å²	26.6	6%	0.055	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	124.7	-179.7	-177.3	0	0	0	0	109.8	N25 D377 Y445 R464 G509 I602 N604	N25-V466 HydrophobicContact CB-CG2 4.02Å; D377-V466 HydrophobicContact CB-CG2 4.07Å; Y445-V466 HydrophobicContact CE1-CG2 4.38Å; Y445-V466 PolarHBondContact OH-N 2.97Å; R464-V466 PolarHBondContact O-N 2.96Å; V466-G509 WeakPolarHBondContact O-CA 3.2Å; V466-I602 WeakPolarHBondContact CA-O 3.01Å; V466-I602 HydrophobicContact CG2-CG2 4.04Å; V466-N604 HydrophobicContact CG1-CB 3.83Å
467	I	85.8	Confident	89.2	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	117.9	178.3	-60.1	169.6	0	0	0	108.6	V469 A507 A512 L516 L588 P601 I602 N604	I467-V469 HydrophobicContact CG2-CG2 3.89Å; I467-A507 HydrophobicContact CG2-CB 4.13Å; I467-A512 HydrophobicContact CG1-CB 4.28Å; I467-L516 HydrophobicContact CD1-CD1 3.97Å; I467-L516 HydrophobicContact CD1-CD2 3.69Å; I467-L516 HydrophobicContact CD1-CG 4.5Å; I467-L516 HydrophobicContact CG1-CD1 4.47Å; I467-L516 HydrophobicContact CG2-CD1 3.91Å; I467-L588 HydrophobicContact CD1-CD2 3.52Å; I467-P601 HydrophobicContact CD1-CB 3.6Å; I467-P601 HydrophobicContact CD1-CG 3.93Å; I467-P601 HydrophobicContact CG1-CB 4.16Å; I467-I602 PolarHBondContact N-O 3.41Å; I467-N604 PolarHBondContact O-N 3.17Å
468	S	85.8	Confident	88.8	Confident	58 Å²	58	30.5 Å²	30.5	41%	0.406	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	125.5	168.5	-177.5	0	0	0	0	109	A507 G508	S468-A507 WeakPolarHBondContact O-CA 3.41Å; S468-G508 PolarHBondContact N-O 2.9Å; S468-G508 PolarHBondContact O-N 3.01Å; S468-G508 VanDerWaalsContact O-N 3.08Å
469	V	87	Confident	88.3	Confident	8 Å²	8	33 Å²	33	5%	0.048	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	123.7	178.4	-175.4	0	0	0	0	108.8	I467 L505 A506 A507 F518 Y586 I603	I467-V469 HydrophobicContact CG2-CG2 3.89Å; V469-L505 HydrophobicContact CG1-CD2 4.03Å; V469-A506 WeakPolarHBondContact CA-O 3.17Å; V469-A507 HydrophobicContact CG2-CB 4.25Å; V469-F518 HydrophobicContact CG2-CE1 3.89Å; V469-F518 HydrophobicContact CG2-CZ 3.8Å; V469-Y586 HydrophobicContact CB-CE2 3.94Å; V469-Y586 HydrophobicContact CG1-CD2 4.17Å; V469-Y586 HydrophobicContact CG1-CE2 3.59Å; V469-Y586 HydrophobicContact CG2-CE2 4.32Å; V469-I603 HydrophobicContact CG2-CG2 4.21Å
470	N	88.3	Confident	88	Confident	99 Å²	99	33.2 Å²	33.2	53%	0.529	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	112	169.1	-170.8	-0	0	0	0	108.5	A506	N470-A506 PolarHBondContact N-O 2.76Å; N470-A506 PolarHBondContact O-N 2.86Å
471	A	89.6	Confident	87.6	Confident	12 Å²	12	34.8 Å²	34.8	10%	0.099	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	127	-179.9	0	0	0	0	0	109.8	C504 L505 Y586 V611	A471-C504 WeakPolarHBondContact CA-O 3.21Å; A471-L505 HydrophobicContact CB-CD2 3.55Å; A471-Y586 HydrophobicContact CB-CD1 4.01Å; A471-Y586 HydrophobicContact CB-CE1 3.59Å; A471-V611 HydrophobicContact CB-CG2 3.76Å
472	T	89.3	Confident	87.2	Confident	54 Å²	54	35.6 Å²	35.6	33%	0.331	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	131.3	178.2	60.9	0	0	0	0	109.8	Y503 C504	T472-Y503 WeakPolarHBondContact O-CA 3.38Å; T472-C504 PolarHBondContact N-O 3.01Å; T472-C504 PolarHBondContact O-N 3.26Å; T472-C504 WeakPolarHBondContact OG1-CB 2.85Å
473	L	91.8	Very high	86.7	Confident	11 Å²	11	42 Å²	42	6%	0.058	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	128.5	176	-178.6	66.8	0	0	0	108.6	V501 L522 V582 M584 V611 K613	L473-V501 HydrophobicContact CD1-CG1 3.63Å; L473-L522 HydrophobicContact CD1-CD2 4.35Å; L473-V582 HydrophobicContact CD1-CG1 4.48Å; L473-V582 HydrophobicContact CD2-CB 4.3Å; L473-V582 HydrophobicContact CD2-CG1 4.04Å; L473-V582 WeakPolarHBondContact CD2-O 3.48Å; L473-M584 HydrophobicContact CD1-CB 4.4Å; L473-M584 HydrophobicContact CD2-CB 4.23Å; L473-V611 HydrophobicContact CB-CB 4.49Å; L473-V611 HydrophobicContact CB-CG1 3.89Å; L473-K613 HydrophobicContact CB-CG 4.49Å; L473-K613 HydrophobicContact CD2-CB 3.97Å; L473-K613 HydrophobicContact CG-CB 4.21Å; L473-K613 HydrophobicContact CG-CG 4.47Å; L473-K613 WeakPolarHBondContact O-CG 3.28Å
474	D	91.3	Very high	86.5	Confident	82 Å²	82	48 Å²	48	44%	0.439	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	147.9	179.2	-166	19.3	0	0	0	111.1	K502	D474-K502 HydrophobicContact CB-CB 4.48Å; D474-K502 PolarHBondContact N-O 3.16Å; D474-K502 PolarHBondContact O-N 3.47Å
475	I	90.3	Very high	86.3	Confident	5 Å²	5	51.2 Å²	51.2	3%	0.026	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	123.8	-177	-53.2	176.4	0	0	0	108.4	Q478 F499 K500 V582 K613 A615	I475-Q478 WeakPolarHBondContact O-CG 3.47Å; I475-F499 HydrophobicContact CG2-CD2 3.6Å; I475-F499 HydrophobicContact CG2-CE2 4.03Å; I475-F499 HydrophobicContact CG2-CG 4.47Å; I475-K500 WeakPolarHBondContact CA-O 3.31Å; I475-V582 HydrophobicContact CD1-CB 4.02Å; I475-V582 HydrophobicContact CD1-CG2 3.71Å; I475-K613 HydrophobicContact CD1-CB 3.73Å; I475-K613 HydrophobicContact CG1-CB 4.12Å; I475-A615 HydrophobicContact CD1-CB 4.21Å; I475-A615 HydrophobicContact CG2-CB 4.19Å
476	N	88.8	Confident	86.2	Confident	113 Å²	113	54.4 Å²	54.4	60%	0.604	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.1	118.7	180	-174.5	33.3	0	0	0	111.3	K500	N476-K500 PolarHBondContact N-O 2.85Å; N476-K500 PolarHBondContact O-N 3.35Å
477	P	87.2	Confident	86.1	Confident	60 Å²	60	55 Å²	55	39%	0.39	30%	0.298	S	S	.	.	S	Bend	cis	-75.7	154.8	-7	32	-36	0	0	0	113.3
478	Q	81.9	Confident	86.1	Confident	82 Å²	82	58.4 Å²	58.4	38%	0.383	32%	0.319	S	S	.	.	S	Bend	trans	-75.7	-28.1	175.1	-73.5	-175.4	-7	0	0	113.4	I475 A615 H616	I475-Q478 WeakPolarHBondContact O-CG 3.47Å; Q478-A615 CarbonylContact O-C 3.57Å; Q478-A615 VanDerWaalsContact O-CA 3.25Å; Q478-A615 WeakPolarHBondContact O-CA 3.33Å; Q478-A615 WeakPolarHBondContact O-CB 3.23Å; Q478-H616 PolarHBondContact O-N 2.83Å
479	I	81.1	Confident	86	Confident	53 Å²	53	56.3 Å²	56.3	27%	0.272	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	121.4	173.7	-59.5	173.7	0	0	0	107.3	H616 L618	I479-H616 CarbonylContact C-O 3.5Å; I479-H616 WeakPolarHBondContact CA-O 3.46Å; I479-L618 HydrophobicContact CG2-CB 3.86Å; I479-L618 HydrophobicContact CG2-CD1 4.02Å; I479-L618 HydrophobicContact CG2-CG 4.3Å
480	I	85.5	Confident	85.6	Confident	3 Å²	3	60.2 Å²	60.2	2%	0.015	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	120.4	-175.8	-58.7	159.4	0	0	0	107.9	P482 F499 L567 I580 A615 H616 L618	I480-P482 WeakPolarHBondContact O-CD 3.21Å; I480-F499 HydrophobicContact CD1-CD1 3.47Å; I480-F499 VanDerWaalsContact CD1-CD1 3.47Å; I480-F499 HydrophobicContact CD1-CE1 3.45Å; I480-F499 VanDerWaalsContact CD1-CE1 3.45Å; I480-F499 HydrophobicContact CD1-CG 4.14Å; I480-F499 HydrophobicContact CD1-CZ 4.09Å; I480-F499 HydrophobicContact CG1-CD1 3.85Å; I480-F499 HydrophobicContact CG1-CE1 4.34Å; I480-F499 HydrophobicContact CG1-CG 4.3Å; I480-L567 HydrophobicContact CG2-CD2 4.11Å; I480-I580 HydrophobicContact CD1-CD1 3.91Å; I480-A615 HydrophobicContact CD1-CB 3.78Å; I480-A615 HydrophobicContact CG1-CB 4.43Å; I480-H616 PolarHBondContact N-O 2.88Å; I480-L618 PolarHBondContact O-N 3.01Å
481	N	83.7	Confident	85	Confident	34 Å²	34	62.4 Å²	62.4	18%	0.182	34%	0.336	C	S	.	.			trans	-91.1	114.4	172.2	-173.4	-5.1	0	0	0	109.8	E483 E484 S497	N481-E483 PolarHBondContact O-N 3.26Å; N481-E483 PolarHBondContact OD1-N 3.19Å; N481-E483 VanDerWaalsContact OD1-N 3.11Å; N481-E484 HydrophobicContact CB-CB 4.06Å; N481-E484 PolarHBondContact O-N 3.26Å; N481-S497 WeakPolarHBondContact O-CB 3.3Å; N481-S497 PolarHBondContact O-OG 2.88Å
482	P	82.4	Confident	84.5	Confident	19 Å²	19	65.9 Å²	65.9	12%	0.123	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-26.3	178.8	-22.5	34.8	0	0	0	114.2	I480 E484 L567 I617	I480-P482 WeakPolarHBondContact O-CD 3.21Å; P482-E484 VanDerWaalsContact C-N 3.34Å; P482-L567 HydrophobicContact CB-CD2 4.49Å; P482-L567 HydrophobicContact CG-CD2 4.3Å; P482-I617 HydrophobicContact CG-CG2 3.67Å
483	E	80.5	Confident	84.1	Confident	147 Å²	147	69.9 Å²	69.9	69%	0.687	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-23.2	-179.4	-62.8	-63	155.3	0	0	112.2	N481 K485	N481-E483 PolarHBondContact O-N 3.26Å; N481-E483 PolarHBondContact OD1-N 3.19Å; N481-E483 VanDerWaalsContact OD1-N 3.11Å; E483-K485 PolarHBondContact O-N 3.14Å; E483-K485 VanDerWaalsContact O-N 3.16Å
484	E	83.8	Confident	83.7	Confident	125 Å²	125	72.5 Å²	72.5	58%	0.584	39%	0.392	S	S	*	.			trans	-85.6	88.3	-179.4	-166.9	175.9	-180	0	0	111.1	N481 P482 S486 S497	N481-E484 HydrophobicContact CB-CB 4.06Å; N481-E484 PolarHBondContact O-N 3.26Å; P482-E484 VanDerWaalsContact C-N 3.34Å; E484-S486 PolarHBondContact O-N 3.29Å; E484-S497 WeakPolarHBondContact O-CA 3.48Å; E484-S497 WeakPolarHBondContact O-CB 3.19Å; E484-S497 PolarHBondContact O-OG 2.84Å
485	K	84.6	Confident	83.5	Confident	88 Å²	88	74.8 Å²	74.8	38%	0.383	40%	0.4	S	S	.	.			trans	-92.3	76.9	-176.2	-57.7	-175.6	179.9	-167.7	0	112.5	E483 Q495 V496 D569	E483-K485 PolarHBondContact O-N 3.14Å; E483-K485 VanDerWaalsContact O-N 3.16Å; K485-Q495 HydrophobicContact CB-CB 3.93Å; K485-V496 CarbonylContact C-O 3.52Å; K485-V496 WeakPolarHBondContact CA-O 3.38Å; K485-D569 IonicContact NZ-OD2 2.74Å
486	S	84.3	Confident	83.3	Confident	81 Å²	81	75.3 Å²	75.3	57%	0.566	40%	0.403	S	S	*	.			trans	-85.1	-24.6	-173.1	53.7	0	0	0	0	115.6	E484 V496 C498	E484-S486 PolarHBondContact O-N 3.29Å; S486-V496 PolarHBondContact N-O 2.88Å; S486-C498 PolarHBondContact OG-SG 3.37Å
487	C	84.9	Confident	83.3	Confident	20 Å²	20	70.3 Å²	70.3	14%	0.135	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	157.1	-178.6	-70.4	0	0	0	0	113.1	Q495 V496 C498 L539	C487-Q495 CarbonylContact O-C 3.55Å; C487-Q495 VanDerWaalsContact O-CA 3.31Å; C487-Q495 WeakPolarHBondContact O-CA 3.22Å; C487-V496 HydrophobicContact CB-CG2 4.33Å; C487-V496 PolarHBondContact N-O 2.95Å; C487-V496 VanDerWaalsContact N-O 3.09Å; C487-V496 PolarHBondContact O-N 3.26Å; C487-C498 HydrophobicContact CB-CB 3.52Å; C487-C498 WeakPolarHBondContact CB-SG 3.08Å; C487-C498 WeakPolarHBondContact SG-CB 3.27Å; C487-C498 CovalentContact SG-SG 2.02Å; C487-C498 PolarHBondContact SG-SG 3.16Å; C487-L539 HydrophobicContact CB-CD1 4.45Å
488	T	85.9	Confident	83.5	Confident	72 Å²	72	68.4 Å²	68.4	44%	0.442	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	131.7	173.3	47	0	0	0	0	110.7	Q495	T488-Q495 HydrophobicContact CG2-CG 3.88Å
489	I	83.9	Confident	83.9	Confident	15 Å²	15	64.7 Å²	64.7	8%	0.077	35%	0.348	C	S	.	.			trans	-72.9	124.6	176.2	-58.9	-178.5	0	0	0	108.7	Q491 T492 N493 T494 V496 L539 Y566	I489-Q491 PolarHBondContact O-N 3.03Å; I489-Q491 VanDerWaalsContact O-N 3.11Å; I489-T492 WeakPolarHBondContact CB-OG1 3.34Å; I489-T492 WeakPolarHBondContact CG2-OG1 3.33Å; I489-T492 PolarHBondContact O-N 2.8Å; I489-N493 WeakPolarHBondContact O-CA 3.42Å; I489-N493 PolarHBondContact O-N 2.85Å; I489-T494 PolarHBondContact N-O 2.84Å; I489-V496 HydrophobicContact CD1-CG1 3.77Å; I489-V496 HydrophobicContact CD1-CG2 4.3Å; I489-V496 HydrophobicContact CG1-CG1 4.03Å; I489-V496 HydrophobicContact CG1-CG2 3.75Å; I489-L539 HydrophobicContact CG1-CD1 4.27Å; I489-Y566 HydrophobicContact CD1-CD2 4.03Å; I489-Y566 HydrophobicContact CD1-CE1 4.36Å; I489-Y566 HydrophobicContact CD1-CE2 3.55Å; I489-Y566 HydrophobicContact CG1-CE2 4.44Å
490	P	79.3	Confident	84.4	Confident	89 Å²	89	66.7 Å²	66.7	58%	0.578	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-28.8	-173.6	-24.4	32	0	0	0	114.8
491	Q	74.4	Confident	84.7	Confident	146 Å²	146	66.6 Å²	66.6	68%	0.682	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-34.6	-173.7	-63.4	169.8	3.8	0	0	113.2	I489	I489-Q491 PolarHBondContact O-N 3.03Å; I489-Q491 VanDerWaalsContact O-N 3.11Å
492	T	79.8	Confident	85.2	Confident	85 Å²	85	68.7 Å²	68.7	52%	0.521	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-8.7	-170.2	51.5	0	0	0	0	113.5	I489 T494	I489-T492 WeakPolarHBondContact CB-OG1 3.34Å; I489-T492 WeakPolarHBondContact CG2-OG1 3.33Å; I489-T492 PolarHBondContact O-N 2.8Å; T492-T494 PolarHBondContact O-N 2.8Å; T492-T494 VanDerWaalsContact O-N 3.13Å; T492-T494 PolarHBondContact OG1-OG1 2.78Å
493	N	80.8	Confident	85.7	Confident	137 Å²	137	67.8 Å²	67.8	73%	0.733	36%	0.356	S	S	*	.			trans	56.4	23.1	-176.7	-139.8	20.1	0	0	0	114	I489	I489-N493 WeakPolarHBondContact O-CA 3.42Å; I489-N493 PolarHBondContact O-N 2.85Å
494	T	83.8	Confident	86.2	Confident	67 Å²	67	61 Å²	61	41%	0.411	33%	0.325	S	S	.	.			trans	-86.4	132.5	178.4	47.5	0	0	0	0	110.3	I489 T492	I489-T494 PolarHBondContact N-O 2.84Å; T492-T494 PolarHBondContact O-N 2.8Å; T492-T494 VanDerWaalsContact O-N 3.13Å; T492-T494 PolarHBondContact OG1-OG1 2.78Å
495	Q	86.4	Confident	86.5	Confident	130 Å²	130	55.1 Å²	55.1	61%	0.607	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	132.5	172.8	-72.4	-174.4	-29.4	0	0	110.7	K485 C487 T488	K485-Q495 HydrophobicContact CB-CB 3.93Å; C487-Q495 CarbonylContact O-C 3.55Å; C487-Q495 VanDerWaalsContact O-CA 3.31Å; C487-Q495 WeakPolarHBondContact O-CA 3.22Å; T488-Q495 HydrophobicContact CG2-CG 3.88Å
496	V	87.5	Confident	86.6	Confident	16 Å²	16	51.4 Å²	51.4	10%	0.097	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	152.9	-177	-68.6	0	0	0	0	111.1	K485 S486 C487 I489 L539 Y566	K485-V496 CarbonylContact C-O 3.52Å; K485-V496 WeakPolarHBondContact CA-O 3.38Å; S486-V496 PolarHBondContact N-O 2.88Å; C487-V496 HydrophobicContact CB-CG2 4.33Å; C487-V496 PolarHBondContact N-O 2.95Å; C487-V496 VanDerWaalsContact N-O 3.09Å; C487-V496 PolarHBondContact O-N 3.26Å; I489-V496 HydrophobicContact CD1-CG1 3.77Å; I489-V496 HydrophobicContact CD1-CG2 4.3Å; I489-V496 HydrophobicContact CG1-CG1 4.03Å; I489-V496 HydrophobicContact CG1-CG2 3.75Å; V496-L539 HydrophobicContact CG2-CD1 4.44Å; V496-Y566 HydrophobicContact CB-CD2 3.98Å; V496-Y566 HydrophobicContact CB-CG 4.42Å; V496-Y566 HydrophobicContact CG1-CD2 4Å; V496-Y566 HydrophobicContact CG2-CD2 3.9Å; V496-Y566 HydrophobicContact CG2-CG 3.9Å
497	S	88.4	Confident	86.7	Confident	8 Å²	8	47.6 Å²	47.6	6%	0.056	26%	0.256	C	S	.	.			trans	-74.7	128.2	172	179.5	0	0	0	0	109.3	N481 E484 Y566 L567	N481-S497 WeakPolarHBondContact O-CB 3.3Å; N481-S497 PolarHBondContact O-OG 2.88Å; E484-S497 WeakPolarHBondContact O-CA 3.48Å; E484-S497 WeakPolarHBondContact O-CB 3.19Å; E484-S497 PolarHBondContact O-OG 2.84Å; S497-Y566 CarbonylContact O-C 3.39Å; S497-Y566 VanDerWaalsContact O-CA 3.27Å; S497-Y566 WeakPolarHBondContact O-CA 3.41Å; S497-L567 PolarHBondContact O-N 2.93Å
498	C	89.8	Confident	86.6	Confident	20 Å²	20	46.8 Å²	46.8	14%	0.135	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	152.6	-175.4	61.2	0	0	0	0	112.4	S486 C487 V565	S486-C498 PolarHBondContact OG-SG 3.37Å; C487-C498 HydrophobicContact CB-CB 3.52Å; C487-C498 WeakPolarHBondContact CB-SG 3.08Å; C487-C498 WeakPolarHBondContact SG-CB 3.27Å; C487-C498 CovalentContact SG-SG 2.02Å; C487-C498 PolarHBondContact SG-SG 3.16Å; C498-V565 CarbonylContact C-O 3.6Å; C498-V565 WeakPolarHBondContact CA-O 3.46Å; C498-V565 WeakPolarHBondContact CB-O 3.39Å
499	F	90.3	Very high	86.2	Confident	3 Å²	3	44.6 Å²	44.6	1%	0.013	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	157.7	175	61.1	-89.1	0	0	0	109.8	I475 I480 V501 A536 V565	I475-F499 HydrophobicContact CG2-CD2 3.6Å; I475-F499 HydrophobicContact CG2-CE2 4.03Å; I475-F499 HydrophobicContact CG2-CG 4.47Å; I480-F499 HydrophobicContact CD1-CD1 3.47Å; I480-F499 VanDerWaalsContact CD1-CD1 3.47Å; I480-F499 HydrophobicContact CD1-CE1 3.45Å; I480-F499 VanDerWaalsContact CD1-CE1 3.45Å; I480-F499 HydrophobicContact CD1-CG 4.14Å; I480-F499 HydrophobicContact CD1-CZ 4.09Å; I480-F499 HydrophobicContact CG1-CD1 3.85Å; I480-F499 HydrophobicContact CG1-CE1 4.34Å; I480-F499 HydrophobicContact CG1-CG 4.3Å; F499-V501 HydrophobicContact CD2-CG2 3.97Å; F499-V501 HydrophobicContact CE2-CG2 3.68Å; F499-A536 HydrophobicContact CE1-CB 4.37Å; F499-A536 HydrophobicContact CZ-CB 4.21Å; F499-V565 HydrophobicContact CD1-CB 4.48Å; F499-V565 HydrophobicContact CD2-CB 4.14Å; F499-V565 HydrophobicContact CE1-CB 4.09Å; F499-V565 HydrophobicContact CE1-CG1 3.69Å; F499-V565 HydrophobicContact CE2-CB 3.73Å; F499-V565 HydrophobicContact CE2-CG1 3.83Å; F499-V565 HydrophobicContact CE2-CG2 4.25Å; F499-V565 HydrophobicContact CZ-CB 3.71Å; F499-V565 HydrophobicContact CZ-CG1 3.3Å; F499-V565 PolarHBondContact N-O 2.94Å; F499-V565 PolarHBondContact O-N 3.03Å; F499-V565 VanDerWaalsContact O-O 3.12Å
500	K	92	Very high	85.7	Confident	96 Å²	96	49.5 Å²	49.5	42%	0.417	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	133.7	-179.1	-62.9	-173	176.8	-172.9	0	110	I475 N476 E564	I475-K500 WeakPolarHBondContact CA-O 3.31Å; N476-K500 PolarHBondContact N-O 2.85Å; N476-K500 PolarHBondContact O-N 3.35Å; K500-E564 HydrophobicContact CG-CG 4.35Å; K500-E564 IonicContact NZ-OE1 3.55Å
501	V	92.8	Very high	85.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	117.1	171.6	178.2	0	0	0	0	107.8	L473 F499 L522 E562 Q563 V565 V582	L473-V501 HydrophobicContact CD1-CG1 3.63Å; F499-V501 HydrophobicContact CD2-CG2 3.97Å; F499-V501 HydrophobicContact CE2-CG2 3.68Å; V501-L522 HydrophobicContact CG1-CD2 3.83Å; V501-E562 WeakPolarHBondContact O-CA 3.45Å; V501-Q563 PolarHBondContact N-O 3.22Å; V501-Q563 PolarHBondContact O-N 3.19Å; V501-V565 HydrophobicContact CB-CG2 4.44Å; V501-V565 HydrophobicContact CG2-CB 4.49Å; V501-V565 HydrophobicContact CG2-CG2 3.71Å; V501-V582 HydrophobicContact CG1-CG1 4.01Å; V501-V582 HydrophobicContact CG2-CG1 4.48Å; V501-V582 HydrophobicContact CG2-CG2 4.42Å
502	K	93.4	Very high	85.1	Confident	78 Å²	78	41.7 Å²	41.7	34%	0.339	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	121.3	177.1	-177.3	174.2	-173.9	162.6	0	109.1	D474 E561 E562	D474-K502 HydrophobicContact CB-CB 4.48Å; D474-K502 PolarHBondContact N-O 3.16Å; D474-K502 PolarHBondContact O-N 3.47Å; K502-E561 WeakPolarHBondContact CA-O 3.5Å; K502-E562 HydrophobicContact CB-CG 4.03Å; K502-E562 HydrophobicContact CD-CG 4.23Å; K502-E562 HydrophobicContact CG-CG 3.89Å; K502-E562 IonicContact NZ-OE1 3.78Å
503	Y	92.6	Very high	84.9	Confident	1 Å²	1	40 Å²	40	0%	0.004	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	138.5	173.7	57.7	-89.1	0	0	0	109.7	T472 V520 L522 M550 C560 E561 Q563 M584	T472-Y503 WeakPolarHBondContact O-CA 3.38Å; Y503-V520 HydrophobicContact CD2-CG1 4.2Å; Y503-V520 HydrophobicContact CE2-CG1 4.31Å; Y503-L522 HydrophobicContact CD1-CD1 3.7Å; Y503-L522 HydrophobicContact CD1-CD2 3.71Å; Y503-L522 HydrophobicContact CD1-CG 4.31Å; Y503-L522 HydrophobicContact CE1-CD1 3.51Å; Y503-L522 HydrophobicContact CE1-CD2 4.24Å; Y503-L522 HydrophobicContact CG-CD1 4.27Å; Y503-L522 HydrophobicContact CG-CD2 4.38Å; Y503-M550 HydrophobicContact CD2-SD 4.36Å; Y503-M550 HydrophobicContact CE2-SD 4.02Å; Y503-C560 WeakPolarHBondContact O-CA 3.43Å; Y503-E561 HydrophobicContact CE1-CB 4.21Å; Y503-E561 HydrophobicContact CE2-CB 3.78Å; Y503-E561 HydrophobicContact CE2-CG 4.37Å; Y503-E561 PolarHBondContact N-O 3.42Å; Y503-E561 PolarHBondContact O-N 2.84Å; Y503-E561 PolarHBondContact OH-OE2 3.33Å; Y503-Q563 HydrophobicContact CE1-CG 3.9Å; Y503-M584 HydrophobicContact CD2-CE 4.24Å
504	C	91.1	Very high	84.8	Confident	5 Å²	5	38.2 Å²	38.2	3%	0.034	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	147.3	176.9	-44.1	0	0	0	0	112	A471 T472 L558 A559 C560	A471-C504 WeakPolarHBondContact CA-O 3.21Å; T472-C504 PolarHBondContact N-O 3.01Å; T472-C504 PolarHBondContact O-N 3.26Å; T472-C504 WeakPolarHBondContact OG1-CB 2.85Å; C504-L558 HydrophobicContact CB-CD1 4.43Å; C504-L558 HydrophobicContact CB-CD2 3.67Å; C504-L558 HydrophobicContact CB-CG 3.73Å; C504-A559 CarbonylContact C-O 3.53Å; C504-A559 WeakPolarHBondContact CA-O 3.43Å; C504-A559 WeakPolarHBondContact CB-O 3.34Å; C504-C560 HydrophobicContact CB-CB 3.97Å; C504-C560 WeakPolarHBondContact CB-SG 3.42Å; C504-C560 WeakPolarHBondContact SG-CB 3.44Å; C504-C560 CovalentContact SG-SG 2.04Å; C504-C560 PolarHBondContact SG-SG 3.46Å
505	L	90.3	Very high	84.8	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	130	175	-68.3	175.3	0	0	0	109.1	V469 A471 F518 V520 M550 V552 A559 M584 Y586	V469-L505 HydrophobicContact CG1-CD2 4.03Å; A471-L505 HydrophobicContact CB-CD2 3.55Å; L505-F518 HydrophobicContact CD1-CB 4.02Å; L505-F518 HydrophobicContact CD1-CD2 4.5Å; L505-F518 HydrophobicContact CD1-CG 4.18Å; L505-V520 HydrophobicContact CD1-CG2 3.59Å; L505-M550 HydrophobicContact CD1-SD 4.15Å; L505-V552 HydrophobicContact CB-CG2 3.99Å; L505-A559 PolarHBondContact N-O 2.86Å; L505-A559 PolarHBondContact O-N 2.87Å; L505-M584 HydrophobicContact CD1-CE 4.08Å; L505-M584 HydrophobicContact CD2-CE 3.5Å; L505-M584 VanDerWaalsContact CD2-CE 3.5Å; L505-M584 HydrophobicContact CG-CE 3.67Å; L505-Y586 HydrophobicContact CD2-CD1 4.32Å; L505-Y586 HydrophobicContact CD2-CG 4.24Å
506	A	88.1	Confident	84.7	Confident	11 Å²	11	32.1 Å²	32.1	9%	0.091	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	128.7	160.6	0	0	0	0	0	108.4	V469 N470 L558	V469-A506 WeakPolarHBondContact CA-O 3.17Å; N470-A506 PolarHBondContact N-O 2.76Å; N470-A506 PolarHBondContact O-N 2.86Å; A506-L558 HydrophobicContact CB-CD1 3.92Å
507	A	86.4	Confident	84.8	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.008	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	146.8	177.8	0	0	0	0	0	110.4	I467 S468 V469 L516 F518 V552 S554 R556	I467-A507 HydrophobicContact CG2-CB 4.13Å; S468-A507 WeakPolarHBondContact O-CA 3.41Å; V469-A507 HydrophobicContact CG2-CB 4.25Å; A507-L516 HydrophobicContact CB-CD1 3.9Å; A507-F518 HydrophobicContact CB-CE2 3.72Å; A507-F518 HydrophobicContact CB-CZ 3.75Å; A507-V552 HydrophobicContact CB-CG1 4.17Å; A507-S554 CarbonylContact O-C 3.03Å; A507-R556 PolarHBondContact O-N 2.85Å
508	G	81.8	Confident	84.8	Confident	3 Å²	3	32.3 Å²	32.3	3%	0.031	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.1	147	171.4	0	0	0	0	0	111.5	S468	S468-G508 PolarHBondContact N-O 2.9Å; S468-G508 PolarHBondContact O-N 3.01Å; S468-G508 VanDerWaalsContact O-N 3.08Å
509	G	76.8	Confident	84.8	Confident	26 Å²	26	37.5 Å²	37.5	27%	0.268	22%	0.219	S	C	.	.			trans	-157.1	153.6	177.7	0	0	0	0	0	110.3	V466	V466-G509 WeakPolarHBondContact O-CA 3.2Å
510	F	73.9	Confident	84.9	Confident	117 Å²	117	37.4 Å²	37.4	51%	0.513	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	139.1	171.9	-166.2	-93.6	0	0	0	108.8	Y445 A512	Y445-F510 WeakPolarHBondContact CE2-O 3.29Å; Y445-F510 PolarHBondContact OH-O 3.42Å; F510-A512 PolarHBondContact O-N 2.97Å
511	G	69.8	Low	84.9	Confident	50 Å²	50	34.7 Å²	34.7	52%	0.515	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	2.1	-177.5	0	0	0	0	0	115.9
512	A	71.3	Confident	84.9	Confident	22 Å²	22	34.7 Å²	34.7	18%	0.182	21%	0.208	C	C	.	.			trans	-80.2	151.3	176.5	0	0	0	0	0	112.5	I467 F510	I467-A512 HydrophobicContact CG1-CB 4.28Å; F510-A512 PolarHBondContact O-N 2.97Å
513	P	76.6	Confident	84.9	Confident	48 Å²	48	31.9 Å²	31.9	31%	0.312	20%	0.197	S	C	.	.			trans	-64.1	156.7	174.3	24.9	-32.1	0	0	0	112.2	S515 L516 S554 A593	P513-S515 VanDerWaalsContact C-N 3.26Å; P513-S515 PolarHBondContact O-N 2.8Å; P513-L516 HydrophobicContact CG-CD2 3.94Å; P513-S554 WeakPolarHBondContact O-CB 3.34Å; P513-A593 HydrophobicContact CG-CB 4.12Å
514	S	78.6	Confident	84.8	Confident	100 Å²	100	31.9 Å²	31.9	70%	0.699	20%	0.198	S	C	*	.	S	Bend	trans	-63.8	-27.4	-172.7	53.2	0	0	0	0	114.4	S554	S514-S554 PolarHBondContact O-N 2.89Å
515	S	82.5	Confident	84.7	Confident	69 Å²	69	31.6 Å²	31.6	48%	0.483	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	136.8	174.4	55.3	0	0	0	0	111.1	P513	P513-S515 VanDerWaalsContact C-N 3.26Å; P513-S515 PolarHBondContact O-N 2.8Å
516	L	85.5	Confident	84.5	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	129.2	179.7	-66	169	0	0	0	109.2	I467 A507 P513 F518 T551 V552 L588 A593	I467-L516 HydrophobicContact CD1-CD1 3.97Å; I467-L516 HydrophobicContact CD1-CD2 3.69Å; I467-L516 HydrophobicContact CD1-CG 4.5Å; I467-L516 HydrophobicContact CG1-CD1 4.47Å; I467-L516 HydrophobicContact CG2-CD1 3.91Å; A507-L516 HydrophobicContact CB-CD1 3.9Å; P513-L516 HydrophobicContact CG-CD2 3.94Å; L516-F518 HydrophobicContact CB-CD2 4.31Å; L516-F518 HydrophobicContact CB-CE2 3.66Å; L516-F518 HydrophobicContact CB-CZ 4.36Å; L516-F518 HydrophobicContact CD1-CE2 4.37Å; L516-T551 CarbonylContact O-C 3.52Å; L516-T551 WeakPolarHBondContact O-CA 3.25Å; L516-V552 PolarHBondContact N-O 3.15Å; L516-V552 PolarHBondContact O-N 3.38Å; L516-L588 HydrophobicContact CB-CD1 4.06Å; L516-L588 HydrophobicContact CD2-CD1 4.19Å; L516-A593 HydrophobicContact CD2-CB 4.18Å
517	S	87.9	Confident	84.2	Confident	26 Å²	26	41.2 Å²	41.2	18%	0.182	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	114.3	179.1	-174	0	0	0	0	110.3	D589	S517-D589 PolarHBondContact O-N 2.92Å
518	F	88.7	Confident	83.9	Confident	1 Å²	1	43.5 Å²	43.5	0%	0.004	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	141.9	176.7	-69	-88.2	0	0	0	110.8	V469 L505 A507 L516 N549 M550 V552 Y586 S587 L588 I603	V469-F518 HydrophobicContact CG2-CE1 3.89Å; V469-F518 HydrophobicContact CG2-CZ 3.8Å; L505-F518 HydrophobicContact CD1-CB 4.02Å; L505-F518 HydrophobicContact CD1-CD2 4.5Å; L505-F518 HydrophobicContact CD1-CG 4.18Å; A507-F518 HydrophobicContact CB-CE2 3.72Å; A507-F518 HydrophobicContact CB-CZ 3.75Å; L516-F518 HydrophobicContact CB-CD2 4.31Å; L516-F518 HydrophobicContact CB-CE2 3.66Å; L516-F518 HydrophobicContact CB-CZ 4.36Å; L516-F518 HydrophobicContact CD1-CE2 4.37Å; F518-N549 CarbonylContact O-C 3.54Å; F518-N549 WeakPolarHBondContact O-CA 3.23Å; F518-M550 PolarHBondContact N-O 2.77Å; F518-M550 PolarHBondContact O-N 3.37Å; F518-V552 HydrophobicContact CD2-CB 4.21Å; F518-V552 HydrophobicContact CD2-CG2 3.83Å; F518-V552 HydrophobicContact CE2-CB 4.19Å; F518-V552 HydrophobicContact CE2-CG2 4.22Å; F518-Y586 HydrophobicContact CD1-CD2 4.32Å; F518-Y586 HydrophobicContact CE1-CD2 4.47Å; F518-S587 CarbonylContact C-O 3.56Å; F518-S587 VanDerWaalsContact CA-O 3.31Å; F518-S587 WeakPolarHBondContact CA-O 3.4Å; F518-L588 HydrophobicContact CD1-CB 4.13Å; F518-L588 HydrophobicContact CD1-CD1 4.04Å; F518-L588 HydrophobicContact CD2-CD1 4.33Å; F518-L588 HydrophobicContact CE1-CB 3.94Å; F518-L588 HydrophobicContact CE1-CD1 3.74Å; F518-L588 HydrophobicContact CE1-CG 4.4Å; F518-L588 HydrophobicContact CE2-CD1 4.05Å; F518-L588 HydrophobicContact CG-CD1 4.33Å; F518-L588 HydrophobicContact CZ-CD1 3.75Å; F518-I603 HydrophobicContact CE1-CD1 4.44Å
519	R	91.2	Very high	83.4	Confident	130 Å²	130	50.7 Å²	50.7	49%	0.491	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	117.9	164.3	176.2	179.8	175.8	160.5	3.5	108.5	D521 Y586 S587	R519-D521 IonicContact NE-OD1 3.29Å; R519-D521 IonicContact NE-OD2 3.41Å; R519-Y586 CarbonylContact O-C 3.47Å; R519-Y586 WeakPolarHBondContact O-CA 3.08Å; R519-S587 PolarHBondContact N-O 3.43Å; R519-S587 PolarHBondContact O-N 2.63Å; R519-S587 PolarHBondContact O-OG 2.88Å
520	V	91.7	Very high	82.8	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.006	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	124.3	-179.4	-177.5	0	0	0	0	109.2	Y503 L505 L522 S547 K548 M550 M584 E585	Y503-V520 HydrophobicContact CD2-CG1 4.2Å; Y503-V520 HydrophobicContact CE2-CG1 4.31Å; L505-V520 HydrophobicContact CD1-CG2 3.59Å; V520-L522 HydrophobicContact CG1-CD1 3.92Å; V520-S547 WeakPolarHBondContact O-CA 3.32Å; V520-K548 PolarHBondContact N-O 3.36Å; V520-K548 PolarHBondContact O-N 3.46Å; V520-M550 HydrophobicContact CG2-CB 4.37Å; V520-M584 HydrophobicContact CG1-CE 3.66Å; V520-M584 HydrophobicContact CG1-CG 3.82Å; V520-M584 HydrophobicContact CG1-SD 4.48Å; V520-M584 HydrophobicContact CG2-CE 4.21Å; V520-E585 CarbonylContact C-O 3.54Å; V520-E585 WeakPolarHBondContact CA-O 3.47Å
521	D	92.8	Very high	82.3	Confident	38 Å²	38	62.8 Å²	62.8	20%	0.203	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	114.4	177.6	-66.3	-29.8	0	0	0	109.1	R519 Y546 S547 E585	R519-D521 IonicContact NE-OD1 3.29Å; R519-D521 IonicContact NE-OD2 3.41Å; D521-Y546 CarbonylContact C-O 3.57Å; D521-Y546 WeakPolarHBondContact CA-O 3.37Å; D521-S547 WeakPolarHBondContact OD1-CB 3.38Å; D521-S547 PolarHBondContact OD1-OG 2.73Å; D521-E585 HydrophobicContact CB-CB 4.44Å; D521-E585 PolarHBondContact N-O 2.81Å; D521-E585 PolarHBondContact O-N 3.44Å
522	L	92.2	Very high	82.4	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	132.2	173.3	-70	105.4	0	0	0	110.6	L473 V501 Y503 V520 F538 Q545 Y546	L473-L522 HydrophobicContact CD1-CD2 4.35Å; V501-L522 HydrophobicContact CG1-CD2 3.83Å; Y503-L522 HydrophobicContact CD1-CD1 3.7Å; Y503-L522 HydrophobicContact CD1-CD2 3.71Å; Y503-L522 HydrophobicContact CD1-CG 4.31Å; Y503-L522 HydrophobicContact CE1-CD1 3.51Å; Y503-L522 HydrophobicContact CE1-CD2 4.24Å; Y503-L522 HydrophobicContact CG-CD1 4.27Å; Y503-L522 HydrophobicContact CG-CD2 4.38Å; V520-L522 HydrophobicContact CG1-CD1 3.92Å; L522-F538 HydrophobicContact CB-CZ 3.83Å; L522-Q545 WeakPolarHBondContact O-CA 3.36Å; L522-Y546 HydrophobicContact CD1-CD1 3.87Å; L522-Y546 HydrophobicContact CD1-CE1 4.46Å; L522-Y546 PolarHBondContact N-O 3.45Å; L522-Y546 PolarHBondContact O-N 3.05Å
523	T	92.3	Very high	82.7	Confident	18 Å²	18	65.1 Å²	65.1	11%	0.11	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	124.8	177.3	63.7	0	0	0	0	110.3	Q545 V582 A583	T523-Q545 HydrophobicContact CG2-CG 4.15Å; T523-V582 WeakPolarHBondContact O-CA 3.48Å; T523-A583 PolarHBondContact N-O 3.04Å; T523-A583 PolarHBondContact O-N 2.79Å; T523-A583 WeakPolarHBondContact OG1-CB 3.29Å; T523-A583 PolarHBondContact OG1-O 3.49Å
524	L	91.7	Very high	83.1	Confident	1 Å²	1	64 Å²	64	1%	0.005	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	143	178.2	-58.3	175.1	0	0	0	111	R526 A536 F538 Y544 V565 V582	L524-R526 PolarHBondContact O-N 2.82Å; L524-A536 HydrophobicContact CD1-CB 4.47Å; L524-F538 HydrophobicContact CD1-CD1 4.18Å; L524-F538 HydrophobicContact CD1-CD2 3.73Å; L524-F538 HydrophobicContact CD1-CE1 4.08Å; L524-F538 HydrophobicContact CD1-CE2 3.61Å; L524-F538 HydrophobicContact CD1-CG 4Å; L524-F538 HydrophobicContact CD1-CZ 3.79Å; L524-F538 HydrophobicContact CD2-CE1 4.22Å; L524-F538 HydrophobicContact CD2-CE2 4.39Å; L524-F538 HydrophobicContact CD2-CZ 3.86Å; L524-F538 HydrophobicContact CG-CD2 4.31Å; L524-F538 HydrophobicContact CG-CE1 4.29Å; L524-F538 HydrophobicContact CG-CE2 3.67Å; L524-F538 HydrophobicContact CG-CZ 3.65Å; L524-Y544 PolarHBondContact N-O 2.66Å; L524-V565 HydrophobicContact CD1-CB 4.47Å; L524-V565 HydrophobicContact CD1-CG1 3.54Å; L524-V565 HydrophobicContact CD1-CG2 4.05Å; L524-V565 HydrophobicContact CD2-CG1 4.12Å; L524-V565 HydrophobicContact CD2-CG2 4.01Å; L524-V565 HydrophobicContact CG-CG1 4.48Å; L524-V582 HydrophobicContact CD2-CB 4.47Å; L524-V582 HydrophobicContact CD2-CG1 4.03Å; L524-V582 HydrophobicContact CD2-CG2 3.82Å
525	D	88.1	Confident	83.5	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.291	C	S	.	.	S	Bend	trans	53.7	50	177.1	-155.8	8.6	0	0	0	112.2	L527 K528 K534 R535 I580 S581	D525-L527 VanDerWaalsContact C-N 3.31Å; D525-L527 PolarHBondContact O-N 3.11Å; D525-K528 PolarHBondContact O-N 2.87Å; D525-K528 WeakPolarHBondContact OD1-CG 3.48Å; D525-K534 HydrophobicContact CB-CD 4.09Å; D525-K534 PolarHBondContact O-NZ 3.09Å; D525-R535 IonicContact OD1-CZ 3.96Å; D525-R535 IonicContact OD1-NE 2.82Å; D525-R535 IonicContact OD1-NH2 3.73Å; D525-R535 PolarHBondContact OD1-NH2 2.82Å; D525-R535 IonicContact OD2-CZ 3.15Å; D525-R535 PolarHBondContact OD2-N 2.86Å; D525-R535 VanDerWaalsContact OD2-N 3.16Å; D525-R535 IonicContact OD2-NE 3.92Å; D525-R535 PolarHBondContact OD2-NE 3.03Å; D525-R535 IonicContact OD2-NH2 2.8Å; D525-I580 HydrophobicContact CB-CG2 4.46Å; D525-S581 VanDerWaalsContact CA-O 3.25Å; D525-S581 WeakPolarHBondContact CA-O 3.41Å; D525-S581 PolarHBondContact N-O 2.89Å
526	R	85.8	Confident	83.8	Confident	108 Å²	108	56.1 Å²	56.1	41%	0.408	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-35.9	-174.1	-176.3	177.9	-178.4	109.2	-13	113.3	L524 K528 S581 A583 E585	L524-R526 PolarHBondContact O-N 2.82Å; R526-K528 PolarHBondContact O-N 3.31Å; R526-S581 PolarHBondContact N-O 2.78Å; R526-A583 HydrophobicContact CB-CB 4.28Å; R526-A583 VanDerWaalsContact CD-CB 3.48Å; R526-A583 HydrophobicContact CG-CB 4.48Å; R526-E585 IonicContact CZ-OE1 3.34Å; R526-E585 VanDerWaalsContact CZ-OE1 3.24Å; R526-E585 IonicContact NH1-OE1 3.41Å; R526-E585 PolarHBondContact NH1-OE1 2.82Å; R526-E585 IonicContact NH2-OE1 3Å; R526-E585 PolarHBondContact NH2-OE1 3.12Å
527	L	82.6	Confident	84.1	Confident	104 Å²	104	56.4 Å²	56.4	55%	0.545	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-23.2	-177.9	-67.2	173.8	0	0	0	113.1	D525 P579	D525-L527 VanDerWaalsContact C-N 3.31Å; D525-L527 PolarHBondContact O-N 3.11Å; L527-P579 HydrophobicContact CD1-CG 4.19Å
528	K	80.1	Confident	84.2	Confident	50 Å²	50	55.3 Å²	55.3	22%	0.217	26%	0.262	C	S	.	.	S	Bend	trans	-74.3	133.7	174.3	-81.5	-72	-177.3	-174.4	0	111.2	D525 R526 A532 K534 D575	D525-K528 PolarHBondContact O-N 2.87Å; D525-K528 WeakPolarHBondContact OD1-CG 3.48Å; R526-K528 PolarHBondContact O-N 3.31Å; K528-A532 HydrophobicContact CB-CB 4.5Å; K528-A532 HydrophobicContact CD-CB 4.17Å; K528-K534 HydrophobicContact CB-CD 4.46Å; K528-K534 PolarHBondContact O-NZ 2.84Å; K528-D575 WeakPolarHBondContact CE-OD2 3.34Å; K528-D575 IonicContact NZ-OD2 3.78Å; K528-D575 PolarHBondContact NZ-OD2 2.84Å
529	Q	70.8	Confident	84.2	Confident	153 Å²	153	55.8 Å²	55.8	72%	0.715	26%	0.264	S	S	*	.			trans	-53.7	151.9	175.4	-68.2	-158.3	-8.7	0	0	112.1	E531 A532	Q529-E531 PolarHBondContact O-N 2.76Å; Q529-E531 VanDerWaalsContact O-N 3.14Å; Q529-A532 PolarHBondContact O-N 3.16Å
530	K	65.1	Low	83.9	Confident	209 Å²	209	55.8 Å²	55.8	91%	0.909	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-26.7	-175.6	-73.2	-175.8	177.7	179.9	0	113.8
531	E	62.8	Low	83.6	Confident	189 Å²	189	58.2 Å²	58.2	88%	0.883	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-10.8	179.9	-64.9	175.6	-178.3	0	0	113.6	Q529	Q529-E531 PolarHBondContact O-N 2.76Å; Q529-E531 VanDerWaalsContact O-N 3.14Å
532	A	72.4	Confident	83.2	Confident	38 Å²	38	58.2 Å²	58.2	31%	0.314	29%	0.291	S	S	.	.	S	Bend	trans	-82.4	149.2	178	0	0	0	0	0	111.3	K528 Q529 K534	K528-A532 HydrophobicContact CB-CB 4.5Å; K528-A532 HydrophobicContact CD-CB 4.17Å; Q529-A532 PolarHBondContact O-N 3.16Å; A532-K534 PolarHBondContact O-N 2.86Å
533	T	77.2	Confident	83	Confident	82 Å²	82	61 Å²	61	50%	0.503	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-62.1	120.5	175.6	47.4	0	0	0	0	110.6
534	K	84.7	Confident	82.8	Confident	26 Å²	26	64.8 Å²	64.8	11%	0.113	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-72.7	128.7	174.7	-62.3	-64.2	-174.8	-180	0	109.4	D525 K528 A532 Y544 R568	D525-K534 HydrophobicContact CB-CD 4.09Å; D525-K534 PolarHBondContact O-NZ 3.09Å; K528-K534 HydrophobicContact CB-CD 4.46Å; K528-K534 PolarHBondContact O-NZ 2.84Å; A532-K534 PolarHBondContact O-N 2.86Å; K534-Y544 HydrophobicContact CB-CG 4.5Å; K534-Y544 HydrophobicContact CG-CD1 4.13Å; K534-Y544 HydrophobicContact CG-CD2 4.37Å; K534-Y544 HydrophobicContact CG-CG 3.94Å; K534-R568 VanDerWaalsContact O-CD 3.27Å; K534-R568 WeakPolarHBondContact O-CD 3.39Å; K534-R568 PolarHBondContact O-NE 3.01Å
535	R	88.2	Confident	82.8	Confident	2 Å²	2	69.8 Å²	69.8	1%	0.008	35%	0.345	C	S	.	.	S	Bend	trans	-83.7	-30.4	-171.6	-62.4	172.2	-70.3	166.1	6.1	113.4	D525 L567 R568 F573 D575 T578 P579	D525-R535 IonicContact OD1-CZ 3.96Å; D525-R535 IonicContact OD1-NE 2.82Å; D525-R535 IonicContact OD1-NH2 3.73Å; D525-R535 PolarHBondContact OD1-NH2 2.82Å; D525-R535 IonicContact OD2-CZ 3.15Å; D525-R535 PolarHBondContact OD2-N 2.86Å; D525-R535 VanDerWaalsContact OD2-N 3.16Å; D525-R535 IonicContact OD2-NE 3.92Å; D525-R535 PolarHBondContact OD2-NE 3.03Å; D525-R535 IonicContact OD2-NH2 2.8Å; R535-L567 HydrophobicContact CB-CD1 4.16Å; R535-R568 WeakPolarHBondContact O-CB 3.48Å; R535-R568 PolarHBondContact O-N 3.1Å; R535-F573 HydrophobicContact CB-CD2 4.46Å; R535-F573 HydrophobicContact CB-CG 4.38Å; R535-F573 HydrophobicContact CG-CB 3.87Å; R535-F573 HydrophobicContact CG-CD1 4.37Å; R535-F573 HydrophobicContact CG-CD2 3.77Å; R535-F573 HydrophobicContact CG-CE2 4.45Å; R535-F573 HydrophobicContact CG-CG 3.73Å; R535-D575 WeakPolarHBondContact CD-O 3.48Å; R535-D575 PolarHBondContact NH1-O 3.17Å; R535-T578 VanDerWaalsContact CZ-O 3.28Å; R535-T578 PolarHBondContact NH1-O 2.84Å; R535-T578 PolarHBondContact NH2-O 2.77Å; R535-P579 PolarHBondContact NH2-O 2.82Å
536	A	88.9	Confident	83	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	140.8	-179.1	0	0	0	0	0	111.2	F499 L524 V565 Y566 I580	F499-A536 HydrophobicContact CE1-CB 4.37Å; F499-A536 HydrophobicContact CZ-CB 4.21Å; L524-A536 HydrophobicContact CD1-CB 4.47Å; A536-V565 HydrophobicContact CB-CG1 3.88Å; A536-Y566 WeakPolarHBondContact CA-O 3.25Å; A536-I580 HydrophobicContact CB-CG2 3.94Å
537	L	90.6	Very high	83.2	Confident	8 Å²	8	70.4 Å²	70.4	4%	0.042	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	150.4	-179.2	-63.2	174.9	0	0	0	110.7	V565 Y566 R568	L537-V565 CarbonylContact O-C 3.58Å; L537-V565 WeakPolarHBondContact O-CA 3.4Å; L537-V565 WeakPolarHBondContact O-CG1 3.27Å; L537-Y566 HydrophobicContact CB-CD1 4.25Å; L537-Y566 HydrophobicContact CB-CE1 3.61Å; L537-Y566 WeakPolarHBondContact CD1-OH 3.4Å; L537-Y566 PolarHBondContact N-O 3.42Å; L537-Y566 WeakPolarHBondContact O-CD1 3.32Å; L537-Y566 PolarHBondContact O-N 3.19Å; L537-R568 HydrophobicContact CD1-CG 4.25Å
538	F	91.4	Very high	83.6	Confident	3 Å²	3	68.7 Å²	68.7	1%	0.013	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	137.2	173.1	-68.2	-72.4	0	0	0	110.8	L522 L524 H540 S541 A542 T543 Q563 V565	L522-F538 HydrophobicContact CB-CZ 3.83Å; L524-F538 HydrophobicContact CD1-CD1 4.18Å; L524-F538 HydrophobicContact CD1-CD2 3.73Å; L524-F538 HydrophobicContact CD1-CE1 4.08Å; L524-F538 HydrophobicContact CD1-CE2 3.61Å; L524-F538 HydrophobicContact CD1-CG 4Å; L524-F538 HydrophobicContact CD1-CZ 3.79Å; L524-F538 HydrophobicContact CD2-CE1 4.22Å; L524-F538 HydrophobicContact CD2-CE2 4.39Å; L524-F538 HydrophobicContact CD2-CZ 3.86Å; L524-F538 HydrophobicContact CG-CD2 4.31Å; L524-F538 HydrophobicContact CG-CE1 4.29Å; L524-F538 HydrophobicContact CG-CE2 3.67Å; L524-F538 HydrophobicContact CG-CZ 3.65Å; F538-H540 PolarHBondContact O-N 2.62Å; F538-S541 WeakPolarHBondContact CB-OG 3.27Å; F538-A542 VanDerWaalsContact O-CA 3.27Å; F538-A542 WeakPolarHBondContact O-CA 3.16Å; F538-A542 PolarHBondContact O-N 2.88Å; F538-T543 VanDerWaalsContact CD2-O 3.24Å; F538-T543 WeakPolarHBondContact CD2-O 3.4Å; F538-T543 PolarHBondContact N-O 2.81Å; F538-Q563 HydrophobicContact CD1-CB 4.26Å; F538-Q563 HydrophobicContact CE1-CB 4.17Å; F538-V565 HydrophobicContact CD1-CG2 3.62Å; F538-V565 HydrophobicContact CE1-CG2 3.66Å
539	L	87.8	Confident	84.1	Confident	11 Å²	11	71.8 Å²	71.8	6%	0.058	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-38.5	-171	-171.5	69.6	0	0	0	113.8	C487 I489 V496 E564 Y566	C487-L539 HydrophobicContact CB-CD1 4.45Å; I489-L539 HydrophobicContact CG1-CD1 4.27Å; V496-L539 HydrophobicContact CG2-CD1 4.44Å; L539-E564 HydrophobicContact CB-CB 4.17Å; L539-E564 WeakPolarHBondContact CB-O 3.08Å; L539-E564 HydrophobicContact CD2-CB 4.17Å; L539-E564 WeakPolarHBondContact CD2-OE2 3.48Å; L539-E564 PolarHBondContact N-O 2.93Å; L539-Y566 HydrophobicContact CB-CD1 4.41Å; L539-Y566 HydrophobicContact CD1-CD1 3.99Å; L539-Y566 HydrophobicContact CD1-CG 4.37Å
540	H	84.9	Confident	84.9	Confident	129 Å²	129	65 Å²	65	60%	0.597	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-41.1	-173.7	-66.5	81.5	0	0	0	113.2	F538	F538-H540 PolarHBondContact O-N 2.62Å
541	S	84.8	Confident	86	Confident	53 Å²	53	60 Å²	60	37%	0.371	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-16.5	-177.8	62	0	0	0	0	113.5	F538 T543	F538-S541 WeakPolarHBondContact CB-OG 3.27Å; S541-T543 WeakPolarHBondContact CB-OG1 3.28Å; S541-T543 PolarHBondContact O-N 2.73Å; S541-T543 VanDerWaalsContact O-N 3.08Å; S541-T543 PolarHBondContact OG-N 3.31Å; S541-T543 PolarHBondContact OG-OG1 3.34Å
542	A	84.4	Confident	87.1	Confident	37 Å²	37	51 Å²	51	31%	0.306	28%	0.279	S	S	.	.			trans	52.8	22.7	-171	0	0	0	0	0	113.8	F538	F538-A542 VanDerWaalsContact O-CA 3.27Å; F538-A542 WeakPolarHBondContact O-CA 3.16Å; F538-A542 PolarHBondContact O-N 2.88Å
543	T	89	Confident	87.7	Confident	61 Å²	61	53.8 Å²	53.8	37%	0.374	29%	0.288	S	S	.	.			trans	-105.5	160.9	176.8	56	0	0	0	0	110.8	F538 S541 Q545	F538-T543 VanDerWaalsContact CD2-O 3.24Å; F538-T543 WeakPolarHBondContact CD2-O 3.4Å; F538-T543 PolarHBondContact N-O 2.81Å; S541-T543 WeakPolarHBondContact CB-OG1 3.28Å; S541-T543 PolarHBondContact O-N 2.73Å; S541-T543 VanDerWaalsContact O-N 3.08Å; S541-T543 PolarHBondContact OG-N 3.31Å; S541-T543 PolarHBondContact OG-OG1 3.34Å; T543-Q545 PolarHBondContact OG1-O 3.41Å
544	Y	88.7	Confident	87.6	Confident	97 Å²	97	50.9 Å²	50.9	38%	0.38	27%	0.271	S	S	.	.	S	Bend	trans	-91.8	-8.4	173	65.1	-87.9	0	0	0	112.9	L524 K534	L524-Y544 PolarHBondContact N-O 2.66Å; K534-Y544 HydrophobicContact CB-CG 4.5Å; K534-Y544 HydrophobicContact CG-CD1 4.13Å; K534-Y544 HydrophobicContact CG-CD2 4.37Å; K534-Y544 HydrophobicContact CG-CG 3.94Å
545	Q	90.6	Very high	87.1	Confident	106 Å²	106	55.4 Å²	55.4	50%	0.495	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	139.5	176.2	-77.6	176.2	-22.5	0	0	110.1	L522 T523 T543	L522-Q545 WeakPolarHBondContact O-CA 3.36Å; T523-Q545 HydrophobicContact CG2-CG 4.15Å; T543-Q545 PolarHBondContact OG1-O 3.41Å
546	Y	91.5	Very high	86.3	Confident	54 Å²	54	64.4 Å²	64.4	21%	0.212	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	131.1	175.8	176.7	-100.4	0	0	0	109.6	D521 L522 K548 Q563	D521-Y546 CarbonylContact C-O 3.57Å; D521-Y546 WeakPolarHBondContact CA-O 3.37Å; L522-Y546 HydrophobicContact CD1-CD1 3.87Å; L522-Y546 HydrophobicContact CD1-CE1 4.46Å; L522-Y546 PolarHBondContact N-O 3.45Å; L522-Y546 PolarHBondContact O-N 3.05Å; Y546-K548 HydrophobicContact CE1-CB 3.79Å; Y546-K548 HydrophobicContact CE1-CD 4.32Å; Y546-K548 WeakPolarHBondContact OH-CD 3.07Å; Y546-Q563 HydrophobicContact CD1-CG 4.42Å; Y546-Q563 HydrophobicContact CE1-CG 4.03Å; Y546-Q563 PolarHBondContact OH-NE2 3.27Å
547	S	91.8	Very high	85.9	Confident	66 Å²	66	73 Å²	73	46%	0.462	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	131.6	-179	-66.8	0	0	0	0	109.4	V520 D521	V520-S547 WeakPolarHBondContact O-CA 3.32Å; D521-S547 WeakPolarHBondContact OD1-CB 3.38Å; D521-S547 PolarHBondContact OD1-OG 2.73Å
548	K	90.1	Very high	85.6	Confident	69 Å²	69	77.3 Å²	77.3	30%	0.3	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	144.4	177	-176.5	164.5	170.6	-161.1	0	112.4	V520 Y546 E561	V520-K548 PolarHBondContact N-O 3.36Å; V520-K548 PolarHBondContact O-N 3.46Å; Y546-K548 HydrophobicContact CE1-CB 3.79Å; Y546-K548 HydrophobicContact CE1-CD 4.32Å; Y546-K548 WeakPolarHBondContact OH-CD 3.07Å; K548-E561 WeakPolarHBondContact CD-OE2 3.38Å; K548-E561 WeakPolarHBondContact CE-OE1 3.36Å; K548-E561 VanDerWaalsContact CE-OE2 3.27Å; K548-E561 WeakPolarHBondContact CE-OE2 3.4Å; K548-E561 IonicContact NZ-OE1 3.81Å; K548-E561 PolarHBondContact NZ-OE1 3.19Å; K548-E561 IonicContact NZ-OE2 3.23Å; K548-E561 PolarHBondContact NZ-OE2 3.46Å
549	N	91.1	Very high	85.4	Confident	114 Å²	114	78.4 Å²	78.4	61%	0.61	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.4	132.3	171	-64.6	-14	0	0	0	109.7	F518	F518-N549 CarbonylContact O-C 3.54Å; F518-N549 WeakPolarHBondContact O-CA 3.23Å
550	M	87.8	Confident	85.5	Confident	10 Å²	10	80.5 Å²	80.5	5%	0.049	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	123.3	-173.9	-176.1	171.1	-171.5	0	0	109.8	Y503 L505 F518 V520 V552 A559 E561	Y503-M550 HydrophobicContact CD2-SD 4.36Å; Y503-M550 HydrophobicContact CE2-SD 4.02Å; L505-M550 HydrophobicContact CD1-SD 4.15Å; F518-M550 PolarHBondContact N-O 2.77Å; F518-M550 PolarHBondContact O-N 3.37Å; V520-M550 HydrophobicContact CG2-CB 4.37Å; M550-V552 HydrophobicContact CG-CG2 4.32Å; M550-A559 HydrophobicContact CE-CB 3.46Å; M550-A559 VanDerWaalsContact CE-CB 3.46Å; M550-A559 WeakPolarHBondContact CE-O 3.36Å; M550-E561 HydrophobicContact CE-CG 4.19Å
551	T	87.4	Confident	85.8	Confident	105 Å²	105	76.9 Å²	76.9	64%	0.644	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	123.1	176.2	53.9	0	0	0	0	110.4	L516	L516-T551 CarbonylContact O-C 3.52Å; L516-T551 WeakPolarHBondContact O-CA 3.25Å
552	V	86	Confident	86.2	Confident	0 Å²	0	79.3 Å²	79.3	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	134.8	-179.7	-175.5	0	0	0	0	109	L505 A507 L516 F518 M550 A559	L505-V552 HydrophobicContact CB-CG2 3.99Å; A507-V552 HydrophobicContact CB-CG1 4.17Å; L516-V552 PolarHBondContact N-O 3.15Å; L516-V552 PolarHBondContact O-N 3.38Å; F518-V552 HydrophobicContact CD2-CB 4.21Å; F518-V552 HydrophobicContact CD2-CG2 3.83Å; F518-V552 HydrophobicContact CE2-CB 4.19Å; F518-V552 HydrophobicContact CE2-CG2 4.22Å; M550-V552 HydrophobicContact CG-CG2 4.32Å; V552-A559 HydrophobicContact CG1-CB 4.42Å; V552-A559 HydrophobicContact CG2-CB 4.22Å
553	N	84.6	Confident	86.5	Confident	96 Å²	96	79.2 Å²	79.2	51%	0.513	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	139.2	174.6	-68.7	-23.5	0	0	0	110	N555	N553-N555 PolarHBondContact O-N 3.05Å
554	S	74.8	Confident	86.6	Confident	21 Å²	21	79.6 Å²	79.6	15%	0.147	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	4.3	-176.5	-170.9	0	0	0	0	115.3	A507 P513 S514 R556	A507-S554 CarbonylContact O-C 3.03Å; P513-S554 WeakPolarHBondContact O-CB 3.34Å; S514-S554 PolarHBondContact O-N 2.89Å; S554-R556 PolarHBondContact O-N 2.93Å; S554-R556 VanDerWaalsContact O-N 3.16Å
555	N	74.4	Confident	86.8	Confident	122 Å²	122	75 Å²	75	65%	0.652	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	23.6	-177.5	-67.5	4.1	0	0	0	113.4	N553 R557	N553-N555 PolarHBondContact O-N 3.05Å; N555-R557 HydrophobicContact CB-CG 4.41Å; N555-R557 PolarHBondContact O-N 3.14Å
556	R	71.6	Confident	86.8	Confident	190 Å²	190	71 Å²	71	72%	0.717	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	22.4	-174.1	-62.4	-175.4	173.1	-174.9	-1.6	114.2	A507 S554	A507-R556 PolarHBondContact O-N 2.85Å; S554-R556 PolarHBondContact O-N 2.93Å; S554-R556 VanDerWaalsContact O-N 3.16Å
557	R	79.9	Confident	86.7	Confident	180 Å²	180	68.6 Å²	68.6	68%	0.679	34%	0.343	S	S	*	.			trans	-80.1	134.3	176.7	-73.8	-171.7	178.6	-178.8	0.2	109.3	N555 A559	N555-R557 HydrophobicContact CB-CG 4.41Å; N555-R557 PolarHBondContact O-N 3.14Å; R557-A559 PolarHBondContact O-N 2.98Å
558	L	84.3	Confident	86.5	Confident	99 Å²	99	69 Å²	69	52%	0.518	34%	0.335	S	S	.	.			trans	-68.7	113.5	177.7	-144.1	87.7	0	0	0	109.1	C504 A506 C560	C504-L558 HydrophobicContact CB-CD1 4.43Å; C504-L558 HydrophobicContact CB-CD2 3.67Å; C504-L558 HydrophobicContact CB-CG 3.73Å; A506-L558 HydrophobicContact CB-CD1 3.92Å; L558-C560 VanDerWaalsContact CD2-SG 3.53Å
559	A	88.3	Confident	86.1	Confident	27 Å²	27	68.7 Å²	68.7	22%	0.223	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	123.1	168.7	0	0	0	0	0	107.5	C504 L505 M550 V552 R557	C504-A559 CarbonylContact C-O 3.53Å; C504-A559 WeakPolarHBondContact CA-O 3.43Å; C504-A559 WeakPolarHBondContact CB-O 3.34Å; L505-A559 PolarHBondContact N-O 2.86Å; L505-A559 PolarHBondContact O-N 2.87Å; M550-A559 HydrophobicContact CE-CB 3.46Å; M550-A559 VanDerWaalsContact CE-CB 3.46Å; M550-A559 WeakPolarHBondContact CE-O 3.36Å; V552-A559 HydrophobicContact CG1-CB 4.42Å; V552-A559 HydrophobicContact CG2-CB 4.22Å; R557-A559 PolarHBondContact O-N 2.98Å
560	C	90.5	Very high	85.2	Confident	54 Å²	54	65.6 Å²	65.6	37%	0.365	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	145.7	-175.6	-66	0	0	0	0	111.1	Y503 C504 L558	Y503-C560 WeakPolarHBondContact O-CA 3.43Å; C504-C560 HydrophobicContact CB-CB 3.97Å; C504-C560 WeakPolarHBondContact CB-SG 3.42Å; C504-C560 WeakPolarHBondContact SG-CB 3.44Å; C504-C560 CovalentContact SG-SG 2.04Å; C504-C560 PolarHBondContact SG-SG 3.46Å; L558-C560 VanDerWaalsContact CD2-SG 3.53Å
561	E	90.4	Very high	84.6	Confident	53 Å²	53	76.3 Å²	76.3	25%	0.248	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	157	166.7	-62.4	-168.4	151.2	0	0	110.4	K502 Y503 K548 M550	K502-E561 WeakPolarHBondContact CA-O 3.5Å; Y503-E561 HydrophobicContact CE1-CB 4.21Å; Y503-E561 HydrophobicContact CE2-CB 3.78Å; Y503-E561 HydrophobicContact CE2-CG 4.37Å; Y503-E561 PolarHBondContact N-O 3.42Å; Y503-E561 PolarHBondContact O-N 2.84Å; Y503-E561 PolarHBondContact OH-OE2 3.33Å; K548-E561 WeakPolarHBondContact CD-OE2 3.38Å; K548-E561 WeakPolarHBondContact CE-OE1 3.36Å; K548-E561 VanDerWaalsContact CE-OE2 3.27Å; K548-E561 WeakPolarHBondContact CE-OE2 3.4Å; K548-E561 IonicContact NZ-OE1 3.81Å; K548-E561 PolarHBondContact NZ-OE1 3.19Å; K548-E561 IonicContact NZ-OE2 3.23Å; K548-E561 PolarHBondContact NZ-OE2 3.46Å; M550-E561 HydrophobicContact CE-CG 4.19Å
562	E	92.1	Very high	84.1	Confident	104 Å²	104	76.3 Å²	76.3	49%	0.486	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	142.2	-178.2	-65.3	-178.1	-178.7	0	0	109.9	V501 K502	V501-E562 WeakPolarHBondContact O-CA 3.45Å; K502-E562 HydrophobicContact CB-CG 4.03Å; K502-E562 HydrophobicContact CD-CG 4.23Å; K502-E562 HydrophobicContact CG-CG 3.89Å; K502-E562 IonicContact NZ-OE1 3.78Å
563	Q	92.1	Very high	83.8	Confident	36 Å²	36	76.8 Å²	76.8	17%	0.168	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	139.9	175.3	-68.5	-62.1	-53.1	0	0	110.3	V501 Y503 F538 Y546	V501-Q563 PolarHBondContact N-O 3.22Å; V501-Q563 PolarHBondContact O-N 3.19Å; Y503-Q563 HydrophobicContact CE1-CG 3.9Å; F538-Q563 HydrophobicContact CD1-CB 4.26Å; F538-Q563 HydrophobicContact CE1-CB 4.17Å; Y546-Q563 HydrophobicContact CD1-CG 4.42Å; Y546-Q563 HydrophobicContact CE1-CG 4.03Å; Y546-Q563 PolarHBondContact OH-NE2 3.27Å
564	E	91.1	Very high	83.4	Confident	68 Å²	68	84.2 Å²	84.2	32%	0.318	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	128.9	177.3	-66.7	-174.3	160.3	0	0	110.5	K500 L539	K500-E564 HydrophobicContact CG-CG 4.35Å; K500-E564 IonicContact NZ-OE1 3.55Å; L539-E564 HydrophobicContact CB-CB 4.17Å; L539-E564 WeakPolarHBondContact CB-O 3.08Å; L539-E564 HydrophobicContact CD2-CB 4.17Å; L539-E564 WeakPolarHBondContact CD2-OE2 3.48Å; L539-E564 PolarHBondContact N-O 2.93Å
565	V	91.9	Very high	83.5	Confident	0 Å²	0	84.9 Å²	84.9	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	139.8	-178.4	-179	0	0	0	0	108	C498 F499 V501 L524 A536 L537 F538	C498-V565 CarbonylContact C-O 3.6Å; C498-V565 WeakPolarHBondContact CA-O 3.46Å; C498-V565 WeakPolarHBondContact CB-O 3.39Å; F499-V565 HydrophobicContact CD1-CB 4.48Å; F499-V565 HydrophobicContact CD2-CB 4.14Å; F499-V565 HydrophobicContact CE1-CB 4.09Å; F499-V565 HydrophobicContact CE1-CG1 3.69Å; F499-V565 HydrophobicContact CE2-CB 3.73Å; F499-V565 HydrophobicContact CE2-CG1 3.83Å; F499-V565 HydrophobicContact CE2-CG2 4.25Å; F499-V565 HydrophobicContact CZ-CB 3.71Å; F499-V565 HydrophobicContact CZ-CG1 3.3Å; F499-V565 PolarHBondContact N-O 2.94Å; F499-V565 PolarHBondContact O-N 3.03Å; F499-V565 VanDerWaalsContact O-O 3.12Å; V501-V565 HydrophobicContact CB-CG2 4.44Å; V501-V565 HydrophobicContact CG2-CB 4.49Å; V501-V565 HydrophobicContact CG2-CG2 3.71Å; L524-V565 HydrophobicContact CD1-CB 4.47Å; L524-V565 HydrophobicContact CD1-CG1 3.54Å; L524-V565 HydrophobicContact CD1-CG2 4.05Å; L524-V565 HydrophobicContact CD2-CG1 4.12Å; L524-V565 HydrophobicContact CD2-CG2 4.01Å; L524-V565 HydrophobicContact CG-CG1 4.48Å; A536-V565 HydrophobicContact CB-CG1 3.88Å; L537-V565 CarbonylContact O-C 3.58Å; L537-V565 WeakPolarHBondContact O-CA 3.4Å; L537-V565 WeakPolarHBondContact O-CG1 3.27Å; F538-V565 HydrophobicContact CD1-CG2 3.62Å; F538-V565 HydrophobicContact CE1-CG2 3.66Å
566	Y	91.1	Very high	83.5	Confident	22 Å²	22	82.2 Å²	82.2	9%	0.086	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	150	174.7	75.8	-81.5	0	0	0	111.8	I489 V496 S497 A536 L537 L539	I489-Y566 HydrophobicContact CD1-CD2 4.03Å; I489-Y566 HydrophobicContact CD1-CE1 4.36Å; I489-Y566 HydrophobicContact CD1-CE2 3.55Å; I489-Y566 HydrophobicContact CG1-CE2 4.44Å; V496-Y566 HydrophobicContact CB-CD2 3.98Å; V496-Y566 HydrophobicContact CB-CG 4.42Å; V496-Y566 HydrophobicContact CG1-CD2 4Å; V496-Y566 HydrophobicContact CG2-CD2 3.9Å; V496-Y566 HydrophobicContact CG2-CG 3.9Å; S497-Y566 CarbonylContact O-C 3.39Å; S497-Y566 VanDerWaalsContact O-CA 3.27Å; S497-Y566 WeakPolarHBondContact O-CA 3.41Å; A536-Y566 WeakPolarHBondContact CA-O 3.25Å; L537-Y566 HydrophobicContact CB-CD1 4.25Å; L537-Y566 HydrophobicContact CB-CE1 3.61Å; L537-Y566 WeakPolarHBondContact CD1-OH 3.4Å; L537-Y566 PolarHBondContact N-O 3.42Å; L537-Y566 WeakPolarHBondContact O-CD1 3.32Å; L537-Y566 PolarHBondContact O-N 3.19Å; L539-Y566 HydrophobicContact CB-CD1 4.41Å; L539-Y566 HydrophobicContact CD1-CD1 3.99Å; L539-Y566 HydrophobicContact CD1-CG 4.37Å
567	L	89.7	Confident	83.7	Confident	5 Å²	5	77.6 Å²	77.6	3%	0.026	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	136.7	171.6	-166.6	69.5	0	0	0	109.2	I480 P482 S497 R535 F573 I580 I617	I480-L567 HydrophobicContact CG2-CD2 4.11Å; P482-L567 HydrophobicContact CB-CD2 4.49Å; P482-L567 HydrophobicContact CG-CD2 4.3Å; S497-L567 PolarHBondContact O-N 2.93Å; R535-L567 HydrophobicContact CB-CD1 4.16Å; L567-F573 HydrophobicContact CD1-CZ 4.28Å; L567-F573 HydrophobicContact CD2-CZ 3.99Å; L567-F573 HydrophobicContact CG-CE1 4.25Å; L567-F573 HydrophobicContact CG-CZ 4.08Å; L567-I580 HydrophobicContact CD1-CD1 3.47Å; L567-I580 VanDerWaalsContact CD1-CD1 3.47Å; L567-I617 HydrophobicContact CD1-CD1 4.36Å; L567-I617 HydrophobicContact CD2-CD1 4.32Å; L567-I617 HydrophobicContact CD2-CG1 4.42Å
568	R	87.3	Confident	83.7	Confident	74 Å²	74	71.3 Å²	71.3	28%	0.279	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-60.1	165.6	172	-76.8	-177.7	172	-154.7	4.5	111.2	K534 R535 L537 E572 F573	K534-R568 VanDerWaalsContact O-CD 3.27Å; K534-R568 WeakPolarHBondContact O-CD 3.39Å; K534-R568 PolarHBondContact O-NE 3.01Å; R535-R568 WeakPolarHBondContact O-CB 3.48Å; R535-R568 PolarHBondContact O-N 3.1Å; L537-R568 HydrophobicContact CD1-CG 4.25Å; R568-E572 HydrophobicContact CB-CB 4.43Å; R568-E572 VanDerWaalsContact CD-OE2 3.31Å; R568-E572 WeakPolarHBondContact CD-OE2 3.2Å; R568-E572 IonicContact CZ-OE2 3.81Å; R568-E572 IonicContact NE-OE2 3.5Å; R568-E572 IonicContact NH1-OE2 3.57Å; R568-E572 PolarHBondContact NH1-OE2 3.48Å; R568-F573 HydrophobicContact CB-CD1 4.21Å; R568-F573 HydrophobicContact CB-CE1 4.37Å; R568-F573 WeakPolarHBondContact O-CE1 3.5Å
569	D	80.8	Confident	83.7	Confident	63 Å²	63	67.3 Å²	67.3	34%	0.337	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-66	144.4	176.2	-168.8	-93	0	0	0	110.8	K485 R571 E572 F573	K485-D569 IonicContact NZ-OD2 2.74Å; D569-R571 PolarHBondContact O-N 2.97Å; D569-R571 WeakPolarHBondContact OD1-CB 3.36Å; D569-R571 WeakPolarHBondContact OD1-CG 3.02Å; D569-R571 PolarHBondContact OD1-N 2.83Å; D569-R571 VanDerWaalsContact OD1-N 3.15Å; D569-E572 WeakPolarHBondContact O-CB 3.48Å; D569-E572 PolarHBondContact O-N 3.36Å; D569-F573 WeakPolarHBondContact O-CD1 3.31Å; D569-F573 WeakPolarHBondContact O-CE1 3.23Å
570	D	72.6	Confident	83.6	Confident	48 Å²	48	66 Å²	66	26%	0.257	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-21.6	-178.2	-95.8	9.5	0	0	0	114.1	E572 K576	D570-E572 VanDerWaalsContact C-N 3.33Å; D570-K576 VanDerWaalsContact CG-NZ 3.26Å; D570-K576 IonicContact OD1-NZ 2.74Å; D570-K576 IonicContact OD2-NZ 3.66Å; D570-K576 PolarHBondContact OD2-NZ 2.75Å
571	R	75.8	Confident	83.6	Confident	236 Å²	236	63.7 Å²	63.7	89%	0.891	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-19.9	176.9	-63.1	173.4	-177.3	-177.5	2.4	113.3	D569	D569-R571 PolarHBondContact O-N 2.97Å; D569-R571 WeakPolarHBondContact OD1-CB 3.36Å; D569-R571 WeakPolarHBondContact OD1-CG 3.02Å; D569-R571 PolarHBondContact OD1-N 2.83Å; D569-R571 VanDerWaalsContact OD1-N 3.15Å
572	E	77.9	Confident	83.6	Confident	104 Å²	104	61.1 Å²	61.1	49%	0.486	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-18	-173.4	-65.9	-173.3	-145.3	0	0	113.7	R568 D569 D570	R568-E572 HydrophobicContact CB-CB 4.43Å; R568-E572 VanDerWaalsContact CD-OE2 3.31Å; R568-E572 WeakPolarHBondContact CD-OE2 3.2Å; R568-E572 IonicContact CZ-OE2 3.81Å; R568-E572 IonicContact NE-OE2 3.5Å; R568-E572 IonicContact NH1-OE2 3.57Å; R568-E572 PolarHBondContact NH1-OE2 3.48Å; D569-E572 WeakPolarHBondContact O-CB 3.48Å; D569-E572 PolarHBondContact O-N 3.36Å; D570-E572 VanDerWaalsContact C-N 3.33Å
573	F	78.8	Confident	83.7	Confident	10 Å²	10	56.2 Å²	56.2	4%	0.044	25%	0.249	C	C	.	.			trans	-140.4	137.5	-179.5	67.2	-83	0	0	0	111.4	R535 L567 R568 D569 D575 K576 I617	R535-F573 HydrophobicContact CB-CD2 4.46Å; R535-F573 HydrophobicContact CB-CG 4.38Å; R535-F573 HydrophobicContact CG-CB 3.87Å; R535-F573 HydrophobicContact CG-CD1 4.37Å; R535-F573 HydrophobicContact CG-CD2 3.77Å; R535-F573 HydrophobicContact CG-CE2 4.45Å; R535-F573 HydrophobicContact CG-CG 3.73Å; L567-F573 HydrophobicContact CD1-CZ 4.28Å; L567-F573 HydrophobicContact CD2-CZ 3.99Å; L567-F573 HydrophobicContact CG-CE1 4.25Å; L567-F573 HydrophobicContact CG-CZ 4.08Å; R568-F573 HydrophobicContact CB-CD1 4.21Å; R568-F573 HydrophobicContact CB-CE1 4.37Å; R568-F573 WeakPolarHBondContact O-CE1 3.5Å; D569-F573 WeakPolarHBondContact O-CD1 3.31Å; D569-F573 WeakPolarHBondContact O-CE1 3.23Å; F573-D575 WeakPolarHBondContact CD2-O 3.46Å; F573-K576 HydrophobicContact CE2-CG 4.11Å; F573-I617 HydrophobicContact CE2-CD1 3.73Å; F573-I617 HydrophobicContact CZ-CD1 4.2Å
574	R	76.8	Confident	83.7	Confident	252 Å²	252	54.5 Å²	54.5	95%	0.951	24%	0.241	S	C	*	.			trans	-90.9	-22.5	179.3	-67.7	-174.8	178.6	-180	-0.6	113.5	K576	R574-K576 PolarHBondContact O-N 3.01Å
575	D	77.1	Confident	83.7	Confident	36 Å²	36	54.4 Å²	54.4	19%	0.193	24%	0.24	C	C	.	.			trans	-88.9	102	-172.7	-175.3	2	0	0	0	111.7	K528 R535 F573 I577 T578	K528-D575 WeakPolarHBondContact CE-OD2 3.34Å; K528-D575 IonicContact NZ-OD2 3.78Å; K528-D575 PolarHBondContact NZ-OD2 2.84Å; R535-D575 WeakPolarHBondContact CD-O 3.48Å; R535-D575 PolarHBondContact NH1-O 3.17Å; F573-D575 WeakPolarHBondContact CD2-O 3.46Å; D575-I577 PolarHBondContact OD1-N 3.31Å; D575-T578 VanDerWaalsContact CG-OG1 3.31Å; D575-T578 PolarHBondContact OD1-N 3.22Å; D575-T578 PolarHBondContact OD1-OG1 3.05Å; D575-T578 VanDerWaalsContact OD2-CB 3.23Å; D575-T578 WeakPolarHBondContact OD2-CB 3.5Å; D575-T578 PolarHBondContact OD2-OG1 2.84Å
576	K	74.6	Confident	83.6	Confident	65 Å²	65	55.2 Å²	55.2	28%	0.283	24%	0.243	S	C	.	.			trans	-103.7	-1.7	175.6	-56.3	-170.1	179.7	-166.8	0	113.5	D570 F573 R574 I617 L619	D570-K576 VanDerWaalsContact CG-NZ 3.26Å; D570-K576 IonicContact OD1-NZ 2.74Å; D570-K576 IonicContact OD2-NZ 3.66Å; D570-K576 PolarHBondContact OD2-NZ 2.75Å; F573-K576 HydrophobicContact CE2-CG 4.11Å; R574-K576 PolarHBondContact O-N 3.01Å; K576-I617 HydrophobicContact CB-CG2 4.44Å; K576-L619 HydrophobicContact CB-CD1 4.41Å
577	I	74.5	Confident	83.5	Confident	94 Å²	94	56.6 Å²	56.6	48%	0.482	26%	0.256	S	S	.	.	S	Bend	trans	-96.3	-41.4	-174.6	-59.4	174.4	0	0	0	110.4	D575 L619	D575-I577 PolarHBondContact OD1-N 3.31Å; I577-L619 HydrophobicContact CG1-CD2 4.01Å
578	T	80.1	Confident	83.4	Confident	48 Å²	48	56.8 Å²	56.8	29%	0.294	26%	0.257	S	S	.	.	S	Bend	trans	-66.9	133	-177.6	-54.3	0	0	0	0	110.5	R535 D575	R535-T578 VanDerWaalsContact CZ-O 3.28Å; R535-T578 PolarHBondContact NH1-O 2.84Å; R535-T578 PolarHBondContact NH2-O 2.77Å; D575-T578 VanDerWaalsContact CG-OG1 3.31Å; D575-T578 PolarHBondContact OD1-N 3.22Å; D575-T578 PolarHBondContact OD1-OG1 3.05Å; D575-T578 VanDerWaalsContact OD2-CB 3.23Å; D575-T578 WeakPolarHBondContact OD2-CB 3.5Å; D575-T578 PolarHBondContact OD2-OG1 2.84Å
579	P	83.8	Confident	83.2	Confident	15 Å²	15	56.7 Å²	56.7	10%	0.097	26%	0.262	C	S	.	.			trans	-59.3	147.4	174.9	20.2	-31.4	0	0	0	112.7	L527 R535 S581 Q614	L527-P579 HydrophobicContact CD1-CG 4.19Å; R535-P579 PolarHBondContact NH2-O 2.82Å; P579-S581 PolarHBondContact O-N 2.76Å; P579-Q614 HydrophobicContact CB-CB 4.07Å; P579-Q614 HydrophobicContact CB-CG 4.41Å; P579-Q614 VanDerWaalsContact CG-OE1 3.29Å
580	I	87.4	Confident	83.2	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	98.1	169.1	-59.9	173.1	0	0	0	107.3	I480 D525 A536 L567 A615 I617	I480-I580 HydrophobicContact CD1-CD1 3.91Å; D525-I580 HydrophobicContact CB-CG2 4.46Å; A536-I580 HydrophobicContact CB-CG2 3.94Å; L567-I580 HydrophobicContact CD1-CD1 3.47Å; L567-I580 VanDerWaalsContact CD1-CD1 3.47Å; I580-A615 PolarHBondContact N-O 2.8Å; I580-A615 PolarHBondContact O-N 2.89Å; I580-I617 HydrophobicContact CD1-CD1 4.17Å; I580-I617 HydrophobicContact CD1-CG1 4.06Å
581	S	89.7	Confident	83.5	Confident	4 Å²	4	61.9 Å²	61.9	3%	0.028	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	118.8	177.7	176.8	0	0	0	0	111.1	D525 R526 P579 K613	D525-S581 VanDerWaalsContact CA-O 3.25Å; D525-S581 WeakPolarHBondContact CA-O 3.41Å; D525-S581 PolarHBondContact N-O 2.89Å; R526-S581 PolarHBondContact N-O 2.78Å; P579-S581 PolarHBondContact O-N 2.76Å; S581-K613 CarbonylContact C-O 3.28Å; S581-K613 WeakPolarHBondContact CA-O 3.47Å
582	V	91.6	Very high	83.4	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	122.3	169.8	-176.5	0	0	0	0	108.1	L473 I475 V501 T523 L524 T612 K613	L473-V582 HydrophobicContact CD1-CG1 4.48Å; L473-V582 HydrophobicContact CD2-CB 4.3Å; L473-V582 HydrophobicContact CD2-CG1 4.04Å; L473-V582 WeakPolarHBondContact CD2-O 3.48Å; I475-V582 HydrophobicContact CD1-CB 4.02Å; I475-V582 HydrophobicContact CD1-CG2 3.71Å; V501-V582 HydrophobicContact CG1-CG1 4.01Å; V501-V582 HydrophobicContact CG2-CG1 4.48Å; V501-V582 HydrophobicContact CG2-CG2 4.42Å; T523-V582 WeakPolarHBondContact O-CA 3.48Å; L524-V582 HydrophobicContact CD2-CB 4.47Å; L524-V582 HydrophobicContact CD2-CG1 4.03Å; L524-V582 HydrophobicContact CD2-CG2 3.82Å; V582-T612 CarbonylContact O-C 3.56Å; V582-T612 WeakPolarHBondContact O-CA 3.36Å; V582-K613 PolarHBondContact N-O 2.87Å; V582-K613 PolarHBondContact O-N 2.88Å
583	A	92.1	Very high	83	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	129.8	176.8	0	0	0	0	0	110.4	T523 R526 V611 T612	T523-A583 PolarHBondContact N-O 3.04Å; T523-A583 PolarHBondContact O-N 2.79Å; T523-A583 WeakPolarHBondContact OG1-CB 3.29Å; T523-A583 PolarHBondContact OG1-O 3.49Å; R526-A583 HydrophobicContact CB-CB 4.28Å; R526-A583 VanDerWaalsContact CD-CB 3.48Å; R526-A583 HydrophobicContact CG-CB 4.48Å; A583-V611 WeakPolarHBondContact CA-O 3.29Å; A583-T612 HydrophobicContact CB-CG2 3.73Å
584	M	92.1	Very high	82.9	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	122.5	173.4	176.7	-168.5	176.1	0	0	108.6	L473 Y503 L505 V520 N610 V611	L473-M584 HydrophobicContact CD1-CB 4.4Å; L473-M584 HydrophobicContact CD2-CB 4.23Å; Y503-M584 HydrophobicContact CD2-CE 4.24Å; L505-M584 HydrophobicContact CD1-CE 4.08Å; L505-M584 HydrophobicContact CD2-CE 3.5Å; L505-M584 VanDerWaalsContact CD2-CE 3.5Å; L505-M584 HydrophobicContact CG-CE 3.67Å; V520-M584 HydrophobicContact CG1-CE 3.66Å; V520-M584 HydrophobicContact CG1-CG 3.82Å; V520-M584 HydrophobicContact CG1-SD 4.48Å; V520-M584 HydrophobicContact CG2-CE 4.21Å; M584-N610 CarbonylContact O-C 3.55Å; M584-N610 WeakPolarHBondContact O-CA 3.46Å; M584-N610 WeakPolarHBondContact O-CB 3.48Å; M584-V611 PolarHBondContact N-O 2.94Å; M584-V611 PolarHBondContact O-N 2.03Å
585	E	92.1	Very high	82.5	Confident	66 Å²	66	45.9 Å²	45.9	31%	0.308	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	140.3	170.2	-63.8	-176.4	170.6	0	0	108.2	V520 D521 R526 N610	V520-E585 CarbonylContact C-O 3.54Å; V520-E585 WeakPolarHBondContact CA-O 3.47Å; D521-E585 HydrophobicContact CB-CB 4.44Å; D521-E585 PolarHBondContact N-O 2.81Å; D521-E585 PolarHBondContact O-N 3.44Å; R526-E585 IonicContact CZ-OE1 3.34Å; R526-E585 VanDerWaalsContact CZ-OE1 3.24Å; R526-E585 IonicContact NH1-OE1 3.41Å; R526-E585 PolarHBondContact NH1-OE1 2.82Å; R526-E585 IonicContact NH2-OE1 3Å; R526-E585 PolarHBondContact NH2-OE1 3.12Å; E585-N610 HydrophobicContact CG-CB 3.85Å
586	Y	90.8	Very high	82	Confident	17 Å²	17	54 Å²	54	7%	0.067	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	143.5	177.7	63	-88.9	0	0	0	110.8	V469 A471 L505 F518 R519 I603 P608	V469-Y586 HydrophobicContact CB-CE2 3.94Å; V469-Y586 HydrophobicContact CG1-CD2 4.17Å; V469-Y586 HydrophobicContact CG1-CE2 3.59Å; V469-Y586 HydrophobicContact CG2-CE2 4.32Å; A471-Y586 HydrophobicContact CB-CD1 4.01Å; A471-Y586 HydrophobicContact CB-CE1 3.59Å; L505-Y586 HydrophobicContact CD2-CD1 4.32Å; L505-Y586 HydrophobicContact CD2-CG 4.24Å; F518-Y586 HydrophobicContact CD1-CD2 4.32Å; F518-Y586 HydrophobicContact CE1-CD2 4.47Å; R519-Y586 CarbonylContact O-C 3.47Å; R519-Y586 WeakPolarHBondContact O-CA 3.08Å; Y586-I603 HydrophobicContact CE2-CD1 4.43Å; Y586-P608 WeakPolarHBondContact CE1-O 3.44Å; Y586-P608 PolarHBondContact OH-O 3.45Å
587	S	88.3	Confident	81.7	Confident	52 Å²	52	54.2 Å²	54.2	36%	0.364	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	139.9	177.7	56.2	0	0	0	0	110.1	F518 R519	F518-S587 CarbonylContact C-O 3.56Å; F518-S587 VanDerWaalsContact CA-O 3.31Å; F518-S587 WeakPolarHBondContact CA-O 3.4Å; R519-S587 PolarHBondContact N-O 3.43Å; R519-S587 PolarHBondContact O-N 2.63Å; R519-S587 PolarHBondContact O-OG 2.88Å
588	L	86.4	Confident	81.6	Confident	8 Å²	8	51 Å²	51	4%	0.042	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	137.9	176.4	-177.9	71.3	0	0	0	109.7	I467 L516 F518 Y590 P601 I603	I467-L588 HydrophobicContact CD1-CD2 3.52Å; L516-L588 HydrophobicContact CB-CD1 4.06Å; L516-L588 HydrophobicContact CD2-CD1 4.19Å; F518-L588 HydrophobicContact CD1-CB 4.13Å; F518-L588 HydrophobicContact CD1-CD1 4.04Å; F518-L588 HydrophobicContact CD2-CD1 4.33Å; F518-L588 HydrophobicContact CE1-CB 3.94Å; F518-L588 HydrophobicContact CE1-CD1 3.74Å; F518-L588 HydrophobicContact CE1-CG 4.4Å; F518-L588 HydrophobicContact CE2-CD1 4.05Å; F518-L588 HydrophobicContact CG-CD1 4.33Å; F518-L588 HydrophobicContact CZ-CD1 3.75Å; L588-Y590 HydrophobicContact CB-CD1 4.46Å; L588-Y590 HydrophobicContact CB-CE1 4.11Å; L588-Y590 HydrophobicContact CD2-CD1 3.9Å; L588-Y590 HydrophobicContact CD2-CE1 3.88Å; L588-Y590 HydrophobicContact CG-CD1 4.36Å; L588-Y590 HydrophobicContact CG-CE1 4.4Å; L588-Y590 WeakPolarHBondContact O-CD2 3.37Å; L588-Y590 WeakPolarHBondContact O-CE2 3.36Å; L588-Y590 PolarHBondContact O-N 2.8Å; L588-Y590 VanDerWaalsContact O-N 3.15Å; L588-P601 HydrophobicContact CD2-CG 4.11Å; L588-I603 HydrophobicContact CB-CD1 3.91Å; L588-I603 HydrophobicContact CB-CG1 4.24Å
589	D	84.4	Confident	81.7	Confident	72 Å²	72	49 Å²	49	39%	0.385	26%	0.259	S	S	.	.			trans	-79.5	94.2	167.1	-166.3	-22.4	0	0	0	110	S517 Q591 L592	S517-D589 PolarHBondContact O-N 2.92Å; D589-Q591 VanDerWaalsContact C-N 3.27Å; D589-Q591 PolarHBondContact O-N 2.79Å; D589-Q591 PolarHBondContact OD1-N 2.9Å; D589-L592 HydrophobicContact CB-CD1 4.39Å
590	Y	80.7	Confident	81.7	Confident	77 Å²	77	50 Å²	50	30%	0.302	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-30.1	-175	-61.4	-71.6	0	0	0	113.6	L588 A593 A594 L600 P601 I602	L588-Y590 HydrophobicContact CB-CD1 4.46Å; L588-Y590 HydrophobicContact CB-CE1 4.11Å; L588-Y590 HydrophobicContact CD2-CD1 3.9Å; L588-Y590 HydrophobicContact CD2-CE1 3.88Å; L588-Y590 HydrophobicContact CG-CD1 4.36Å; L588-Y590 HydrophobicContact CG-CE1 4.4Å; L588-Y590 WeakPolarHBondContact O-CD2 3.37Å; L588-Y590 WeakPolarHBondContact O-CE2 3.36Å; L588-Y590 PolarHBondContact O-N 2.8Å; L588-Y590 VanDerWaalsContact O-N 3.15Å; Y590-A593 PolarHBondContact O-N 2.86Å; Y590-A594 PolarHBondContact O-N 3.42Å; Y590-L600 WeakPolarHBondContact O-CD2 3.28Å; Y590-P601 WeakPolarHBondContact CD1-O 3.39Å; Y590-P601 WeakPolarHBondContact CE1-O 3.46Å; Y590-I602 HydrophobicContact CE1-CD1 4.5Å
591	Q	78.4	Confident	81.6	Confident	143 Å²	143	50.1 Å²	50.1	67%	0.668	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-38.8	-174.3	-65.6	-64.5	-32.2	0	0	111.9	D589 A593	D589-Q591 VanDerWaalsContact C-N 3.27Å; D589-Q591 PolarHBondContact O-N 2.79Å; D589-Q591 PolarHBondContact OD1-N 2.9Å; Q591-A593 PolarHBondContact O-N 3.44Å
592	L	73.9	Confident	81.4	Confident	131 Å²	131	51 Å²	51	69%	0.686	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-20.6	176.4	-68.6	173	0	0	0	112.6	D589	D589-L592 HydrophobicContact CB-CD1 4.39Å
593	A	70.3	Confident	81.1	Confident	6 Å²	6	52.3 Å²	52.3	5%	0.05	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	6.9	-178.2	0	0	0	0	0	113.5	P513 L516 Y590 Q591 P601	P513-A593 HydrophobicContact CG-CB 4.12Å; L516-A593 HydrophobicContact CD2-CB 4.18Å; Y590-A593 PolarHBondContact O-N 2.86Å; Q591-A593 PolarHBondContact O-N 3.44Å; A593-P601 HydrophobicContact CB-CG 3.58Å; A593-P601 VanDerWaalsContact O-CD 3.23Å; A593-P601 WeakPolarHBondContact O-CD 3.26Å
594	A	75.5	Confident	80.7	Confident	38 Å²	38	53.7 Å²	53.7	31%	0.314	28%	0.282	S	S	.	.			trans	-69.4	141.1	179.8	0	0	0	0	0	112.1	Y590 L599 L600	Y590-A594 PolarHBondContact O-N 3.42Å; A594-L599 WeakPolarHBondContact CA-O 3.48Å; A594-L600 HydrophobicContact CB-CD2 3.69Å
595	D	69.4	Low	79.9	Confident	91 Å²	91	57.6 Å²	57.6	49%	0.487	30%	0.302	S	S	.	.			trans	-72.9	171.4	172.4	-176	36.3	0	0	0	112	T597 G598 L599	D595-T597 PolarHBondContact O-N 3.39Å; D595-G598 WeakPolarHBondContact O-CA 3.41Å; D595-G598 PolarHBondContact O-N 2.92Å; D595-L599 PolarHBondContact N-O 3.34Å
596	K	67.1	Low	79.1	Confident	208 Å²	208	60.8 Å²	60.8	90%	0.904	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-26.7	175.9	-65.6	178	-177.9	172.5	0	113.6
597	T	67.9	Low	78.5	Confident	68 Å²	68	60.7 Å²	60.7	42%	0.417	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-0.2	176.9	63.5	0	0	0	0	113.8	R462 D595 L599	R462-T597 PolarHBondContact NH1-OG1 2.93Å; D595-T597 PolarHBondContact O-N 3.39Å; T597-L599 VanDerWaalsContact C-N 3.34Å
598	G	72.9	Confident	78.1	Confident	28 Å²	28	61.8 Å²	61.8	29%	0.289	32%	0.32	S	S	.	.			trans	77.1	15.3	-177.4	0	0	0	0	0	114.5	D595	D595-G598 WeakPolarHBondContact O-CA 3.41Å; D595-G598 PolarHBondContact O-N 2.92Å
599	L	80.4	Confident	77.8	Confident	5 Å²	5	66.6 Å²	66.6	3%	0.026	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-75.3	123.2	175	-170.9	69.2	0	0	0	109.5	D27 R464 A594 D595 T597	D27-L599 HydrophobicContact CB-CD1 3.93Å; R464-L599 HydrophobicContact CG-CD1 3.86Å; R464-L599 HydrophobicContact CG-CG 4.34Å; A594-L599 WeakPolarHBondContact CA-O 3.48Å; D595-L599 PolarHBondContact N-O 3.34Å; T597-L599 VanDerWaalsContact C-N 3.34Å
600	L	84.8	Confident	77.9	Confident	36 Å²	36	65.9 Å²	65.9	19%	0.188	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-90.5	134.7	-177	-57.7	173.3	0	0	0	110	R464 Y590 A594	R464-L600 WeakPolarHBondContact CB-O 3.5Å; R464-L600 WeakPolarHBondContact CG-O 3.37Å; R464-L600 PolarHBondContact NE-O 2.96Å; Y590-L600 WeakPolarHBondContact O-CD2 3.28Å; A594-L600 HydrophobicContact CB-CD2 3.69Å
601	P	84.8	Confident	78.3	Confident	3 Å²	3	63.6 Å²	63.6	2%	0.019	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-69.6	168.1	172.4	29.6	-34	0	0	0	111.1	R464 P465 I467 L588 Y590 A593	R464-P601 PolarHBondContact NH2-O 3.46Å; P465-P601 HydrophobicContact CB-CB 4.34Å; P465-P601 CarbonylContact O-C 3.53Å; P465-P601 WeakPolarHBondContact O-CA 3.05Å; P465-P601 WeakPolarHBondContact O-CB 3.12Å; I467-P601 HydrophobicContact CD1-CB 3.6Å; I467-P601 HydrophobicContact CD1-CG 3.93Å; I467-P601 HydrophobicContact CG1-CB 4.16Å; L588-P601 HydrophobicContact CD2-CG 4.11Å; Y590-P601 WeakPolarHBondContact CD1-O 3.39Å; Y590-P601 WeakPolarHBondContact CE1-O 3.46Å; A593-P601 HydrophobicContact CB-CG 3.58Å; A593-P601 VanDerWaalsContact O-CD 3.23Å; A593-P601 WeakPolarHBondContact O-CD 3.26Å
602	I	86.1	Confident	78.8	Confident	22 Å²	22	60.1 Å²	60.1	11%	0.113	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	146.4	178.5	-166.7	61.9	0	0	0	110.1	F24 N25 R464 P465 V466 I467 Y590	F24-I602 WeakPolarHBondContact O-CG1 3.3Å; F24-I602 VanDerWaalsContact O-CG2 3.23Å; F24-I602 WeakPolarHBondContact O-CG2 3.11Å; N25-I602 HydrophobicContact CB-CG2 4.42Å; R464-I602 HydrophobicContact CB-CG2 4.31Å; P465-I602 PolarHBondContact O-N 2.87Å; V466-I602 WeakPolarHBondContact CA-O 3.01Å; V466-I602 HydrophobicContact CG2-CG2 4.04Å; I467-I602 PolarHBondContact N-O 3.41Å; Y590-I602 HydrophobicContact CE1-CD1 4.5Å
603	I	85.5	Confident	79.5	Confident	28 Å²	28	58.1 Å²	58.1	14%	0.144	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	138.4	173.6	-60.4	174.1	0	0	0	107.3	V469 F518 Y586 L588 I605 A607	V469-I603 HydrophobicContact CG2-CG2 4.21Å; F518-I603 HydrophobicContact CE1-CD1 4.44Å; Y586-I603 HydrophobicContact CE2-CD1 4.43Å; L588-I603 HydrophobicContact CB-CD1 3.91Å; L588-I603 HydrophobicContact CB-CG1 4.24Å; I603-I605 PolarHBondContact O-N 3.04Å; I603-A607 HydrophobicContact CG2-CB 4.06Å
604	N	82.9	Confident	80.3	Confident	29 Å²	29	60.7 Å²	60.7	16%	0.155	33%	0.325	C	S	.	.			trans	-52	133.2	175.6	-173.5	-28.3	0	0	0	111.1	V466 I467 W606 A607	V466-N604 HydrophobicContact CG1-CB 3.83Å; I467-N604 PolarHBondContact O-N 3.17Å; N604-W606 PolarHBondContact O-N 3.48Å; N604-W606 PolarHBondContact OD1-N 2.8Å; N604-A607 HydrophobicContact CB-CB 4.44Å; N604-A607 WeakPolarHBondContact O-CB 3.16Å; N604-A607 PolarHBondContact O-N 2.87Å; N604-A607 VanDerWaalsContact O-N 3.08Å
605	I	76.5	Confident	80.8	Confident	82 Å²	82	58.9 Å²	58.9	42%	0.421	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-28.6	-178.7	-160.1	167.7	0	0	0	113.7	F24 I603 A607	F24-I605 HydrophobicContact CD2-CB 3.71Å; F24-I605 HydrophobicContact CD2-CD1 4.36Å; F24-I605 HydrophobicContact CD2-CG2 3.67Å; F24-I605 HydrophobicContact CE2-CB 3.73Å; F24-I605 HydrophobicContact CE2-CG2 3.34Å; F24-I605 HydrophobicContact CZ-CG2 4.33Å; I603-I605 PolarHBondContact O-N 3.04Å; I605-A607 VanDerWaalsContact C-N 3.3Å
606	W	74.9	Confident	81.5	Confident	132 Å²	132	55 Å²	55	50%	0.5	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-9.7	178	-57.4	-67.3	0	0	0	112.5	F24 D377 D379 N403 N604	F24-W606 HydrophobicContact CZ-CH2 4.06Å; F24-W606 HydrophobicContact CZ-CZ3 4.03Å; D377-W606 WeakPolarHBondContact OD2-CH2 3.39Å; D377-W606 WeakPolarHBondContact OD2-CZ3 3.33Å; D379-W606 HydrophobicContact CB-CZ3 4.44Å; N403-W606 HydrophobicContact CB-CH2 4.3Å; N403-W606 HydrophobicContact CB-CZ2 4.39Å; N604-W606 PolarHBondContact O-N 3.48Å; N604-W606 PolarHBondContact OD1-N 2.8Å
607	A	78.3	Confident	82.2	Confident	15 Å²	15	45.3 Å²	45.3	12%	0.124	25%	0.247	C	C	.	.	S	Bend	trans	-72.6	128.1	173.5	0	0	0	0	0	110.2	I603 N604 I605 T609	I603-A607 HydrophobicContact CG2-CB 4.06Å; N604-A607 HydrophobicContact CB-CB 4.44Å; N604-A607 WeakPolarHBondContact O-CB 3.16Å; N604-A607 PolarHBondContact O-N 2.87Å; N604-A607 VanDerWaalsContact O-N 3.08Å; I605-A607 VanDerWaalsContact C-N 3.3Å; A607-T609 PolarHBondContact O-N 2.77Å
608	P	79.5	Confident	82.8	Confident	76 Å²	76	43.6 Å²	43.6	49%	0.494	24%	0.236	S	C	.	.			trans	-67.9	122.7	-178.2	27.6	-33.8	0	0	0	109.9	Y586 N610	Y586-P608 WeakPolarHBondContact CE1-O 3.44Å; Y586-P608 PolarHBondContact OH-O 3.45Å; P608-N610 PolarHBondContact O-N 3.22Å
609	T	79.1	Confident	82.9	Confident	108 Å²	108	44.8 Å²	44.8	66%	0.663	24%	0.235	S	C	*	.	S	Bend	trans	-64.5	-19.4	179.5	52.6	0	0	0	0	113.5	A607	A607-T609 PolarHBondContact O-N 2.77Å
610	N	86.9	Confident	82.3	Confident	58 Å²	58	51.2 Å²	51.2	31%	0.31	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	151.1	175.2	65.5	12.8	0	0	0	111.9	M584 E585 P608	M584-N610 CarbonylContact O-C 3.55Å; M584-N610 WeakPolarHBondContact O-CA 3.46Å; M584-N610 WeakPolarHBondContact O-CB 3.48Å; E585-N610 HydrophobicContact CG-CB 3.85Å; P608-N610 PolarHBondContact O-N 3.22Å
611	V	88.6	Confident	81.7	Confident	28 Å²	28	49.8 Å²	49.8	17%	0.17	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	127.4	174.6	-177.7	0	0	0	0	107.8	A471 L473 A583 M584	A471-V611 HydrophobicContact CB-CG2 3.76Å; L473-V611 HydrophobicContact CB-CB 4.49Å; L473-V611 HydrophobicContact CB-CG1 3.89Å; A583-V611 WeakPolarHBondContact CA-O 3.29Å; M584-V611 PolarHBondContact N-O 2.94Å; M584-V611 PolarHBondContact O-N 2.03Å
612	T	89.6	Confident	81.3	Confident	71 Å²	71	52 Å²	52	44%	0.436	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	134.4	-179.8	61.6	0	0	0	0	111	V582 A583	V582-T612 CarbonylContact O-C 3.56Å; V582-T612 WeakPolarHBondContact O-CA 3.36Å; A583-T612 HydrophobicContact CB-CG2 3.73Å
613	K	88.9	Confident	80.9	Confident	89 Å²	89	60.3 Å²	60.3	39%	0.387	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	155.2	166.3	-90.8	-62.4	-169.7	179.3	0	110.7	L473 I475 S581 V582	L473-K613 HydrophobicContact CB-CG 4.49Å; L473-K613 HydrophobicContact CD2-CB 3.97Å; L473-K613 HydrophobicContact CG-CB 4.21Å; L473-K613 HydrophobicContact CG-CG 4.47Å; L473-K613 WeakPolarHBondContact O-CG 3.28Å; I475-K613 HydrophobicContact CD1-CB 3.73Å; I475-K613 HydrophobicContact CG1-CB 4.12Å; S581-K613 CarbonylContact C-O 3.28Å; S581-K613 WeakPolarHBondContact CA-O 3.47Å; V582-K613 PolarHBondContact N-O 2.87Å; V582-K613 PolarHBondContact O-N 2.88Å
614	Q	87.4	Confident	80.5	Confident	59 Å²	59	62.7 Å²	62.7	28%	0.276	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	140.6	-176.5	-59.9	-173.7	16.8	0	0	109.1	P579	P579-Q614 HydrophobicContact CB-CB 4.07Å; P579-Q614 HydrophobicContact CB-CG 4.41Å; P579-Q614 VanDerWaalsContact CG-OE1 3.29Å
615	A	85.9	Confident	80.1	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	146.2	169.5	0	0	0	0	0	109.1	I475 Q478 I480 I580	I475-A615 HydrophobicContact CD1-CB 4.21Å; I475-A615 HydrophobicContact CG2-CB 4.19Å; Q478-A615 CarbonylContact O-C 3.57Å; Q478-A615 VanDerWaalsContact O-CA 3.25Å; Q478-A615 WeakPolarHBondContact O-CA 3.33Å; Q478-A615 WeakPolarHBondContact O-CB 3.23Å; I480-A615 HydrophobicContact CD1-CB 3.78Å; I480-A615 HydrophobicContact CG1-CB 4.43Å; I580-A615 PolarHBondContact N-O 2.8Å; I580-A615 PolarHBondContact O-N 2.89Å
616	H	82.6	Confident	80.1	Confident	9 Å²	9	64.3 Å²	64.3	4%	0.042	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	145.9	-174.4	-59.3	-64.9	0	0	0	110.6	Q478 I479 I480 Y664 E665 N709	Q478-H616 PolarHBondContact O-N 2.83Å; I479-H616 CarbonylContact C-O 3.5Å; I479-H616 WeakPolarHBondContact CA-O 3.46Å; I480-H616 PolarHBondContact N-O 2.88Å; H616-Y664 HydrophobicContact CB-CD1 4.05Å; H616-Y664 HydrophobicContact CB-CE1 4.22Å; H616-Y664 AromaticContact CG-CD1 4Å; H616-E665 IonicContact CE1-OE1 3.6Å; H616-E665 PolarHBondContact CE1-OE1 2.96Å; H616-E665 IonicContact NE2-OE1 3.05Å; H616-E665 PolarHBondContact NE2-OE1 2.86Å; H616-N709 PolarHBondContact CE1-ND2 3.5Å
617	I	82.2	Confident	80.4	Confident	5 Å²	5	58.5 Å²	58.5	3%	0.026	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	131.2	171	-62	171.5	0	0	0	107	P482 L567 F573 K576 I580 L619	P482-I617 HydrophobicContact CG-CG2 3.67Å; L567-I617 HydrophobicContact CD1-CD1 4.36Å; L567-I617 HydrophobicContact CD2-CD1 4.32Å; L567-I617 HydrophobicContact CD2-CG1 4.42Å; F573-I617 HydrophobicContact CE2-CD1 3.73Å; F573-I617 HydrophobicContact CZ-CD1 4.2Å; K576-I617 HydrophobicContact CB-CG2 4.44Å; I580-I617 HydrophobicContact CD1-CD1 4.17Å; I580-I617 HydrophobicContact CD1-CG1 4.06Å; I617-L619 PolarHBondContact O-N 2.88Å
618	L	80.8	Confident	80.7	Confident	32 Å²	32	61.6 Å²	61.6	17%	0.168	34%	0.336	C	S	.	.			trans	-60.8	121.7	179	-170.2	144	0	0	0	110.6	I479 I480 N625	I479-L618 HydrophobicContact CG2-CB 3.86Å; I479-L618 HydrophobicContact CG2-CD1 4.02Å; I479-L618 HydrophobicContact CG2-CG 4.3Å; I480-L618 PolarHBondContact O-N 3.01Å; L618-N625 HydrophobicContact CD1-CB 3.98Å; L618-N625 WeakPolarHBondContact CD1-O 3.43Å
619	L	74.9	Confident	81.1	Confident	53 Å²	53	58 Å²	58	28%	0.277	31%	0.313	S	S	.	.			trans	-142.4	131.9	-179.1	-164.3	75.3	0	0	0	110.5	K576 I577 I617 C621 Y664	K576-L619 HydrophobicContact CB-CD1 4.41Å; I577-L619 HydrophobicContact CG1-CD2 4.01Å; I617-L619 PolarHBondContact O-N 2.88Å; L619-C621 PolarHBondContact O-N 2.76Å; L619-Y664 PolarHBondContact N-OH 2.84Å; L619-Y664 PolarHBondContact O-OH 3.14Å; L619-Y664 VanDerWaalsContact O-OH 3.05Å
620	D	68.9	Low	81.7	Confident	141 Å²	141	56.1 Å²	56.1	75%	0.754	30%	0.298	S	S	*	.	S	Bend	trans	55.1	39.4	171.6	-57.4	-25.5	0	0	0	116.3
621	C	72.4	Confident	81.9	Confident	5 Å²	5	53.7 Å²	53.7	3%	0.034	29%	0.285	C	S	.	.			trans	-102.2	30.8	-179.8	-58.4	0	0	0	0	115.1	L619 N625 I626 C627	L619-C621 PolarHBondContact O-N 2.76Å; C621-N625 PolarHBondContact O-N 3.49Å; C621-I626 PolarHBondContact O-N 2.64Å; C621-C627 WeakPolarHBondContact CA-SG 3.36Å; C621-C627 HydrophobicContact CB-CB 3.96Å; C621-C627 WeakPolarHBondContact CB-SG 3.39Å; C621-C627 WeakPolarHBondContact SG-CB 3.28Å; C621-C627 CovalentContact SG-SG 2.03Å; C621-C627 PolarHBondContact SG-SG 3.29Å
622	G	75.7	Confident	82	Confident	49 Å²	49	56.3 Å²	56.3	51%	0.505	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.6	-167.9	179.1	0	0	0	0	0	115.1
623	E	76.7	Confident	82.2	Confident	198 Å²	198	53.9 Å²	53.9	93%	0.925	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-20.3	177.8	-66.9	-164.3	170.3	0	0	113.2	N625	E623-N625 VanDerWaalsContact C-N 3.3Å
624	D	78.1	Confident	82.4	Confident	78 Å²	78	52.5 Å²	52.5	42%	0.417	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-2.5	178.6	65.4	-18.1	0	0	0	113	I626 K628	D624-I626 WeakPolarHBondContact O-CG1 3.48Å; D624-I626 PolarHBondContact O-N 3.42Å; D624-I626 VanDerWaalsContact O-N 3.15Å; D624-K628 IonicContact OD2-NZ 3.6Å; D624-K628 PolarHBondContact OD2-NZ 2.96Å
625	N	74.4	Confident	82.6	Confident	82 Å²	82	50.7 Å²	50.7	44%	0.439	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	23.6	-179.5	-65.6	-42.4	0	0	0	113.4	L618 C621 E623	L618-N625 HydrophobicContact CD1-CB 3.98Å; L618-N625 WeakPolarHBondContact CD1-O 3.43Å; C621-N625 PolarHBondContact O-N 3.49Å; E623-N625 VanDerWaalsContact C-N 3.3Å
626	I	77.3	Confident	82.8	Confident	63 Å²	63	56.7 Å²	56.7	32%	0.323	30%	0.301	S	S	.	.			trans	-127.1	103.8	-177.2	-64.1	167.8	0	0	0	109.5	C621 D624 K628 E661 F747	C621-I626 PolarHBondContact O-N 2.64Å; D624-I626 WeakPolarHBondContact O-CG1 3.48Å; D624-I626 PolarHBondContact O-N 3.42Å; D624-I626 VanDerWaalsContact O-N 3.15Å; I626-K628 HydrophobicContact CG2-CG 4.47Å; I626-K628 PolarHBondContact O-N 3.39Å; I626-E661 VanDerWaalsContact O-OE2 3.13Å; I626-F747 HydrophobicContact CG2-CD2 3.49Å; I626-F747 VanDerWaalsContact CG2-CD2 3.49Å; I626-F747 HydrophobicContact CG2-CE2 3.74Å
627	C	79.8	Confident	83.1	Confident	9 Å²	9	57.8 Å²	57.8	6%	0.061	31%	0.31	C	S	.	.			trans	-68.9	115.6	179.7	-87.7	0	0	0	0	112.8	C621 E661 Y664 N745	C621-C627 WeakPolarHBondContact CA-SG 3.36Å; C621-C627 HydrophobicContact CB-CB 3.96Å; C621-C627 WeakPolarHBondContact CB-SG 3.39Å; C621-C627 WeakPolarHBondContact SG-CB 3.28Å; C621-C627 CovalentContact SG-SG 2.03Å; C621-C627 PolarHBondContact SG-SG 3.29Å; C627-E661 WeakPolarHBondContact CA-OE2 3.48Å; C627-E661 HydrophobicContact CB-CB 4.47Å; C627-Y664 HydrophobicContact CB-CE2 3.99Å; C627-N745 WeakPolarHBondContact CB-ND2 3.46Å; C627-N745 PolarHBondContact O-ND2 3.21Å
628	K	85.5	Confident	83.3	Confident	81 Å²	81	63.5 Å²	63.5	35%	0.352	34%	0.34	S	S	.	.			trans	-111.6	103	175.6	-66.6	167.8	-170.2	132.4	0	111.4	D624 I626 E661 F747	D624-K628 IonicContact OD2-NZ 3.6Å; D624-K628 PolarHBondContact OD2-NZ 2.96Å; I626-K628 HydrophobicContact CG2-CG 4.47Å; I626-K628 PolarHBondContact O-N 3.39Å; K628-E661 PolarHBondContact N-OE2 3.16Å; K628-E661 PolarHBondContact O-N 2.96Å; K628-F747 HydrophobicContact CG-CB 4.14Å
629	P	88.1	Confident	83.5	Confident	1 Å²	1	67.3 Å²	67.3	1%	0.006	35%	0.353	C	S	.	.			trans	-83.1	153	178.7	33.2	-31.4	0	0	0	112.4	L631 A663 N745 F747 Q748	P629-L631 HydrophobicContact CB-CD2 4.34Å; P629-L631 HydrophobicContact CB-CG 4.2Å; P629-A663 HydrophobicContact CB-CB 3.7Å; P629-A663 HydrophobicContact CG-CB 4.1Å; P629-N745 HydrophobicContact CG-CB 4.27Å; P629-F747 WeakPolarHBondContact CD-O 3.43Å; P629-Q748 WeakPolarHBondContact O-CB 3.39Å; P629-Q748 PolarHBondContact O-OE1 3.22Å
630	D	90.3	Very high	83.8	Confident	67 Å²	67	73.2 Å²	73.2	36%	0.358	38%	0.376	S	S	.	.			trans	-120.4	89.5	172.2	178.1	25.6	0	0	0	108.6	K632 N658 R659	D630-K632 WeakPolarHBondContact OD2-CE 3.49Å; D630-K632 IonicContact OD2-NZ 2.67Å; D630-N658 PolarHBondContact N-OD1 3.45Å; D630-N658 WeakPolarHBondContact O-CA 3.5Å; D630-N658 PolarHBondContact O-OD1 3.47Å; D630-R659 HydrophobicContact CB-CB 4.22Å; D630-R659 PolarHBondContact O-N 2.88Å
631	L	91.6	Very high	84.5	Confident	7 Å²	7	71.5 Å²	71.5	4%	0.037	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	119.3	-172.4	-59	171.3	0	0	0	111	P629 E657 N658 A663 M711 I741 S751	P629-L631 HydrophobicContact CB-CD2 4.34Å; P629-L631 HydrophobicContact CB-CG 4.2Å; L631-E657 CarbonylContact C-O 3.59Å; L631-E657 WeakPolarHBondContact CA-O 3.39Å; L631-N658 HydrophobicContact CD2-CB 3.97Å; L631-A663 HydrophobicContact CD2-CB 4.07Å; L631-M711 HydrophobicContact CD2-SD 4.24Å; L631-I741 HydrophobicContact CB-CB 4.47Å; L631-I741 HydrophobicContact CB-CG2 4.49Å; L631-I741 HydrophobicContact CD1-CB 4.4Å; L631-I741 HydrophobicContact CD1-CG2 3.84Å; L631-I741 HydrophobicContact CD2-CG2 4.34Å; L631-I741 HydrophobicContact CG-CG2 4.45Å; L631-S751 VanDerWaalsContact O-CB 3.28Å; L631-S751 WeakPolarHBondContact O-CB 3.34Å
632	K	91.8	Very high	85.1	Confident	83 Å²	83	71.2 Å²	71.2	36%	0.361	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	143.7	176.5	-64.1	-173.3	-176.6	-178.1	0	111.1	D630 E657	D630-K632 WeakPolarHBondContact OD2-CE 3.49Å; D630-K632 IonicContact OD2-NZ 2.67Å; K632-E657 HydrophobicContact CB-CB 4.36Å; K632-E657 PolarHBondContact N-O 3.05Å; K632-E657 PolarHBondContact O-N 3.27Å
633	L	93.7	Very high	85.4	Confident	21 Å²	21	73 Å²	73	11%	0.11	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	134.9	-175.8	-176.9	67.7	0	0	0	109.8	V635 V654 T655 L668 L739 I741 V754	L633-V635 HydrophobicContact CG-CG2 4.27Å; L633-V654 HydrophobicContact CD1-CG1 3.46Å; L633-V654 VanDerWaalsContact CD1-CG1 3.46Å; L633-T655 WeakPolarHBondContact CA-O 3.1Å; L633-L668 HydrophobicContact CD1-CD1 3.77Å; L633-L668 HydrophobicContact CD2-CD1 4.14Å; L633-L739 HydrophobicContact CD2-CB 3.67Å; L633-I741 HydrophobicContact CB-CD1 4.11Å; L633-I741 HydrophobicContact CB-CG1 4.35Å; L633-I741 HydrophobicContact CD1-CD1 4.11Å; L633-I741 HydrophobicContact CD1-CG1 4.13Å; L633-I741 HydrophobicContact CD2-CG1 4.43Å; L633-V754 HydrophobicContact CB-CG2 4.27Å; L633-V754 HydrophobicContact CD2-CB 4.32Å; L633-V754 HydrophobicContact CD2-CG2 4.28Å; L633-V754 HydrophobicContact CG-CG2 4.35Å
634	S	91.9	Very high	85.4	Confident	60 Å²	60	63.8 Å²	63.8	42%	0.42	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	144.3	168.4	63.8	0	0	0	0	110.6	T655	S634-T655 PolarHBondContact N-O 3.13Å; S634-T655 PolarHBondContact O-N 3.08Å; S634-T655 VanDerWaalsContact OG-CB 3.28Å; S634-T655 WeakPolarHBondContact OG-CB 3.38Å; S634-T655 PolarHBondContact OG-OG1 2.79Å
635	V	91.9	Very high	85.1	Confident	21 Å²	21	61.9 Å²	61.9	13%	0.127	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	130.3	-173.6	-173.9	0	0	0	0	110	L633 L652 M653 V654 L739 V754	L633-V635 HydrophobicContact CG-CG2 4.27Å; V635-L652 HydrophobicContact CG1-CB 4.33Å; V635-M653 CarbonylContact C-O 3.56Å; V635-M653 WeakPolarHBondContact CA-O 3.48Å; V635-V654 HydrophobicContact CG1-CG2 4.36Å; V635-V654 HydrophobicContact CG2-CG1 4.45Å; V635-V654 HydrophobicContact CG2-CG2 4.4Å; V635-L739 HydrophobicContact CG1-CD1 4.11Å; V635-L739 HydrophobicContact CG1-CD2 4.28Å; V635-L739 HydrophobicContact CG2-CB 4.22Å; V635-L739 HydrophobicContact CG2-CD1 4.05Å; V635-L739 HydrophobicContact CG2-CD2 3.75Å; V635-L739 HydrophobicContact CG2-CG 4.21Å; V635-V754 HydrophobicContact CB-CG1 4.34Å; V635-V754 HydrophobicContact CG2-CB 4.49Å; V635-V754 HydrophobicContact CG2-CG1 4.13Å
636	E	90.3	Very high	85	Confident	125 Å²	125	60.5 Å²	60.5	58%	0.584	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.5	135.3	175.2	-66.8	-174	172.2	0	0	110.2	M653	E636-M653 HydrophobicContact CB-CE 4.03Å; E636-M653 HydrophobicContact CG-CE 4.46Å; E636-M653 PolarHBondContact N-O 2.91Å; E636-M653 PolarHBondContact O-N 3.14Å; E636-M653 VanDerWaalsContact OE2-CE 3.26Å; E636-M653 WeakPolarHBondContact OE2-CE 3.31Å
637	S	88.9	Confident	85	Confident	32 Å²	32	62 Å²	62	22%	0.224	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	133.4	174.4	60.5	0	0	0	0	110.2	R639	S637-R639 PolarHBondContact O-N 2.86Å; S637-R639 PolarHBondContact OG-O 3.19Å; S637-R639 VanDerWaalsContact OG-O 3.11Å
638	D	86.8	Confident	85.1	Confident	125 Å²	125	62.1 Å²	62.1	67%	0.668	31%	0.309	S	S	*	.	S	Bend	trans	-59.9	-36.5	176	178.1	45.2	0	0	0	112.1	T651	D638-T651 PolarHBondContact N-O 3.24Å
639	R	83.8	Confident	85.1	Confident	112 Å²	112	61.4 Å²	61.4	42%	0.423	32%	0.319	S	S	.	.			trans	-108.8	132.4	177.8	-64.1	-174.3	176.8	-173.3	0.7	111.6	S637 L650 T758	S637-R639 PolarHBondContact O-N 2.86Å; S637-R639 PolarHBondContact OG-O 3.19Å; S637-R639 VanDerWaalsContact OG-O 3.11Å; R639-L650 HydrophobicContact CB-CD1 4.22Å; R639-T758 WeakPolarHBondContact O-CG2 3.03Å
640	K	82.6	Confident	85.2	Confident	177 Å²	177	61.4 Å²	61.4	77%	0.77	32%	0.319	S	S	*	.	S	Bend	trans	-80	-24.9	172.8	-64.3	-174.5	179	-177.8	0	113.3	Q759	K640-Q759 PolarHBondContact O-N 3.5Å
641	K	84.1	Confident	85.2	Confident	105 Å²	105	59.9 Å²	59.9	46%	0.457	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	144.6	-174.5	-66.8	179.5	162	-158	0	111.6	Q759 D761	K641-Q759 VanDerWaalsContact CA-O 3.28Å; K641-Q759 WeakPolarHBondContact CA-O 3.46Å; K641-D761 HydrophobicContact CB-CB 4.33Å; K641-D761 HydrophobicContact CD-CB 4.26Å; K641-D761 VanDerWaalsContact CD-OD2 3.31Å; K641-D761 WeakPolarHBondContact CD-OD2 3.15Å; K641-D761 WeakPolarHBondContact CE-OD2 3.44Å; K641-D761 IonicContact NZ-OD2 3.64Å; K641-D761 PolarHBondContact NZ-OD2 3.12Å
642	I	83.9	Confident	85.2	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	139.1	179.2	-74.5	172.3	0	0	0	109.1	N648 L650 L728 I735 T758 Q759 L760 D761	I642-N648 HydrophobicContact CG2-CB 3.69Å; I642-N648 WeakPolarHBondContact CG2-ND2 3.1Å; I642-L650 HydrophobicContact CD1-CB 4.4Å; I642-L650 HydrophobicContact CD1-CD1 4.14Å; I642-L650 HydrophobicContact CD1-CD2 4.07Å; I642-L650 HydrophobicContact CD1-CG 4.43Å; I642-L728 HydrophobicContact CG2-CD1 4.05Å; I642-I735 HydrophobicContact CD1-CD1 4.03Å; I642-T758 HydrophobicContact CB-CG2 4.48Å; I642-T758 HydrophobicContact CD1-CG2 3.58Å; I642-T758 HydrophobicContact CG1-CG2 3.72Å; I642-Q759 PolarHBondContact N-O 3.25Å; I642-L760 HydrophobicContact CB-CD2 3.96Å; I642-L760 HydrophobicContact CG2-CD2 3.81Å; I642-L760 CarbonylContact O-C 3.51Å; I642-L760 WeakPolarHBondContact O-CA 3.26Å; I642-D761 PolarHBondContact O-N 2.74Å
643	Y	82.6	Confident	85.2	Confident	86 Å²	86	59 Å²	59	34%	0.337	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	128.2	-175.8	-62	-69.2	0	0	0	112.6	G645 N648 D761 L763	Y643-G645 PolarHBondContact O-N 3.28Å; Y643-N648 PolarHBondContact O-ND2 3.21Å; Y643-D761 VanDerWaalsContact CA-O 3.31Å; Y643-D761 WeakPolarHBondContact CA-O 3.25Å; Y643-D761 HydrophobicContact CD1-CB 4.14Å; Y643-D761 HydrophobicContact CE1-CB 4.11Å; Y643-L763 HydrophobicContact CD1-CB 3.53Å; Y643-L763 HydrophobicContact CD1-CD2 4.42Å; Y643-L763 HydrophobicContact CD2-CD2 4.47Å; Y643-L763 HydrophobicContact CE1-CB 3.86Å; Y643-L763 HydrophobicContact CE1-CD2 4.35Å; Y643-L763 HydrophobicContact CE2-CD2 4.4Å; Y643-L763 HydrophobicContact CG-CB 4.06Å; Y643-L763 HydrophobicContact CG-CD2 4.47Å
644	I	77.3	Confident	85.1	Confident	4 Å²	4	58.1 Å²	58.1	2%	0.021	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	133.7	179.2	-56.9	173.2	0	0	0	110.4	L728 L760 D761 P811 S812 Y963 L966	I644-L728 HydrophobicContact CG2-CB 4.34Å; I644-L760 HydrophobicContact CD1-CB 4.16Å; I644-L760 HydrophobicContact CD1-CD1 4.33Å; I644-L760 HydrophobicContact CG1-CB 4.13Å; I644-L760 HydrophobicContact CG1-CD1 4.32Å; I644-L760 HydrophobicContact CG1-CD2 4.49Å; I644-D761 PolarHBondContact N-O 2.88Å; I644-D761 VanDerWaalsContact N-O 3.12Å; I644-P811 CarbonylContact O-C 3.6Å; I644-S812 VanDerWaalsContact O-CA 3.26Å; I644-S812 WeakPolarHBondContact O-CA 3.38Å; I644-S812 WeakPolarHBondContact O-CB 3.24Å; I644-S812 PolarHBondContact O-N 2.94Å; I644-S812 PolarHBondContact O-OG 2.85Å; I644-Y963 HydrophobicContact CB-CE1 4.29Å; I644-Y963 HydrophobicContact CD1-CD1 4Å; I644-Y963 HydrophobicContact CD1-CE1 4.21Å; I644-Y963 HydrophobicContact CG2-CD1 4.39Å; I644-Y963 HydrophobicContact CG2-CE1 3.56Å; I644-L966 HydrophobicContact CD1-CD1 3.74Å
645	G	70.6	Confident	85.1	Confident	38 Å²	38	57 Å²	57	39%	0.392	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.6	1.9	173.9	0	0	0	0	0	116.3	Y643 P811	Y643-G645 PolarHBondContact O-N 3.28Å; G645-P811 CarbonylContact C-O 3.17Å; G645-P811 VanDerWaalsContact CA-O 3.27Å; G645-P811 WeakPolarHBondContact CA-O 3.41Å
646	D	72	Confident	85.1	Confident	54 Å²	54	56.1 Å²	56.1	29%	0.289	29%	0.29	S	S	.	.	S	Bend	trans	-116.6	163.1	164.4	-143.6	-15.7	0	0	0	111.5	N648 P811 R921	D646-N648 PolarHBondContact O-N 3.42Å; D646-N648 PolarHBondContact O-ND2 2.87Å; D646-P811 HydrophobicContact CB-CB 3.7Å; D646-R921 IonicContact OD1-CZ 3.5Å; D646-R921 VanDerWaalsContact OD1-CZ 3.22Å; D646-R921 IonicContact OD1-NH1 2.7Å; D646-R921 PolarHBondContact OD1-NH1 3.37Å; D646-R921 IonicContact OD1-NH2 3.37Å; D646-R921 PolarHBondContact OD1-NH2 2.98Å; D646-R921 VanDerWaalsContact OD1-NH2 3.08Å; D646-R921 IonicContact OD2-CZ 3.24Å; D646-R921 IonicContact OD2-NH1 3.71Å; D646-R921 IonicContact OD2-NH2 2.97Å; D646-R921 PolarHBondContact OD2-NH2 3.41Å
647	D	77.2	Confident	85.2	Confident	95 Å²	95	52.4 Å²	52.4	51%	0.508	27%	0.273	S	S	.	.			trans	-76.6	108.5	165.6	-66.6	-16.7	0	0	0	108	H726	D647-H726 IonicContact OD1-CE1 2.88Å; D647-H726 IonicContact OD1-CG 3.79Å; D647-H726 IonicContact OD1-ND1 3.88Å; D647-H726 PolarHBondContact OD1-ND1 3.15Å; D647-H726 IonicContact OD2-CE1 3.31Å; D647-H726 PolarHBondContact OD2-CE1 2.97Å; D647-H726 IonicContact OD2-ND1 2.68Å; D647-H726 PolarHBondContact OD2-ND1 3.07Å
648	N	81.8	Confident	85.3	Confident	10 Å²	10	50.9 Å²	50.9	5%	0.053	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	116.9	-174.7	-71.3	-87.8	0	0	0	110.7	I642 Y643 D646 L650 V725	I642-N648 HydrophobicContact CG2-CB 3.69Å; I642-N648 WeakPolarHBondContact CG2-ND2 3.1Å; Y643-N648 PolarHBondContact O-ND2 3.21Å; D646-N648 PolarHBondContact O-N 3.42Å; D646-N648 PolarHBondContact O-ND2 2.87Å; N648-L650 PolarHBondContact O-N 3.31Å; N648-V725 PolarHBondContact N-O 3.14Å; N648-V725 VanDerWaalsContact N-O 3.08Å; N648-V725 PolarHBondContact O-N 3.44Å
649	A	86.7	Confident	85.4	Confident	66 Å²	66	50.6 Å²	50.6	55%	0.545	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	123.9	166.2	0	0	0	0	0	110	F723	A649-F723 WeakPolarHBondContact CA-O 3.3Å
650	L	89.3	Confident	85.5	Confident	2 Å²	2	46 Å²	46	1%	0.01	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	127.1	177.1	179.8	67.7	0	0	0	109.4	R639 I642 N648 L652 F723 F737	R639-L650 HydrophobicContact CB-CD1 4.22Å; I642-L650 HydrophobicContact CD1-CB 4.4Å; I642-L650 HydrophobicContact CD1-CD1 4.14Å; I642-L650 HydrophobicContact CD1-CD2 4.07Å; I642-L650 HydrophobicContact CD1-CG 4.43Å; N648-L650 PolarHBondContact O-N 3.31Å; L650-L652 HydrophobicContact CD2-CD2 4.21Å; L650-L652 HydrophobicContact CG-CD2 4.36Å; L650-F723 PolarHBondContact N-O 3.21Å; L650-F723 PolarHBondContact O-N 3.3Å; L650-F737 HydrophobicContact CD2-CD2 4.24Å; L650-F737 HydrophobicContact CD2-CE2 3.37Å; L650-F737 HydrophobicContact CD2-CZ 3.79Å
651	T	90.8	Very high	85.7	Confident	35 Å²	35	39.9 Å²	39.9	22%	0.215	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	130.1	174.7	-53.1	0	0	0	0	110	D638 V682 E720 L721	D638-T651 PolarHBondContact N-O 3.24Å; T651-V682 HydrophobicContact CG2-CG2 4.05Å; T651-E720 HydrophobicContact CG2-CB 3.78Å; T651-E720 HydrophobicContact CG2-CG 4.17Å; T651-L721 WeakPolarHBondContact CA-O 3.37Å
652	L	91.3	Very high	85.7	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	119.3	173.3	-59	-178.2	0	0	0	109.5	V635 L650 E720 L721 F723 F737	V635-L652 HydrophobicContact CG1-CB 4.33Å; L650-L652 HydrophobicContact CD2-CD2 4.21Å; L650-L652 HydrophobicContact CG-CD2 4.36Å; L652-E720 WeakPolarHBondContact O-CA 3.39Å; L652-L721 PolarHBondContact N-O 3.35Å; L652-L721 PolarHBondContact O-N 3.04Å; L652-F723 HydrophobicContact CD1-CD2 4.09Å; L652-F723 HydrophobicContact CD1-CE2 3.76Å; L652-F723 HydrophobicContact CG-CD2 4.16Å; L652-F723 HydrophobicContact CG-CE2 4.16Å; L652-F737 HydrophobicContact CD1-CB 3.88Å; L652-F737 HydrophobicContact CD1-CD1 3.78Å; L652-F737 HydrophobicContact CD1-CD2 4.19Å; L652-F737 HydrophobicContact CD1-CE1 4.35Å; L652-F737 HydrophobicContact CD1-CG 3.68Å
653	M	91.2	Very high	85.7	Confident	71 Å²	71	35.4 Å²	35.4	35%	0.35	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	118.4	171.1	-175.2	174.6	62.7	0	0	108.8	V635 E636 E720	V635-M653 CarbonylContact C-O 3.56Å; V635-M653 WeakPolarHBondContact CA-O 3.48Å; E636-M653 HydrophobicContact CB-CE 4.03Å; E636-M653 HydrophobicContact CG-CE 4.46Å; E636-M653 PolarHBondContact N-O 2.91Å; E636-M653 PolarHBondContact O-N 3.14Å; E636-M653 VanDerWaalsContact OE2-CE 3.26Å; E636-M653 WeakPolarHBondContact OE2-CE 3.31Å; M653-E720 HydrophobicContact CB-CG 4.46Å
654	V	92.4	Very high	85.7	Confident	3 Å²	3	31.6 Å²	31.6	2%	0.018	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	128.4	-176.2	-175.4	0	0	0	0	109.7	L633 V635 L668 A719 L721 L739	L633-V654 HydrophobicContact CD1-CG1 3.46Å; L633-V654 VanDerWaalsContact CD1-CG1 3.46Å; V635-V654 HydrophobicContact CG1-CG2 4.36Å; V635-V654 HydrophobicContact CG2-CG1 4.45Å; V635-V654 HydrophobicContact CG2-CG2 4.4Å; V654-L668 HydrophobicContact CG1-CD1 4.4Å; V654-L668 HydrophobicContact CG1-CD2 3.87Å; V654-A719 PolarHBondContact N-O 3.25Å; V654-A719 PolarHBondContact O-N 3.32Å; V654-L721 HydrophobicContact CG2-CD1 4.09Å; V654-L721 HydrophobicContact CG2-CG 4.41Å; V654-L739 HydrophobicContact CG1-CD2 4.41Å; V654-L739 HydrophobicContact CG2-CD2 3.68Å
655	T	91.8	Very high	85.9	Confident	37 Å²	37	34.4 Å²	34.4	23%	0.227	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	115.5	171.3	-42.8	0	0	0	0	108.8	L633 S634 I717 L718	L633-T655 WeakPolarHBondContact CA-O 3.1Å; S634-T655 PolarHBondContact N-O 3.13Å; S634-T655 PolarHBondContact O-N 3.08Å; S634-T655 VanDerWaalsContact OG-CB 3.28Å; S634-T655 WeakPolarHBondContact OG-CB 3.38Å; S634-T655 PolarHBondContact OG-OG1 2.79Å; T655-I717 WeakPolarHBondContact CA-O 3.43Å; T655-L718 HydrophobicContact CG2-CD2 3.72Å; T655-L718 HydrophobicContact CG2-CG 4.3Å; T655-L718 VanDerWaalsContact OG1-CD2 3.28Å; T655-L718 WeakPolarHBondContact OG1-CD2 3.39Å
656	A	92.1	Very high	86.7	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.008	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	127	174.4	0	0	0	0	0	109.6	L707 T716 I717 I741	A656-L707 HydrophobicContact CB-CD1 3.92Å; A656-L707 HydrophobicContact CB-CD2 4.1Å; A656-T716 WeakPolarHBondContact O-CA 3.35Å; A656-I717 HydrophobicContact CB-CB 4.47Å; A656-I717 PolarHBondContact N-O 2.91Å; A656-I717 PolarHBondContact O-N 3.34Å; A656-I741 HydrophobicContact CB-CD1 3.69Å
657	E	92.1	Very high	87.6	Confident	47 Å²	47	32.5 Å²	32.5	22%	0.22	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	135.6	-176.3	179.3	178.5	-167.2	0	0	110.3	L631 K632 R659 T715 T716	L631-E657 CarbonylContact C-O 3.59Å; L631-E657 WeakPolarHBondContact CA-O 3.39Å; K632-E657 HydrophobicContact CB-CB 4.36Å; K632-E657 PolarHBondContact N-O 3.05Å; K632-E657 PolarHBondContact O-N 3.27Å; E657-R659 HydrophobicContact CG-CG 3.92Å; E657-R659 WeakPolarHBondContact OE1-CG 3.38Å; E657-R659 IonicContact OE1-CZ 3.53Å; E657-R659 IonicContact OE1-NE 3.8Å; E657-R659 PolarHBondContact OE1-NE 3.48Å; E657-R659 IonicContact OE1-NH2 2.73Å; E657-R659 PolarHBondContact OE1-NH2 3.19Å; E657-R659 IonicContact OE2-CZ 3.8Å; E657-R659 IonicContact OE2-NE 3.23Å; E657-R659 PolarHBondContact OE2-NE 3.18Å; E657-R659 VanDerWaalsContact OE2-NE 3.15Å; E657-R659 IonicContact OE2-NH2 3.96Å; E657-R659 PolarHBondContact OE2-NH2 3.47Å; E657-T715 WeakPolarHBondContact CA-O 2.82Å; E657-T716 HydrophobicContact CB-CG2 4.05Å; E657-T716 HydrophobicContact CG-CG2 3.68Å
658	N	91.4	Very high	88.3	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	109.1	169.7	-177.8	16.5	0	0	0	110.1	D630 L631 G660 E661 M711 K712 D714 T715	D630-N658 PolarHBondContact N-OD1 3.45Å; D630-N658 WeakPolarHBondContact O-CA 3.5Å; D630-N658 PolarHBondContact O-OD1 3.47Å; L631-N658 HydrophobicContact CD2-CB 3.97Å; N658-G660 PolarHBondContact OD1-N 3.06Å; N658-G660 VanDerWaalsContact OD1-N 3.09Å; N658-E661 PolarHBondContact ND2-O 3.25Å; N658-M711 HydrophobicContact CB-CE 3.73Å; N658-M711 HydrophobicContact CB-CG 3.99Å; N658-M711 HydrophobicContact CB-SD 3.9Å; N658-M711 PolarHBondContact ND2-O 3.48Å; N658-K712 PolarHBondContact ND2-O 3.02Å; N658-D714 WeakPolarHBondContact O-CA 3.44Å; N658-D714 PolarHBondContact O-N 3.24Å; N658-T715 PolarHBondContact N-O 2.89Å; N658-T715 PolarHBondContact O-N 3.05Å
659	R	89.1	Confident	88.7	Confident	120 Å²	120	28.7 Å²	28.7	45%	0.453	15%	0.153	S	C	.	.			trans	-95	-5.9	177.2	-60.9	-172.1	-178.4	-178.5	5.4	113.7	D630 E657	D630-R659 HydrophobicContact CB-CB 4.22Å; D630-R659 PolarHBondContact O-N 2.88Å; E657-R659 HydrophobicContact CG-CG 3.92Å; E657-R659 WeakPolarHBondContact OE1-CG 3.38Å; E657-R659 IonicContact OE1-CZ 3.53Å; E657-R659 IonicContact OE1-NE 3.8Å; E657-R659 PolarHBondContact OE1-NE 3.48Å; E657-R659 IonicContact OE1-NH2 2.73Å; E657-R659 PolarHBondContact OE1-NH2 3.19Å; E657-R659 IonicContact OE2-CZ 3.8Å; E657-R659 IonicContact OE2-NE 3.23Å; E657-R659 PolarHBondContact OE2-NE 3.18Å; E657-R659 VanDerWaalsContact OE2-NE 3.15Å; E657-R659 IonicContact OE2-NH2 3.96Å; E657-R659 PolarHBondContact OE2-NH2 3.47Å
660	G	85.3	Confident	89	Confident	14 Å²	14	25.5 Å²	25.5	14%	0.144	13%	0.127	C	C	.	.	S	Bend	trans	-95.9	-150.9	-178.4	0	0	0	0	0	112.1	N658 K713	N658-G660 PolarHBondContact OD1-N 3.06Å; N658-G660 VanDerWaalsContact OD1-N 3.09Å; G660-K713 WeakPolarHBondContact O-CA 3.42Å; G660-K713 WeakPolarHBondContact O-CB 3.37Å; G660-K713 WeakPolarHBondContact O-CG 3.25Å
661	E	87.9	Confident	89.1	Confident	50 Å²	50	28.2 Å²	28.2	23%	0.234	14%	0.137	C	C	.	.	S	Bend	trans	-81.3	-176.1	174.7	-63.6	175	153.4	0	0	111.7	I626 C627 K628 N658 A663	I626-E661 VanDerWaalsContact O-OE2 3.13Å; C627-E661 WeakPolarHBondContact CA-OE2 3.48Å; C627-E661 HydrophobicContact CB-CB 4.47Å; K628-E661 PolarHBondContact N-OE2 3.16Å; K628-E661 PolarHBondContact O-N 2.96Å; N658-E661 PolarHBondContact ND2-O 3.25Å; E661-A663 PolarHBondContact O-N 3.32Å
662	G	83	Confident	89	Confident	10 Å²	10	27 Å²	27	10%	0.103	13%	0.13	C	C	.	.			trans	-59.1	123.9	-179.1	0	0	0	0	0	113.1	N745	G662-N745 PolarHBondContact O-ND2 3.5Å
663	A	84.2	Confident	88.8	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.139	C	C	.	.	B	Isolated β-bridge	trans	-93.1	113.8	169.8	0	0	0	0	0	109.5	P629 L631 E661 A666 P710 M711	P629-A663 HydrophobicContact CB-CB 3.7Å; P629-A663 HydrophobicContact CG-CB 4.1Å; L631-A663 HydrophobicContact CD2-CB 4.07Å; E661-A663 PolarHBondContact O-N 3.32Å; A663-A666 HydrophobicContact CB-CB 4.1Å; A663-P710 CarbonylContact O-C 3.55Å; A663-P710 WeakPolarHBondContact O-CA 3.38Å; A663-P710 WeakPolarHBondContact O-CB 3.34Å; A663-M711 HydrophobicContact CB-CB 4.28Å; A663-M711 PolarHBondContact N-O 2.91Å; A663-M711 PolarHBondContact O-N 2.92Å
664	Y	82.1	Confident	88.3	Confident	7 Å²	7	32.1 Å²	32.1	3%	0.027	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	139.4	177.9	-63.7	-81.1	0	0	0	110.3	H616 L619 C627 A666 P710 S744 N745	H616-Y664 HydrophobicContact CB-CD1 4.05Å; H616-Y664 HydrophobicContact CB-CE1 4.22Å; H616-Y664 AromaticContact CG-CD1 4Å; L619-Y664 PolarHBondContact N-OH 2.84Å; L619-Y664 PolarHBondContact O-OH 3.14Å; L619-Y664 VanDerWaalsContact O-OH 3.05Å; C627-Y664 HydrophobicContact CB-CE2 3.99Å; Y664-A666 VanDerWaalsContact C-N 3.3Å; Y664-A666 PolarHBondContact O-N 2.95Å; Y664-P710 HydrophobicContact CD1-CB 3.87Å; Y664-P710 HydrophobicContact CD1-CG 4.39Å; Y664-P710 HydrophobicContact CE1-CB 4.06Å; Y664-P710 HydrophobicContact CE1-CG 4.19Å; Y664-P710 HydrophobicContact CG-CB 4.4Å; Y664-S744 VanDerWaalsContact C-OG 3.31Å; Y664-S744 WeakPolarHBondContact CB-OG 3.4Å; Y664-S744 PolarHBondContact O-N 3.36Å; Y664-S744 PolarHBondContact O-OG 3.38Å; Y664-N745 PolarHBondContact N-OD1 3.49Å
665	E	81.8	Confident	87.9	Confident	62 Å²	62	34.8 Å²	34.8	29%	0.29	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.1	50.6	-175.8	-62.8	177.6	-169.4	0	0	112.3	H616 E667 N709	H616-E665 IonicContact CE1-OE1 3.6Å; H616-E665 PolarHBondContact CE1-OE1 2.96Å; H616-E665 IonicContact NE2-OE1 3.05Å; H616-E665 PolarHBondContact NE2-OE1 2.86Å; E665-E667 PolarHBondContact O-N 3.13Å; E665-N709 PolarHBondContact N-OD1 3.24Å
666	A	86.8	Confident	87.6	Confident	2 Å²	2	33 Å²	33	2%	0.017	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	117.7	178.5	0	0	0	0	0	110	A663 Y664 L707 G708 M711 V742	A663-A666 HydrophobicContact CB-CB 4.1Å; Y664-A666 VanDerWaalsContact C-N 3.3Å; Y664-A666 PolarHBondContact O-N 2.95Å; A666-L707 HydrophobicContact CB-CB 4.11Å; A666-L707 WeakPolarHBondContact O-CA 3.26Å; A666-L707 WeakPolarHBondContact O-CB 3.11Å; A666-L707 PolarHBondContact O-N 3.04Å; A666-G708 PolarHBondContact N-O 2.81Å; A666-G708 VanDerWaalsContact N-O 3.14Å; A666-G708 PolarHBondContact O-N 3.2Å; A666-M711 HydrophobicContact CB-CB 3.66Å; A666-M711 HydrophobicContact CB-SD 4.25Å; A666-V742 WeakPolarHBondContact CA-O 3.41Å
667	E	90.9	Very high	87.4	Confident	51 Å²	51	36.2 Å²	36.2	24%	0.238	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	139.7	-179.9	-67.1	-176.7	170.4	0	0	110.6	E665 H669 V704 C705 I741 V742	E665-E667 PolarHBondContact O-N 3.13Å; E667-H669 IonicContact OE2-CD2 2.83Å; E667-H669 IonicContact OE2-CE1 2.8Å; E667-H669 IonicContact OE2-NE2 3.85Å; E667-H669 PolarHBondContact OE2-NE2 3.43Å; E667-V704 HydrophobicContact CB-CG1 4.02Å; E667-V704 VanDerWaalsContact CD-CG1 3.48Å; E667-V704 HydrophobicContact CG-CG1 3.99Å; E667-V704 VanDerWaalsContact OE2-CG1 3.24Å; E667-V704 WeakPolarHBondContact OE2-CG1 3.26Å; E667-C705 CarbonylContact C-O 3.59Å; E667-C705 WeakPolarHBondContact CA-O 3.44Å; E667-I741 CarbonylContact O-C 3.58Å; E667-I741 WeakPolarHBondContact O-CA 3.44Å; E667-I741 WeakPolarHBondContact O-CG2 3.35Å; E667-V742 PolarHBondContact N-O 3.4Å; E667-V742 PolarHBondContact O-N 2.93Å
668	L	91.8	Very high	87.2	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	120.3	167	173.5	71.3	0	0	0	109	L633 V654 V670 V704 C705 L707 L721 I741	L633-L668 HydrophobicContact CD1-CD1 3.77Å; L633-L668 HydrophobicContact CD2-CD1 4.14Å; V654-L668 HydrophobicContact CG1-CD1 4.4Å; V654-L668 HydrophobicContact CG1-CD2 3.87Å; L668-V670 HydrophobicContact CD2-CG2 4.07Å; L668-V670 HydrophobicContact CG-CG2 3.99Å; L668-V704 CarbonylContact O-C 3.37Å; L668-V704 WeakPolarHBondContact O-CA 3.49Å; L668-C705 HydrophobicContact CB-CB 4.18Å; L668-C705 PolarHBondContact N-O 2.74Å; L668-C705 PolarHBondContact O-N 3.08Å; L668-L707 HydrophobicContact CB-CD1 4.06Å; L668-L707 HydrophobicContact CB-CD2 4.08Å; L668-L707 HydrophobicContact CB-CG 4.06Å; L668-L721 HydrophobicContact CD2-CD1 4.2Å; L668-I741 HydrophobicContact CD1-CG1 4.1Å
669	H	91.9	Very high	87	Confident	23 Å²	23	41 Å²	41	11%	0.106	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	120.3	174.3	-65.5	-177.3	0	0	0	109.6	E667 Y671 M702 V703 L739 Q740	E667-H669 IonicContact OE2-CD2 2.83Å; E667-H669 IonicContact OE2-CE1 2.8Å; E667-H669 IonicContact OE2-NE2 3.85Å; E667-H669 PolarHBondContact OE2-NE2 3.43Å; H669-Y671 HydrophobicContact CB-CE2 4.02Å; H669-M702 HydrophobicContact CB-CE 4.39Å; H669-V703 WeakPolarHBondContact CA-O 2.99Å; H669-L739 CarbonylContact O-C 3.43Å; H669-L739 WeakPolarHBondContact O-CA 3.15Å; H669-Q740 PolarHBondContact N-O 3.45Å; H669-Q740 PolarHBondContact O-N 3.3Å
670	V	92.1	Very high	86.8	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	126.7	176	-177.6	0	0	0	0	108.8	L668 P672 M702 V703 L721 F723 L739	L668-V670 HydrophobicContact CD2-CG2 4.07Å; L668-V670 HydrophobicContact CG-CG2 3.99Å; V670-P672 WeakPolarHBondContact O-CD 3.36Å; V670-M702 CarbonylContact O-C 3.54Å; V670-M702 VanDerWaalsContact O-CA 3.29Å; V670-M702 WeakPolarHBondContact O-CA 3.42Å; V670-V703 HydrophobicContact CB-CB 4.21Å; V670-V703 PolarHBondContact N-O 3.1Å; V670-V703 PolarHBondContact O-N 3.08Å; V670-L721 HydrophobicContact CG2-CD1 3.77Å; V670-F723 HydrophobicContact CG1-CZ 3.9Å; V670-L739 HydrophobicContact CB-CD2 4.4Å; V670-L739 HydrophobicContact CB-CG 4.22Å; V670-L739 HydrophobicContact CG1-CD1 4.37Å; V670-L739 HydrophobicContact CG1-CD2 4.17Å; V670-L739 HydrophobicContact CG1-CG 3.91Å; V670-L739 HydrophobicContact CG2-CD2 3.6Å; V670-L739 HydrophobicContact CG2-CG 3.86Å
671	Y	91.1	Very high	86.9	Confident	58 Å²	58	37.2 Å²	37.2	23%	0.227	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	90.1	179.2	-58	-84.4	0	0	0	109	H669 M702 D738	H669-Y671 HydrophobicContact CB-CE2 4.02Å; Y671-M702 HydrophobicContact CD1-CB 4.2Å; Y671-M702 HydrophobicContact CE1-CB 4.25Å; Y671-D738 HydrophobicContact CD2-CB 4.39Å; Y671-D738 WeakPolarHBondContact CD2-O 3.43Å; Y671-D738 PolarHBondContact N-O 3.31Å; Y671-D738 PolarHBondContact O-N 2.79Å
672	P	89.3	Confident	86.6	Confident	11 Å²	11	37.5 Å²	37.5	7%	0.071	20%	0.199	C	C	.	.			trans	-72.8	151.9	173	30.5	-36.2	0	0	0	111.6	V670 A676 K701 F723 F737	V670-P672 WeakPolarHBondContact O-CD 3.36Å; P672-A676 HydrophobicContact CB-CB 4.21Å; P672-K701 WeakPolarHBondContact CD-O 3.29Å; P672-K701 HydrophobicContact CG-CB 3.99Å; P672-F723 HydrophobicContact CB-CD1 4.43Å; P672-F723 HydrophobicContact CB-CE1 4.15Å; P672-F723 HydrophobicContact CG-CE1 4.48Å; P672-F737 HydrophobicContact CB-CD1 4.11Å; P672-F737 HydrophobicContact CB-CE1 3.9Å
673	P	86.6	Confident	86.3	Confident	27 Å²	27	48 Å²	48	18%	0.175	24%	0.235	C	C	.	.			trans	-70.3	165.3	171.6	27.5	-28.9	0	0	0	111.5	Q675 A676 I735 K736 F737	P673-Q675 PolarHBondContact O-N 3.02Å; P673-Q675 VanDerWaalsContact O-N 3.17Å; P673-A676 HydrophobicContact CG-CB 4.03Å; P673-A676 PolarHBondContact O-N 2.81Å; P673-I735 HydrophobicContact CG-CG2 3.43Å; P673-I735 VanDerWaalsContact CG-CG2 3.43Å; P673-K736 WeakPolarHBondContact CD-O 3.3Å; P673-F737 HydrophobicContact CG-CZ 4.48Å
674	Q	81.4	Confident	85.6	Confident	151 Å²	151	50.9 Å²	50.9	71%	0.706	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-31	-174	-70.1	-166.3	-15.6	0	0	113.2	A676 K701	Q674-A676 VanDerWaalsContact C-N 3.28Å; Q674-A676 PolarHBondContact O-N 3.45Å; Q674-K701 PolarHBondContact O-NZ 3.11Å
675	Q	83	Confident	84.7	Confident	59 Å²	59	60.3 Å²	60.3	28%	0.276	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-10.7	179.3	-57.7	89.4	-21.4	0	0	113.8	P673 V725 H726 L728 D732	P673-Q675 PolarHBondContact O-N 3.02Å; P673-Q675 VanDerWaalsContact O-N 3.17Å; Q675-V725 HydrophobicContact CB-CG1 4.47Å; Q675-V725 WeakPolarHBondContact O-CA 3.18Å; Q675-H726 WeakPolarHBondContact CB-O 3.39Å; Q675-H726 PolarHBondContact O-N 3.18Å; Q675-L728 HydrophobicContact CB-CD2 4.45Å; Q675-D732 PolarHBondContact NE2-OD2 2.67Å; Q675-D732 VanDerWaalsContact NE2-OD2 3.1Å
676	A	86.6	Confident	83.7	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	131.6	-174.7	0	0	0	0	0	112	P672 P673 Q674 V725 F737	P672-A676 HydrophobicContact CB-CB 4.21Å; P673-A676 HydrophobicContact CG-CB 4.03Å; P673-A676 PolarHBondContact O-N 2.81Å; Q674-A676 VanDerWaalsContact C-N 3.28Å; Q674-A676 PolarHBondContact O-N 3.45Å; A676-V725 HydrophobicContact CB-CG2 4.12Å; A676-F737 HydrophobicContact CB-CE1 4Å; A676-F737 HydrophobicContact CB-CZ 3.88Å
677	D	86.9	Confident	82.8	Confident	68 Å²	68	64.1 Å²	64.1	36%	0.364	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	142.4	176.5	-67.8	-32.6	0	0	0	111.2	K701 F723 S724 H726	D677-K701 IonicContact OD1-NZ 2.74Å; D677-K701 PolarHBondContact OD1-NZ 2.76Å; D677-F723 CarbonylContact O-C 3.08Å; D677-F723 VanDerWaalsContact O-CA 3.26Å; D677-F723 WeakPolarHBondContact O-CA 3.06Å; D677-S724 PolarHBondContact N-O 3.23Å; D677-S724 PolarHBondContact O-N 2.95Å; D677-H726 IonicContact OD2-CD2 2.74Å
678	F	89.1	Confident	81.6	Confident	47 Å²	47	64 Å²	64	21%	0.206	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	120.5	-178.3	178.8	-114.2	0	0	0	110.5	G680 V681 C692 V703 L721 F723	F678-G680 VanDerWaalsContact CZ-C 3.48Å; F678-G680 VanDerWaalsContact CZ-CA 3.45Å; F678-V681 HydrophobicContact CZ-CG2 4.2Å; F678-C692 HydrophobicContact CE1-CB 4.05Å; F678-C692 HydrophobicContact CZ-CB 3.85Å; F678-V703 HydrophobicContact CB-CG2 3.78Å; F678-V703 HydrophobicContact CD1-CG1 4.16Å; F678-V703 HydrophobicContact CD1-CG2 4.34Å; F678-V703 HydrophobicContact CD2-CG1 4.2Å; F678-V703 HydrophobicContact CD2-CG2 4.12Å; F678-V703 HydrophobicContact CE1-CG1 4.08Å; F678-V703 HydrophobicContact CE2-CG1 4.13Å; F678-V703 HydrophobicContact CG-CG1 4.2Å; F678-V703 HydrophobicContact CG-CG2 3.82Å; F678-V703 HydrophobicContact CZ-CG1 4.06Å; F678-L721 HydrophobicContact CE2-CB 4.31Å; F678-L721 HydrophobicContact CE2-CD2 4.22Å; F678-F723 HydrophobicContact CB-CD1 4.26Å; F678-F723 HydrophobicContact CB-CE1 4.03Å; F678-F723 HydrophobicContact CD2-CD1 4.24Å; F678-F723 AromaticContact CD2-CE1 3.72Å; F678-F723 HydrophobicContact CD2-CE1 3.72Å; F678-F723 HydrophobicContact CD2-CE2 4.5Å; F678-F723 AromaticContact CD2-CZ 3.85Å; F678-F723 HydrophobicContact CD2-CZ 3.85Å; F678-F723 HydrophobicContact CE2-CZ 4.47Å; F678-F723 HydrophobicContact CG-CE1 4.34Å
679	T	86.3	Confident	80.7	Confident	100 Å²	100	75 Å²	75	61%	0.613	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	-36.1	178.8	59.9	0	0	0	0	112.2	G722	T679-G722 PolarHBondContact N-O 3.35Å; T679-G722 WeakPolarHBondContact OG1-CA 3.37Å; T679-G722 PolarHBondContact OG1-O 3.2Å
680	G	85.7	Confident	80.3	Confident	20 Å²	20	75 Å²	75	21%	0.206	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	148.8	-179.9	-179.5	0	0	0	0	0	113.7	F678 G722	F678-G680 VanDerWaalsContact CZ-C 3.48Å; F678-G680 VanDerWaalsContact CZ-CA 3.45Å; G680-G722 PolarHBondContact O-N 3.08Å
681	V	85.9	Confident	79.9	Confident	34 Å²	34	78.5 Å²	78.5	21%	0.206	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	127.6	173.1	-172.4	0	0	0	0	109.2	F678 R683 L690 C692 E720 L721	F678-V681 HydrophobicContact CZ-CG2 4.2Å; V681-R683 PolarHBondContact O-N 3.03Å; V681-L690 HydrophobicContact CG2-CB 4.41Å; V681-C692 HydrophobicContact CG2-CB 4.04Å; V681-C692 WeakPolarHBondContact CG2-SG 3.27Å; V681-E720 WeakPolarHBondContact CA-O 3.45Å; V681-L721 HydrophobicContact CG2-CD2 3.9Å
682	V	81.9	Confident	79.7	Confident	56 Å²	56	77.2 Å²	77.2	34%	0.339	40%	0.398	S	S	.	.			trans	-68.4	130	179.5	-176.7	0	0	0	0	109.6	T651 E720	T651-V682 HydrophobicContact CG2-CG2 4.05Å; V682-E720 HydrophobicContact CB-CB 3.86Å; V682-E720 HydrophobicContact CG2-CB 4.03Å; V682-E720 PolarHBondContact N-O 3.12Å
683	R	76.4	Confident	79.5	Confident	230 Å²	230	79.1 Å²	79.1	87%	0.868	41%	0.414	S	S	*	.			trans	-93.7	106.4	-177.7	-65.6	-179.1	179.1	170.9	0.9	110.2	V681	V681-R683 PolarHBondContact O-N 3.03Å
684	S	70.8	Confident	79.4	Confident	61 Å²	61	82.6 Å²	82.6	43%	0.427	42%	0.424	S	S	.	.			trans	-126.2	159.4	167.9	-170.5	0	0	0	0	111	T686 L687	S684-T686 PolarHBondContact O-N 3.5Å; S684-T686 PolarHBondContact OG-OG1 3.23Å; S684-L687 PolarHBondContact O-N 2.85Å
685	Q	62.2	Low	79.3	Confident	205 Å²	205	80 Å²	80	96%	0.958	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-21	178.7	-67.7	-178.1	0.3	0	0	112.9
686	T	61.9	Low	78.9	Confident	121 Å²	121	83.7 Å²	83.7	74%	0.742	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-9.1	-179.1	51.4	0	0	0	0	114	S684	S684-T686 PolarHBondContact O-N 3.5Å; S684-T686 PolarHBondContact OG-OG1 3.23Å
687	L	67.8	Low	78	Confident	24 Å²	24	89.5 Å²	89.5	13%	0.126	45%	0.453	C	S	.	.	S	Bend	trans	-104.9	144.4	-173.7	-68.9	165.7	0	0	0	111.5	S684 L718 E720	S684-L687 PolarHBondContact O-N 2.85Å; L687-L718 HydrophobicContact CD2-CB 4.34Å; L687-E720 HydrophobicContact CD1-CB 3.97Å; L687-E720 VanDerWaalsContact CD1-CD 3.43Å; L687-E720 HydrophobicContact CD1-CG 3.79Å; L687-E720 HydrophobicContact CD2-CG 4.02Å
688	S	66.1	Low	77.1	Confident	49 Å²	49	93.5 Å²	93.5	34%	0.343	47%	0.474	S	S	.	.			trans	-70.9	131.1	176.9	-66.7	0	0	0	0	110.8	L690 L718	S688-L690 PolarHBondContact O-N 2.8Å; S688-L718 PolarHBondContact N-O 3.11Å
689	R	72.9	Confident	75.8	Confident	230 Å²	230	98.5 Å²	98.5	87%	0.868	50%	0.498	S	S	*	.			trans	-77.3	91.1	174	-67	-179	-177.5	165.9	1.3	109.5
690	L	81.6	Confident	75.3	Confident	23 Å²	23	97.5 Å²	97.5	12%	0.12	49%	0.492	C	S	.	.			trans	-78.1	139.6	173.5	-65.9	177.7	0	0	0	111.1	V681 S688 C705 D706 L707 I717 A719	V681-L690 HydrophobicContact CG2-CB 4.41Å; S688-L690 PolarHBondContact O-N 2.8Å; L690-C705 HydrophobicContact CB-CB 4.39Å; L690-C705 HydrophobicContact CD1-CB 4.21Å; L690-D706 WeakPolarHBondContact CD2-O 3.23Å; L690-L707 HydrophobicContact CD1-CD2 4.23Å; L690-L707 HydrophobicContact CD2-CD2 3.94Å; L690-I717 HydrophobicContact CD2-CG2 3.99Å; L690-A719 HydrophobicContact CD1-CB 3.25Å; L690-A719 HydrophobicContact CG-CB 3.98Å
691	S	84.4	Confident	75.1	Confident	75 Å²	75	98.5 Å²	98.5	52%	0.524	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	108.2	166.3	176.7	0	0	0	0	107.2	C705 D706	S691-C705 CarbonylContact O-C 3.26Å; S691-C705 WeakPolarHBondContact O-CA 3.28Å; S691-D706 WeakPolarHBondContact CB-OD2 3.41Å; S691-D706 PolarHBondContact O-N 3.31Å; S691-D706 PolarHBondContact OG-OD2 2.95Å
692	C	86.9	Confident	75.2	Confident	31 Å²	31	97.4 Å²	97.4	21%	0.209	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	136	-179.3	-60.5	0	0	0	0	110.7	F678 V681 V703 V704 C705	F678-C692 HydrophobicContact CE1-CB 4.05Å; F678-C692 HydrophobicContact CZ-CB 3.85Å; V681-C692 HydrophobicContact CG2-CB 4.04Å; V681-C692 WeakPolarHBondContact CG2-SG 3.27Å; C692-V703 HydrophobicContact CB-CG1 4.16Å; C692-V704 CarbonylContact C-O 3.59Å; C692-V704 VanDerWaalsContact CA-O 3.26Å; C692-V704 WeakPolarHBondContact CA-O 3.35Å; C692-C705 HydrophobicContact CB-CB 4.08Å; C692-C705 WeakPolarHBondContact CB-SG 3.38Å; C692-C705 WeakPolarHBondContact SG-CB 3.31Å; C692-C705 CovalentContact SG-SG 2.03Å; C692-C705 PolarHBondContact SG-SG 3.07Å
693	A	84.9	Confident	75.6	Confident	50 Å²	50	94.8 Å²	94.8	41%	0.413	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	136	175	0	0	0	0	0	110.2	V704	A693-V704 PolarHBondContact N-O 2.85Å; A693-V704 PolarHBondContact O-N 2.73Å
694	Y	84.1	Confident	76.2	Confident	100 Å²	100	84 Å²	84	39%	0.392	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	127.6	170.4	178.6	-93.4	0	0	0	109.3	K696 K701 V703	Y694-K696 HydrophobicContact CE1-CB 4.43Å; Y694-K701 HydrophobicContact CE2-CB 4.09Å; Y694-K701 HydrophobicContact CE2-CD 4.41Å; Y694-K701 HydrophobicContact CE2-CG 4.44Å; Y694-K701 VanDerWaalsContact OH-CD 3.27Å; Y694-K701 WeakPolarHBondContact OH-CD 3.29Å; Y694-K701 WeakPolarHBondContact OH-CG 3.17Å; Y694-V703 HydrophobicContact CD2-CG2 4.08Å
695	K	78.9	Confident	77.2	Confident	97 Å²	97	81.1 Å²	81.1	42%	0.422	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	146.6	174.8	-64.8	-177.3	-174.7	170.5	0	109.3	M702 V704	K695-M702 HydrophobicContact CB-CG 3.74Å; K695-M702 HydrophobicContact CB-SD 4.2Å; K695-M702 PolarHBondContact N-O 2.86Å; K695-M702 WeakPolarHBondContact O-CG 3.08Å; K695-M702 PolarHBondContact O-N 2.7Å; K695-V704 HydrophobicContact CD-CG2 3.92Å; K695-V704 HydrophobicContact CG-CG2 4.45Å
696	K	75.1	Confident	78.4	Confident	137 Å²	137	75.1 Å²	75.1	60%	0.596	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.7	107.7	173.6	-171	179.1	179.7	-175.2	0	107.3	Y694	Y694-K696 HydrophobicContact CE1-CB 4.43Å
697	E	68.8	Low	79.5	Confident	121 Å²	121	70 Å²	70	57%	0.565	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121	122.1	-178.6	-167	169.2	-160.7	0	0	108.4	E699 T700 M702	E697-E699 VanDerWaalsContact C-N 3.31Å; E697-E699 PolarHBondContact O-N 2.86Å; E697-T700 PolarHBondContact N-O 2.84Å; E697-T700 PolarHBondContact O-N 3.08Å; E697-T700 PolarHBondContact O-OG1 2.73Å; E697-M702 HydrophobicContact CB-SD 4.48Å
698	N	66.4	Low	80.1	Confident	152 Å²	152	70.2 Å²	70.2	81%	0.813	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.4	50.3	-178.3	-58.1	-29.5	0	0	0	113.3	T700	N698-T700 PolarHBondContact O-N 2.92Å
699	E	63.3	Low	80.6	Confident	153 Å²	153	70.1 Å²	70.1	72%	0.715	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	-9.9	-178.3	-52.9	-177.1	159.1	0	0	116.9	E697 K701	E697-E699 VanDerWaalsContact C-N 3.31Å; E697-E699 PolarHBondContact O-N 2.86Å; E699-K701 PolarHBondContact O-N 3.31Å
700	T	74.6	Confident	80.8	Confident	78 Å²	78	60.4 Å²	60.4	48%	0.479	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	120.7	173.5	63.1	0	0	0	0	110.5	E697 N698 M702	E697-T700 PolarHBondContact N-O 2.84Å; E697-T700 PolarHBondContact O-N 3.08Å; E697-T700 PolarHBondContact O-OG1 2.73Å; N698-T700 PolarHBondContact O-N 2.92Å; T700-M702 PolarHBondContact O-N 3.04Å
701	K	81.4	Confident	81	Confident	41 Å²	41	59.5 Å²	59.5	18%	0.178	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	126.1	170.8	-61.2	-168	168	-179.9	0	107.6	P672 Q674 D677 Y694 E699	P672-K701 WeakPolarHBondContact CD-O 3.29Å; P672-K701 HydrophobicContact CG-CB 3.99Å; Q674-K701 PolarHBondContact O-NZ 3.11Å; D677-K701 IonicContact OD1-NZ 2.74Å; D677-K701 PolarHBondContact OD1-NZ 2.76Å; Y694-K701 HydrophobicContact CE2-CB 4.09Å; Y694-K701 HydrophobicContact CE2-CD 4.41Å; Y694-K701 HydrophobicContact CE2-CG 4.44Å; Y694-K701 VanDerWaalsContact OH-CD 3.27Å; Y694-K701 WeakPolarHBondContact OH-CD 3.29Å; Y694-K701 WeakPolarHBondContact OH-CG 3.17Å; E699-K701 PolarHBondContact O-N 3.31Å
702	M	88.4	Confident	81	Confident	12 Å²	12	62.3 Å²	62.3	6%	0.059	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	143.2	174.6	70.2	-178.9	-55.5	0	0	111.4	H669 V670 Y671 K695 E697 T700 V704	H669-M702 HydrophobicContact CB-CE 4.39Å; V670-M702 CarbonylContact O-C 3.54Å; V670-M702 VanDerWaalsContact O-CA 3.29Å; V670-M702 WeakPolarHBondContact O-CA 3.42Å; Y671-M702 HydrophobicContact CD1-CB 4.2Å; Y671-M702 HydrophobicContact CE1-CB 4.25Å; K695-M702 HydrophobicContact CB-CG 3.74Å; K695-M702 HydrophobicContact CB-SD 4.2Å; K695-M702 PolarHBondContact N-O 2.86Å; K695-M702 WeakPolarHBondContact O-CG 3.08Å; K695-M702 PolarHBondContact O-N 2.7Å; E697-M702 HydrophobicContact CB-SD 4.48Å; T700-M702 PolarHBondContact O-N 3.04Å; M702-V704 HydrophobicContact CE-CG2 3.59Å; M702-V704 HydrophobicContact CG-CG2 4.49Å; M702-V704 HydrophobicContact SD-CG2 4.44Å
703	V	90.4	Very high	80.9	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	124.4	170.6	-177.5	0	0	0	0	107.5	H669 V670 F678 C692 Y694 F723	H669-V703 WeakPolarHBondContact CA-O 2.99Å; V670-V703 HydrophobicContact CB-CB 4.21Å; V670-V703 PolarHBondContact N-O 3.1Å; V670-V703 PolarHBondContact O-N 3.08Å; F678-V703 HydrophobicContact CB-CG2 3.78Å; F678-V703 HydrophobicContact CD1-CG1 4.16Å; F678-V703 HydrophobicContact CD1-CG2 4.34Å; F678-V703 HydrophobicContact CD2-CG1 4.2Å; F678-V703 HydrophobicContact CD2-CG2 4.12Å; F678-V703 HydrophobicContact CE1-CG1 4.08Å; F678-V703 HydrophobicContact CE2-CG1 4.13Å; F678-V703 HydrophobicContact CG-CG1 4.2Å; F678-V703 HydrophobicContact CG-CG2 3.82Å; F678-V703 HydrophobicContact CZ-CG1 4.06Å; C692-V703 HydrophobicContact CB-CG1 4.16Å; Y694-V703 HydrophobicContact CD2-CG2 4.08Å; V703-F723 HydrophobicContact CG2-CE1 4.3Å
704	V	90.3	Very high	81	Confident	4 Å²	4	69.8 Å²	69.8	2%	0.024	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	121.9	179	179.9	0	0	0	0	108.4	E667 L668 C692 A693 K695 M702	E667-V704 HydrophobicContact CB-CG1 4.02Å; E667-V704 VanDerWaalsContact CD-CG1 3.48Å; E667-V704 HydrophobicContact CG-CG1 3.99Å; E667-V704 VanDerWaalsContact OE2-CG1 3.24Å; E667-V704 WeakPolarHBondContact OE2-CG1 3.26Å; L668-V704 CarbonylContact O-C 3.37Å; L668-V704 WeakPolarHBondContact O-CA 3.49Å; C692-V704 CarbonylContact C-O 3.59Å; C692-V704 VanDerWaalsContact CA-O 3.26Å; C692-V704 WeakPolarHBondContact CA-O 3.35Å; A693-V704 PolarHBondContact N-O 2.85Å; A693-V704 PolarHBondContact O-N 2.73Å; K695-V704 HydrophobicContact CD-CG2 3.92Å; K695-V704 HydrophobicContact CG-CG2 4.45Å; M702-V704 HydrophobicContact CE-CG2 3.59Å; M702-V704 HydrophobicContact CG-CG2 4.49Å; M702-V704 HydrophobicContact SD-CG2 4.44Å
705	C	90.4	Very high	81.2	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	130.6	177.4	-61.9	0	0	0	0	111.4	E667 L668 L690 S691 C692 L707	E667-C705 CarbonylContact C-O 3.59Å; E667-C705 WeakPolarHBondContact CA-O 3.44Å; L668-C705 HydrophobicContact CB-CB 4.18Å; L668-C705 PolarHBondContact N-O 2.74Å; L668-C705 PolarHBondContact O-N 3.08Å; L690-C705 HydrophobicContact CB-CB 4.39Å; L690-C705 HydrophobicContact CD1-CB 4.21Å; S691-C705 CarbonylContact O-C 3.26Å; S691-C705 WeakPolarHBondContact O-CA 3.28Å; C692-C705 HydrophobicContact CB-CB 4.08Å; C692-C705 WeakPolarHBondContact CB-SG 3.38Å; C692-C705 WeakPolarHBondContact SG-CB 3.31Å; C692-C705 CovalentContact SG-SG 2.03Å; C692-C705 PolarHBondContact SG-SG 3.07Å; C705-L707 PolarHBondContact O-N 2.93Å
706	D	88	Confident	81.7	Confident	80 Å²	80	66.5 Å²	66.5	43%	0.428	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	115	-179.9	-57.3	-33	0	0	0	110.6	L690 S691	L690-D706 WeakPolarHBondContact CD2-O 3.23Å; S691-D706 WeakPolarHBondContact CB-OD2 3.41Å; S691-D706 PolarHBondContact O-N 3.31Å; S691-D706 PolarHBondContact OG-OD2 2.95Å
707	L	85.4	Confident	82.3	Confident	12 Å²	12	61.1 Å²	61.1	6%	0.063	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-17.3	176.9	-61.4	178.5	0	0	0	112.7	A656 A666 L668 L690 C705 M711 I717 I741	A656-L707 HydrophobicContact CB-CD1 3.92Å; A656-L707 HydrophobicContact CB-CD2 4.1Å; A666-L707 HydrophobicContact CB-CB 4.11Å; A666-L707 WeakPolarHBondContact O-CA 3.26Å; A666-L707 WeakPolarHBondContact O-CB 3.11Å; A666-L707 PolarHBondContact O-N 3.04Å; L668-L707 HydrophobicContact CB-CD1 4.06Å; L668-L707 HydrophobicContact CB-CD2 4.08Å; L668-L707 HydrophobicContact CB-CG 4.06Å; L690-L707 HydrophobicContact CD1-CD2 4.23Å; L690-L707 HydrophobicContact CD2-CD2 3.94Å; C705-L707 PolarHBondContact O-N 2.93Å; L707-M711 HydrophobicContact CB-SD 4.14Å; L707-M711 HydrophobicContact CD1-SD 4.34Å; L707-I717 HydrophobicContact CB-CD1 4.08Å; L707-I717 HydrophobicContact CD2-CD1 4.28Å; L707-I717 HydrophobicContact CD2-CG2 4.35Å; L707-I717 WeakPolarHBondContact O-CD1 3.32Å; L707-I741 HydrophobicContact CD1-CB 4.45Å; L707-I741 HydrophobicContact CD1-CD1 4.07Å; L707-I741 HydrophobicContact CD1-CG1 4.04Å; L707-I741 HydrophobicContact CD1-CG2 3.61Å
708	G	79.2	Confident	83.3	Confident	29 Å²	29	59 Å²	59	30%	0.299	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	140.2	156.6	173.8	0	0	0	0	0	113	A666 M711	A666-G708 PolarHBondContact N-O 2.81Å; A666-G708 VanDerWaalsContact N-O 3.14Å; A666-G708 PolarHBondContact O-N 3.2Å; G708-M711 PolarHBondContact O-N 2.95Å
709	N	76.2	Confident	84.4	Confident	48 Å²	48	51.9 Å²	51.9	26%	0.257	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.9	97.1	179.9	-168.5	13.6	0	0	0	111.6	H616 E665	H616-N709 PolarHBondContact CE1-ND2 3.5Å; E665-N709 PolarHBondContact N-OD1 3.24Å
710	P	77.4	Confident	85.6	Confident	26 Å²	26	47.4 Å²	47.4	17%	0.169	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	cis	-78.3	150.7	-10.2	31.3	-32.8	0	0	0	112.7	A663 Y664 K712	A663-P710 CarbonylContact O-C 3.55Å; A663-P710 WeakPolarHBondContact O-CA 3.38Å; A663-P710 WeakPolarHBondContact O-CB 3.34Å; Y664-P710 HydrophobicContact CD1-CB 3.87Å; Y664-P710 HydrophobicContact CD1-CG 4.39Å; Y664-P710 HydrophobicContact CE1-CB 4.06Å; Y664-P710 HydrophobicContact CE1-CG 4.19Å; Y664-P710 HydrophobicContact CG-CB 4.4Å; P710-K712 PolarHBondContact O-N 2.87Å
711	M	85.7	Confident	86.4	Confident	4 Å²	4	43.7 Å²	43.7	2%	0.02	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-71.8	105.2	163.1	-179.5	178.5	-174.4	0	0	108	L631 N658 A663 A666 L707 G708 T715 I717	L631-M711 HydrophobicContact CD2-SD 4.24Å; N658-M711 HydrophobicContact CB-CE 3.73Å; N658-M711 HydrophobicContact CB-CG 3.99Å; N658-M711 HydrophobicContact CB-SD 3.9Å; N658-M711 PolarHBondContact ND2-O 3.48Å; A663-M711 HydrophobicContact CB-CB 4.28Å; A663-M711 PolarHBondContact N-O 2.91Å; A663-M711 PolarHBondContact O-N 2.92Å; A666-M711 HydrophobicContact CB-CB 3.66Å; A666-M711 HydrophobicContact CB-SD 4.25Å; L707-M711 HydrophobicContact CB-SD 4.14Å; L707-M711 HydrophobicContact CD1-SD 4.34Å; G708-M711 PolarHBondContact O-N 2.95Å; M711-T715 WeakPolarHBondContact CE-O 3.35Å; M711-T715 WeakPolarHBondContact CE-OG1 3.25Å; M711-T715 WeakPolarHBondContact CG-OG1 3.37Å; M711-I717 HydrophobicContact CE-CD1 4.16Å; M711-I717 HydrophobicContact CE-CG1 4.42Å
712	K	84.9	Confident	86.8	Confident	133 Å²	133	42 Å²	42	58%	0.578	22%	0.224	S	C	*	.			trans	-64.5	164.1	-171.8	-60.3	-177	179.1	-174.8	0	112.4	N658 P710 T715	N658-K712 PolarHBondContact ND2-O 3.02Å; P710-K712 PolarHBondContact O-N 2.87Å; K712-T715 HydrophobicContact CB-CG2 3.72Å; K712-T715 WeakPolarHBondContact O-CB 3.32Å; K712-T715 VanDerWaalsContact O-CG2 3.3Å; K712-T715 WeakPolarHBondContact O-CG2 3.35Å; K712-T715 PolarHBondContact O-N 3.1Å; K712-T715 PolarHBondContact O-OG1 3.07Å
713	K	85.7	Confident	86.9	Confident	131 Å²	131	41.5 Å²	41.5	57%	0.57	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	140.7	169.8	174.8	165.6	-177.5	-179.5	0	111.8	G660 T715	G660-K713 WeakPolarHBondContact O-CA 3.42Å; G660-K713 WeakPolarHBondContact O-CB 3.37Å; G660-K713 WeakPolarHBondContact O-CG 3.25Å; K713-T715 PolarHBondContact O-N 3.42Å
714	D	86.4	Confident	86.8	Confident	107 Å²	107	42.5 Å²	42.5	57%	0.572	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.5	32	178.4	-58.7	-43.4	0	0	0	113.8	N658	N658-D714 WeakPolarHBondContact O-CA 3.44Å; N658-D714 PolarHBondContact O-N 3.24Å
715	T	87.4	Confident	86.6	Confident	40 Å²	40	42.3 Å²	42.3	25%	0.245	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	131.8	175.7	52.8	0	0	0	0	111.3	E657 N658 M711 K712 K713	E657-T715 WeakPolarHBondContact CA-O 2.82Å; N658-T715 PolarHBondContact N-O 2.89Å; N658-T715 PolarHBondContact O-N 3.05Å; M711-T715 WeakPolarHBondContact CE-O 3.35Å; M711-T715 WeakPolarHBondContact CE-OG1 3.25Å; M711-T715 WeakPolarHBondContact CG-OG1 3.37Å; K712-T715 HydrophobicContact CB-CG2 3.72Å; K712-T715 WeakPolarHBondContact O-CB 3.32Å; K712-T715 VanDerWaalsContact O-CG2 3.3Å; K712-T715 WeakPolarHBondContact O-CG2 3.35Å; K712-T715 PolarHBondContact O-N 3.1Å; K712-T715 PolarHBondContact O-OG1 3.07Å; K713-T715 PolarHBondContact O-N 3.42Å
716	T	89.8	Confident	86.2	Confident	89 Å²	89	44.8 Å²	44.8	55%	0.546	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130.1	173.3	48.8	0	0	0	0	109.6	A656 E657	A656-T716 WeakPolarHBondContact O-CA 3.35Å; E657-T716 HydrophobicContact CB-CG2 4.05Å; E657-T716 HydrophobicContact CG-CG2 3.68Å
717	I	88.2	Confident	85.1	Confident	23 Å²	23	49.9 Å²	49.9	12%	0.118	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	123.7	-177.6	-62.5	177.6	0	0	0	107.8	T655 A656 L690 L707 M711	T655-I717 WeakPolarHBondContact CA-O 3.43Å; A656-I717 HydrophobicContact CB-CB 4.47Å; A656-I717 PolarHBondContact N-O 2.91Å; A656-I717 PolarHBondContact O-N 3.34Å; L690-I717 HydrophobicContact CD2-CG2 3.99Å; L707-I717 HydrophobicContact CB-CD1 4.08Å; L707-I717 HydrophobicContact CD2-CD1 4.28Å; L707-I717 HydrophobicContact CD2-CG2 4.35Å; L707-I717 WeakPolarHBondContact O-CD1 3.32Å; M711-I717 HydrophobicContact CE-CD1 4.16Å; M711-I717 HydrophobicContact CE-CG1 4.42Å
718	L	90	Very high	84.2	Confident	78 Å²	78	50.3 Å²	50.3	41%	0.408	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	123.9	175	-73.2	157.5	0	0	0	108.6	T655 L687 S688	T655-L718 HydrophobicContact CG2-CD2 3.72Å; T655-L718 HydrophobicContact CG2-CG 4.3Å; T655-L718 VanDerWaalsContact OG1-CD2 3.28Å; T655-L718 WeakPolarHBondContact OG1-CD2 3.39Å; L687-L718 HydrophobicContact CD2-CB 4.34Å; S688-L718 PolarHBondContact N-O 3.11Å
719	A	88.8	Confident	83.5	Confident	2 Å²	2	51.5 Å²	51.5	2%	0.017	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	146.7	179.1	0	0	0	0	0	111.7	V654 L690	V654-A719 PolarHBondContact N-O 3.25Å; V654-A719 PolarHBondContact O-N 3.32Å; L690-A719 HydrophobicContact CD1-CB 3.25Å; L690-A719 HydrophobicContact CG-CB 3.98Å
720	E	89.9	Confident	83.1	Confident	58 Å²	58	53.1 Å²	53.1	27%	0.271	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	122.5	174.2	-76.3	175.4	-165.6	0	0	109.4	T651 L652 M653 V681 V682 L687	T651-E720 HydrophobicContact CG2-CB 3.78Å; T651-E720 HydrophobicContact CG2-CG 4.17Å; L652-E720 WeakPolarHBondContact O-CA 3.39Å; M653-E720 HydrophobicContact CB-CG 4.46Å; V681-E720 WeakPolarHBondContact CA-O 3.45Å; V682-E720 HydrophobicContact CB-CB 3.86Å; V682-E720 HydrophobicContact CG2-CB 4.03Å; V682-E720 PolarHBondContact N-O 3.12Å; L687-E720 HydrophobicContact CD1-CB 3.97Å; L687-E720 VanDerWaalsContact CD1-CD 3.43Å; L687-E720 HydrophobicContact CD1-CG 3.79Å; L687-E720 HydrophobicContact CD2-CG 4.02Å
721	L	90.5	Very high	82.6	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	118.9	-179	-57.5	-179.3	0	0	0	109.2	T651 L652 V654 L668 V670 F678 V681 F723	T651-L721 WeakPolarHBondContact CA-O 3.37Å; L652-L721 PolarHBondContact N-O 3.35Å; L652-L721 PolarHBondContact O-N 3.04Å; V654-L721 HydrophobicContact CG2-CD1 4.09Å; V654-L721 HydrophobicContact CG2-CG 4.41Å; L668-L721 HydrophobicContact CD2-CD1 4.2Å; V670-L721 HydrophobicContact CG2-CD1 3.77Å; F678-L721 HydrophobicContact CE2-CB 4.31Å; F678-L721 HydrophobicContact CE2-CD2 4.22Å; V681-L721 HydrophobicContact CG2-CD2 3.9Å; L721-F723 HydrophobicContact CB-CD2 4.46Å; L721-F723 HydrophobicContact CB-CE2 3.62Å; L721-F723 HydrophobicContact CB-CZ 4.23Å; L721-F723 WeakPolarHBondContact O-CD2 3.46Å
722	G	90.8	Very high	81.9	Confident	5 Å²	5	61.7 Å²	61.7	5%	0.052	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	130.8	178.8	0	0	0	0	0	112	T679 G680	T679-G722 PolarHBondContact N-O 3.35Å; T679-G722 WeakPolarHBondContact OG1-CA 3.37Å; T679-G722 PolarHBondContact OG1-O 3.2Å; G680-G722 PolarHBondContact O-N 3.08Å
723	F	89.9	Confident	81.6	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.009	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	147.8	175.2	-64.3	-88.3	0	0	0	110.4	A649 L650 L652 V670 P672 D677 F678 V703 L721 F737	A649-F723 WeakPolarHBondContact CA-O 3.3Å; L650-F723 PolarHBondContact N-O 3.21Å; L650-F723 PolarHBondContact O-N 3.3Å; L652-F723 HydrophobicContact CD1-CD2 4.09Å; L652-F723 HydrophobicContact CD1-CE2 3.76Å; L652-F723 HydrophobicContact CG-CD2 4.16Å; L652-F723 HydrophobicContact CG-CE2 4.16Å; V670-F723 HydrophobicContact CG1-CZ 3.9Å; P672-F723 HydrophobicContact CB-CD1 4.43Å; P672-F723 HydrophobicContact CB-CE1 4.15Å; P672-F723 HydrophobicContact CG-CE1 4.48Å; D677-F723 CarbonylContact O-C 3.08Å; D677-F723 VanDerWaalsContact O-CA 3.26Å; D677-F723 WeakPolarHBondContact O-CA 3.06Å; F678-F723 HydrophobicContact CB-CD1 4.26Å; F678-F723 HydrophobicContact CB-CE1 4.03Å; F678-F723 HydrophobicContact CD2-CD1 4.24Å; F678-F723 AromaticContact CD2-CE1 3.72Å; F678-F723 HydrophobicContact CD2-CE1 3.72Å; F678-F723 HydrophobicContact CD2-CE2 4.5Å; F678-F723 AromaticContact CD2-CZ 3.85Å; F678-F723 HydrophobicContact CD2-CZ 3.85Å; F678-F723 HydrophobicContact CE2-CZ 4.47Å; F678-F723 HydrophobicContact CG-CE1 4.34Å; V703-F723 HydrophobicContact CG2-CE1 4.3Å; L721-F723 HydrophobicContact CB-CD2 4.46Å; L721-F723 HydrophobicContact CB-CE2 3.62Å; L721-F723 HydrophobicContact CB-CZ 4.23Å; L721-F723 WeakPolarHBondContact O-CD2 3.46Å; F723-F737 HydrophobicContact CB-CE1 4.41Å; F723-F737 HydrophobicContact CB-CZ 4.43Å; F723-F737 AromaticContact CD1-CE1 3.97Å; F723-F737 HydrophobicContact CD1-CE1 3.97Å; F723-F737 HydrophobicContact CD2-CE1 4.17Å; F723-F737 HydrophobicContact CE1-CE1 4.29Å; F723-F737 HydrophobicContact CE2-CE1 4.48Å; F723-F737 AromaticContact CG-CE1 3.91Å; F723-F737 HydrophobicContact CG-CE1 3.91Å; F723-F737 HydrophobicContact CG-CZ 4.38Å
724	S	88.9	Confident	81.5	Confident	21 Å²	21	55 Å²	55	15%	0.147	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	121.5	169.2	-172.2	0	0	0	0	108.1	D677 H726	D677-S724 PolarHBondContact N-O 3.23Å; D677-S724 PolarHBondContact O-N 2.95Å; S724-H726 WeakPolarHBondContact CB-NE2 3.42Å; S724-H726 PolarHBondContact OG-CE1 3.18Å; S724-H726 PolarHBondContact OG-NE2 3.42Å
725	V	85.9	Confident	81.5	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	121.9	-179.7	-179.7	0	0	0	0	108.8	N648 Q675 A676 L728 I735	N648-V725 PolarHBondContact N-O 3.14Å; N648-V725 VanDerWaalsContact N-O 3.08Å; N648-V725 PolarHBondContact O-N 3.44Å; Q675-V725 HydrophobicContact CB-CG1 4.47Å; Q675-V725 WeakPolarHBondContact O-CA 3.18Å; A676-V725 HydrophobicContact CB-CG2 4.12Å; V725-L728 HydrophobicContact CG1-CD1 4.08Å; V725-L728 HydrophobicContact CG1-CD2 3.7Å; V725-L728 HydrophobicContact CG1-CG 3.93Å; V725-I735 HydrophobicContact CB-CD1 4.34Å; V725-I735 HydrophobicContact CG1-CD1 3.46Å; V725-I735 VanDerWaalsContact CG1-CD1 3.46Å; V725-I735 HydrophobicContact CG2-CD1 4.13Å
726	H	80.3	Confident	81.6	Confident	52 Å²	52	53.3 Å²	53.3	24%	0.241	28%	0.279	C	S	.	.			trans	-118.3	155.1	-176.5	-60.5	-70.6	0	0	0	111.1	D647 Q675 D677 S724 L728	D647-H726 IonicContact OD1-CE1 2.88Å; D647-H726 IonicContact OD1-CG 3.79Å; D647-H726 IonicContact OD1-ND1 3.88Å; D647-H726 PolarHBondContact OD1-ND1 3.15Å; D647-H726 IonicContact OD2-CE1 3.31Å; D647-H726 PolarHBondContact OD2-CE1 2.97Å; D647-H726 IonicContact OD2-ND1 2.68Å; D647-H726 PolarHBondContact OD2-ND1 3.07Å; Q675-H726 WeakPolarHBondContact CB-O 3.39Å; Q675-H726 PolarHBondContact O-N 3.18Å; D677-H726 IonicContact OD2-CD2 2.74Å; S724-H726 WeakPolarHBondContact CB-NE2 3.42Å; S724-H726 PolarHBondContact OG-CE1 3.18Å; S724-H726 PolarHBondContact OG-NE2 3.42Å; H726-L728 PolarHBondContact O-N 2.98Å
727	Q	65.3	Low	81.6	Confident	187 Å²	187	49 Å²	49	87%	0.874	25%	0.253	S	S	*	.			trans	55.2	48.4	159.1	-150.2	170.8	9.9	0	0	114.5	S729	Q727-S729 PolarHBondContact O-N 2.65Å
728	L	66.6	Low	81.8	Confident	21 Å²	21	49.2 Å²	49.2	11%	0.11	25%	0.254	C	S	.	.			trans	-66.5	130.1	178.1	-69.3	162.4	0	0	0	111	I642 I644 Q675 V725 H726 I735 L760	I642-L728 HydrophobicContact CG2-CD1 4.05Å; I644-L728 HydrophobicContact CG2-CB 4.34Å; Q675-L728 HydrophobicContact CB-CD2 4.45Å; V725-L728 HydrophobicContact CG1-CD1 4.08Å; V725-L728 HydrophobicContact CG1-CD2 3.7Å; V725-L728 HydrophobicContact CG1-CG 3.93Å; H726-L728 PolarHBondContact O-N 2.98Å; L728-I735 HydrophobicContact CD1-CD1 4.5Å; L728-I735 HydrophobicContact CD2-CD1 3.61Å; L728-I735 HydrophobicContact CD2-CG1 4.02Å; L728-L760 HydrophobicContact CD1-CD2 3.67Å; L728-L760 HydrophobicContact CD2-CD1 4.17Å; L728-L760 HydrophobicContact CD2-CD2 4.2Å
729	S	65.9	Low	82	Confident	54 Å²	54	45.5 Å²	45.5	38%	0.378	24%	0.235	S	C	.	.			trans	-67.2	150.4	177	-176.6	0	0	0	0	110.8	Q727 E731 D732	Q727-S729 PolarHBondContact O-N 2.65Å; S729-E731 PolarHBondContact O-N 3.18Å; S729-E731 PolarHBondContact OG-N 3.08Å; S729-D732 WeakPolarHBondContact CB-OD2 3.39Å; S729-D732 PolarHBondContact N-OD2 3.28Å; S729-D732 PolarHBondContact O-N 3.46Å
730	E	66.9	Low	82.2	Confident	82 Å²	82	47.4 Å²	47.4	38%	0.383	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-13.6	176.4	-58.6	-176.8	166.2	0	0	112.4	R918 Y963	E730-R918 IonicContact OE1-CZ 3.79Å; E730-R918 IonicContact OE1-NH2 2.76Å; E730-R918 PolarHBondContact OE1-NH2 2.93Å; E730-Y963 HydrophobicContact CB-CD1 4.21Å; E730-Y963 HydrophobicContact CB-CE1 4.35Å; E730-Y963 HydrophobicContact CG-CD1 4.33Å; E730-Y963 HydrophobicContact CG-CE1 3.98Å
731	E	66	Low	82.3	Confident	161 Å²	161	44.6 Å²	44.6	75%	0.752	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-19	179.1	-60.4	-171.4	168.3	0	0	114.2	S729	S729-E731 PolarHBondContact O-N 3.18Å; S729-E731 PolarHBondContact OG-N 3.08Å
732	D	71.6	Confident	82.4	Confident	49 Å²	49	46.5 Å²	46.5	26%	0.262	24%	0.242	S	C	.	.			trans	-71.4	137.7	-176	-70.1	-31.8	0	0	0	110.5	Q675 S729 L760	Q675-D732 PolarHBondContact NE2-OD2 2.67Å; Q675-D732 VanDerWaalsContact NE2-OD2 3.1Å; S729-D732 WeakPolarHBondContact CB-OD2 3.39Å; S729-D732 PolarHBondContact N-OD2 3.28Å; S729-D732 PolarHBondContact O-N 3.46Å; D732-L760 HydrophobicContact CB-CD1 3.83Å; D732-L760 WeakPolarHBondContact O-CD1 3.41Å
733	T	78.2	Confident	82.3	Confident	72 Å²	72	46.7 Å²	46.7	44%	0.442	24%	0.242	S	C	.	.			trans	-109.9	-25.4	178.7	53.1	0	0	0	0	113.2	L760 N965	T733-L760 PolarHBondContact O-N 2.85Å; T733-L760 VanDerWaalsContact O-N 3.1Å; T733-N965 HydrophobicContact CG2-CB 4.23Å
734	S	84.4	Confident	81.9	Confident	51 Å²	51	48.6 Å²	48.6	36%	0.357	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	157.9	179.9	62.8	0	0	0	0	111	T758	S734-T758 CarbonylContact C-O 3.53Å; S734-T758 VanDerWaalsContact CA-O 3.32Å; S734-T758 WeakPolarHBondContact CA-O 3.46Å; S734-T758 WeakPolarHBondContact CB-O 3.31Å
735	I	86.8	Confident	81.6	Confident	9 Å²	9	47.9 Å²	47.9	5%	0.046	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	130.3	177.7	-55.7	178.7	0	0	0	107.8	I642 P673 V725 L728 F737 V757 T758 L760	I642-I735 HydrophobicContact CD1-CD1 4.03Å; P673-I735 HydrophobicContact CG-CG2 3.43Å; P673-I735 VanDerWaalsContact CG-CG2 3.43Å; V725-I735 HydrophobicContact CB-CD1 4.34Å; V725-I735 HydrophobicContact CG1-CD1 3.46Å; V725-I735 VanDerWaalsContact CG1-CD1 3.46Å; V725-I735 HydrophobicContact CG2-CD1 4.13Å; L728-I735 HydrophobicContact CD1-CD1 4.5Å; L728-I735 HydrophobicContact CD2-CD1 3.61Å; L728-I735 HydrophobicContact CD2-CG1 4.02Å; I735-F737 HydrophobicContact CG2-CD2 4.21Å; I735-F737 HydrophobicContact CG2-CE2 3.55Å; I735-F737 HydrophobicContact CG2-CZ 4.13Å; I735-V757 WeakPolarHBondContact O-CA 3.31Å; I735-T758 PolarHBondContact N-O 2.9Å; I735-T758 PolarHBondContact O-N 3.38Å; I735-L760 HydrophobicContact CD1-CD2 3.92Å; I735-L760 HydrophobicContact CG1-CD2 4.05Å; I735-L760 HydrophobicContact CG1-CG 4.44Å
736	K	89.2	Confident	81.3	Confident	102 Å²	102	54.9 Å²	54.9	44%	0.443	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	128	-178.5	-174.4	-178.5	-175.3	-122.8	0	110.7	P673 D738 S756 V757	P673-K736 WeakPolarHBondContact CD-O 3.3Å; K736-D738 WeakPolarHBondContact CE-OD1 3.28Å; K736-D738 IonicContact NZ-OD1 3.44Å; K736-D738 PolarHBondContact NZ-OD1 2.75Å; K736-D738 IonicContact NZ-OD2 3.62Å; K736-D738 PolarHBondContact NZ-OD2 3.11Å; K736-S756 WeakPolarHBondContact CA-O 3.45Å; K736-V757 HydrophobicContact CB-CG2 4.47Å; K736-V757 HydrophobicContact CG-CG2 4.17Å
737	F	90.3	Very high	81.3	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	125.9	169.4	-67.3	-96.6	0	0	0	109	L650 L652 P672 P673 A676 F723 I735 L739 S755 S756	L650-F737 HydrophobicContact CD2-CD2 4.24Å; L650-F737 HydrophobicContact CD2-CE2 3.37Å; L650-F737 HydrophobicContact CD2-CZ 3.79Å; L652-F737 HydrophobicContact CD1-CB 3.88Å; L652-F737 HydrophobicContact CD1-CD1 3.78Å; L652-F737 HydrophobicContact CD1-CD2 4.19Å; L652-F737 HydrophobicContact CD1-CE1 4.35Å; L652-F737 HydrophobicContact CD1-CG 3.68Å; P672-F737 HydrophobicContact CB-CD1 4.11Å; P672-F737 HydrophobicContact CB-CE1 3.9Å; P673-F737 HydrophobicContact CG-CZ 4.48Å; A676-F737 HydrophobicContact CB-CE1 4Å; A676-F737 HydrophobicContact CB-CZ 3.88Å; F723-F737 HydrophobicContact CB-CE1 4.41Å; F723-F737 HydrophobicContact CB-CZ 4.43Å; F723-F737 AromaticContact CD1-CE1 3.97Å; F723-F737 HydrophobicContact CD1-CE1 3.97Å; F723-F737 HydrophobicContact CD2-CE1 4.17Å; F723-F737 HydrophobicContact CE1-CE1 4.29Å; F723-F737 HydrophobicContact CE2-CE1 4.48Å; F723-F737 AromaticContact CG-CE1 3.91Å; F723-F737 HydrophobicContact CG-CE1 3.91Å; F723-F737 HydrophobicContact CG-CZ 4.38Å; I735-F737 HydrophobicContact CG2-CD2 4.21Å; I735-F737 HydrophobicContact CG2-CE2 3.55Å; I735-F737 HydrophobicContact CG2-CZ 4.13Å; F737-L739 HydrophobicContact CB-CD1 4.02Å; F737-S755 CarbonylContact O-C 3.48Å; F737-S755 VanDerWaalsContact O-CA 3.25Å; F737-S755 WeakPolarHBondContact O-CA 3.27Å; F737-S756 PolarHBondContact N-O 2.91Å; F737-S756 PolarHBondContact O-N 3.14Å
738	D	91.6	Very high	82.1	Confident	26 Å²	26	54.5 Å²	54.5	14%	0.139	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	133	175	-70.2	-34.3	0	0	0	110.3	Y671 K736 R753 S755	Y671-D738 HydrophobicContact CD2-CB 4.39Å; Y671-D738 WeakPolarHBondContact CD2-O 3.43Å; Y671-D738 PolarHBondContact N-O 3.31Å; Y671-D738 PolarHBondContact O-N 2.79Å; K736-D738 WeakPolarHBondContact CE-OD1 3.28Å; K736-D738 IonicContact NZ-OD1 3.44Å; K736-D738 PolarHBondContact NZ-OD1 2.75Å; K736-D738 IonicContact NZ-OD2 3.62Å; K736-D738 PolarHBondContact NZ-OD2 3.11Å; D738-R753 HydrophobicContact CB-CG 4.38Å; D738-R753 IonicContact OD2-CZ 2.82Å; D738-R753 IonicContact OD2-NE 2.78Å; D738-R753 IonicContact OD2-NH2 3.33Å; D738-S755 WeakPolarHBondContact OD1-CB 3.39Å
739	L	93.8	Very high	83	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	145.5	-177.8	-63.7	83.6	0	0	0	111.2	L633 V635 V654 H669 V670 F737 R753 V754	L633-L739 HydrophobicContact CD2-CB 3.67Å; V635-L739 HydrophobicContact CG1-CD1 4.11Å; V635-L739 HydrophobicContact CG1-CD2 4.28Å; V635-L739 HydrophobicContact CG2-CB 4.22Å; V635-L739 HydrophobicContact CG2-CD1 4.05Å; V635-L739 HydrophobicContact CG2-CD2 3.75Å; V635-L739 HydrophobicContact CG2-CG 4.21Å; V654-L739 HydrophobicContact CG1-CD2 4.41Å; V654-L739 HydrophobicContact CG2-CD2 3.68Å; H669-L739 CarbonylContact O-C 3.43Å; H669-L739 WeakPolarHBondContact O-CA 3.15Å; V670-L739 HydrophobicContact CB-CD2 4.4Å; V670-L739 HydrophobicContact CB-CG 4.22Å; V670-L739 HydrophobicContact CG1-CD1 4.37Å; V670-L739 HydrophobicContact CG1-CD2 4.17Å; V670-L739 HydrophobicContact CG1-CG 3.91Å; V670-L739 HydrophobicContact CG2-CD2 3.6Å; V670-L739 HydrophobicContact CG2-CG 3.86Å; F737-L739 HydrophobicContact CB-CD1 4.02Å; L739-R753 WeakPolarHBondContact O-CA 3.4Å; L739-V754 PolarHBondContact N-O 3.01Å; L739-V754 PolarHBondContact O-N 3.23Å
740	Q	93.2	Very high	84.1	Confident	42 Å²	42	57.1 Å²	57.1	20%	0.196	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	143.1	178.1	-172.1	171.8	22.1	0	0	111.4	H669 V742 S751	H669-Q740 PolarHBondContact N-O 3.45Å; H669-Q740 PolarHBondContact O-N 3.3Å; Q740-V742 HydrophobicContact CG-CG2 4.47Å; Q740-S751 WeakPolarHBondContact CG-O 3.44Å; Q740-S751 PolarHBondContact NE2-O 3.33Å
741	I	92.7	Very high	85.2	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	134.3	171.2	-52.4	172.8	0	0	0	109.2	L631 L633 A656 E667 L668 L707 T750 S751	L631-I741 HydrophobicContact CB-CB 4.47Å; L631-I741 HydrophobicContact CB-CG2 4.49Å; L631-I741 HydrophobicContact CD1-CB 4.4Å; L631-I741 HydrophobicContact CD1-CG2 3.84Å; L631-I741 HydrophobicContact CD2-CG2 4.34Å; L631-I741 HydrophobicContact CG-CG2 4.45Å; L633-I741 HydrophobicContact CB-CD1 4.11Å; L633-I741 HydrophobicContact CB-CG1 4.35Å; L633-I741 HydrophobicContact CD1-CD1 4.11Å; L633-I741 HydrophobicContact CD1-CG1 4.13Å; L633-I741 HydrophobicContact CD2-CG1 4.43Å; A656-I741 HydrophobicContact CB-CD1 3.69Å; E667-I741 CarbonylContact O-C 3.58Å; E667-I741 WeakPolarHBondContact O-CA 3.44Å; E667-I741 WeakPolarHBondContact O-CG2 3.35Å; L668-I741 HydrophobicContact CD1-CG1 4.1Å; L707-I741 HydrophobicContact CD1-CB 4.45Å; L707-I741 HydrophobicContact CD1-CD1 4.07Å; L707-I741 HydrophobicContact CD1-CG1 4.04Å; L707-I741 HydrophobicContact CD1-CG2 3.61Å; I741-T750 CarbonylContact O-C 3.54Å; I741-T750 VanDerWaalsContact O-CA 3.3Å; I741-T750 WeakPolarHBondContact O-CA 3.32Å; I741-S751 PolarHBondContact N-OG 3.2Å; I741-S751 PolarHBondContact O-N 3.1Å
742	V	91.3	Very high	86.4	Confident	40 Å²	40	50.4 Å²	50.4	24%	0.242	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	142.1	178.7	-175.9	0	0	0	0	109.4	A666 E667 Q740 N749 T750	A666-V742 WeakPolarHBondContact CA-O 3.41Å; E667-V742 PolarHBondContact N-O 3.4Å; E667-V742 PolarHBondContact O-N 2.93Å; Q740-V742 HydrophobicContact CG-CG2 4.47Å; V742-N749 CarbonylContact C-O 3.39Å; V742-T750 HydrophobicContact CG1-CG2 4.3Å; V742-T750 HydrophobicContact CG2-CG2 4.26Å
743	S	88.8	Confident	87.3	Confident	8 Å²	8	54.6 Å²	54.6	6%	0.056	28%	0.282	C	S	.	.			trans	-135	164	175.8	64	0	0	0	0	110.8	N745 N749	S743-N745 VanDerWaalsContact C-N 3.31Å; S743-N749 PolarHBondContact N-O 2.95Å; S743-N749 VanDerWaalsContact OG-CA 3.3Å; S743-N749 WeakPolarHBondContact OG-CA 3.06Å; S743-N749 PolarHBondContact OG-O 2.73Å
744	S	83.1	Confident	88	Confident	42 Å²	42	53 Å²	53	29%	0.294	27%	0.272	S	S	.	.	S	Bend	trans	-85.8	3.1	-179.5	60	0	0	0	0	114.2	Y664	Y664-S744 VanDerWaalsContact C-OG 3.31Å; Y664-S744 WeakPolarHBondContact CB-OG 3.4Å; Y664-S744 PolarHBondContact O-N 3.36Å; Y664-S744 PolarHBondContact O-OG 3.38Å
745	N	82.4	Confident	88.3	Confident	7 Å²	7	53.7 Å²	53.7	4%	0.037	28%	0.277	C	S	.	.			trans	-64.4	155.8	-179.2	-68.4	52	0	0	0	112	C627 P629 G662 Y664 S743 N749	C627-N745 WeakPolarHBondContact CB-ND2 3.46Å; C627-N745 PolarHBondContact O-ND2 3.21Å; P629-N745 HydrophobicContact CG-CB 4.27Å; G662-N745 PolarHBondContact O-ND2 3.5Å; Y664-N745 PolarHBondContact N-OD1 3.49Å; S743-N745 VanDerWaalsContact C-N 3.31Å; N745-N749 VanDerWaalsContact O-CB 3.23Å; N745-N749 WeakPolarHBondContact O-CB 3.22Å
746	Q	78.6	Confident	88.4	Confident	147 Å²	147	53.8 Å²	53.8	69%	0.687	28%	0.278	S	S	*	.	S	Bend	trans	-75.5	-28.4	178.1	-68.6	-178.8	0.6	0	0	113.3
747	F	80.3	Confident	88.4	Confident	102 Å²	102	52.7 Å²	52.7	45%	0.447	28%	0.28	S	S	.	.	S	Bend	trans	-125.7	143.4	-175.9	-63	-85.3	0	0	0	110.2	I626 K628 P629 N749	I626-F747 HydrophobicContact CG2-CD2 3.49Å; I626-F747 VanDerWaalsContact CG2-CD2 3.49Å; I626-F747 HydrophobicContact CG2-CE2 3.74Å; K628-F747 HydrophobicContact CG-CB 4.14Å; P629-F747 WeakPolarHBondContact CD-O 3.43Å; F747-N749 PolarHBondContact O-N 3.01Å
748	Q	82.3	Confident	88.2	Confident	129 Å²	129	52.7 Å²	52.7	60%	0.603	28%	0.28	S	S	*	.	S	Bend	trans	49.4	41.6	177.4	-65.6	-179.6	-28.8	0	0	113.4	P629 T750	P629-Q748 WeakPolarHBondContact O-CB 3.39Å; P629-Q748 PolarHBondContact O-OE1 3.22Å; Q748-T750 VanDerWaalsContact C-N 3.29Å; Q748-T750 PolarHBondContact O-N 2.93Å
749	N	84.9	Confident	88	Confident	65 Å²	65	57.2 Å²	57.2	35%	0.348	30%	0.3	S	S	.	.			trans	-76.8	-9.4	-168.8	63.7	-17.3	0	0	0	115	V742 S743 N745 F747	V742-N749 CarbonylContact C-O 3.39Å; S743-N749 PolarHBondContact N-O 2.95Å; S743-N749 VanDerWaalsContact OG-CA 3.3Å; S743-N749 WeakPolarHBondContact OG-CA 3.06Å; S743-N749 PolarHBondContact OG-O 2.73Å; N745-N749 VanDerWaalsContact O-CB 3.23Å; N745-N749 WeakPolarHBondContact O-CB 3.22Å; F747-N749 PolarHBondContact O-N 3.01Å
750	T	89.8	Confident	87.5	Confident	66 Å²	66	57.5 Å²	57.5	41%	0.405	30%	0.302	S	S	.	.	B	Isolated β-bridge	trans	-131.7	145.6	-177.3	58.8	0	0	0	0	112.8	I741 V742 Q748	I741-T750 CarbonylContact O-C 3.54Å; I741-T750 VanDerWaalsContact O-CA 3.3Å; I741-T750 WeakPolarHBondContact O-CA 3.32Å; V742-T750 HydrophobicContact CG1-CG2 4.3Å; V742-T750 HydrophobicContact CG2-CG2 4.26Å; Q748-T750 VanDerWaalsContact C-N 3.29Å; Q748-T750 PolarHBondContact O-N 2.93Å
751	S	90.3	Very high	86.9	Confident	3 Å²	3	57 Å²	57	2%	0.021	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-79.8	164.1	168.3	78.5	0	0	0	0	112.1	L631 Q740 I741	L631-S751 VanDerWaalsContact O-CB 3.28Å; L631-S751 WeakPolarHBondContact O-CB 3.34Å; Q740-S751 WeakPolarHBondContact CG-O 3.44Å; Q740-S751 PolarHBondContact NE2-O 3.33Å; I741-S751 PolarHBondContact N-OG 3.2Å; I741-S751 PolarHBondContact O-N 3.1Å
752	P	90.3	Very high	86.3	Confident	98 Å²	98	57.9 Å²	57.9	64%	0.636	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-58	146.9	163.4	-20.4	32.5	0	0	0	111.2
753	R	90.5	Very high	85.8	Confident	137 Å²	137	58.5 Å²	58.5	52%	0.517	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-79	129.2	176.6	-162.8	170.1	-171.2	178.5	-0.8	109.9	D738 L739	D738-R753 HydrophobicContact CB-CG 4.38Å; D738-R753 IonicContact OD2-CZ 2.82Å; D738-R753 IonicContact OD2-NE 2.78Å; D738-R753 IonicContact OD2-NH2 3.33Å; L739-R753 WeakPolarHBondContact O-CA 3.4Å
754	V	92.8	Very high	85.4	Confident	39 Å²	39	58.7 Å²	58.7	24%	0.236	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	130.1	-178.2	-179	0	0	0	0	109.2	L633 V635 L739	L633-V754 HydrophobicContact CB-CG2 4.27Å; L633-V754 HydrophobicContact CD2-CB 4.32Å; L633-V754 HydrophobicContact CD2-CG2 4.28Å; L633-V754 HydrophobicContact CG-CG2 4.35Å; V635-V754 HydrophobicContact CB-CG1 4.34Å; V635-V754 HydrophobicContact CG2-CB 4.49Å; V635-V754 HydrophobicContact CG2-CG1 4.13Å; L739-V754 PolarHBondContact N-O 3.01Å; L739-V754 PolarHBondContact O-N 3.23Å
755	S	90.9	Very high	85.5	Confident	66 Å²	66	62.6 Å²	62.6	46%	0.462	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	129.4	179.1	60.5	0	0	0	0	111.7	F737 D738	F737-S755 CarbonylContact O-C 3.48Å; F737-S755 VanDerWaalsContact O-CA 3.25Å; F737-S755 WeakPolarHBondContact O-CA 3.27Å; D738-S755 WeakPolarHBondContact OD1-CB 3.39Å
756	S	89.3	Confident	85.7	Confident	11 Å²	11	62.9 Å²	62.9	8%	0.077	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	125	168.2	-169.4	0	0	0	0	109.4	K736 F737	K736-S756 WeakPolarHBondContact CA-O 3.45Å; F737-S756 PolarHBondContact N-O 2.91Å; F737-S756 PolarHBondContact O-N 3.14Å
757	V	88.8	Confident	86.3	Confident	78 Å²	78	57 Å²	57	47%	0.473	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	121.4	-178.4	-177.7	0	0	0	0	109.3	I735 K736	I735-V757 WeakPolarHBondContact O-CA 3.31Å; K736-V757 HydrophobicContact CB-CG2 4.47Å; K736-V757 HydrophobicContact CG-CG2 4.17Å
758	T	87.5	Confident	86.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	128.6	175.6	-51.5	0	0	0	0	109.4	R639 I642 S734 I735	R639-T758 WeakPolarHBondContact O-CG2 3.03Å; I642-T758 HydrophobicContact CB-CG2 4.48Å; I642-T758 HydrophobicContact CD1-CG2 3.58Å; I642-T758 HydrophobicContact CG1-CG2 3.72Å; S734-T758 CarbonylContact C-O 3.53Å; S734-T758 VanDerWaalsContact CA-O 3.32Å; S734-T758 WeakPolarHBondContact CA-O 3.46Å; S734-T758 WeakPolarHBondContact CB-O 3.31Å; I735-T758 PolarHBondContact N-O 2.9Å; I735-T758 PolarHBondContact O-N 3.38Å
759	Q	86.3	Confident	87.3	Confident	121 Å²	121	53.1 Å²	53.1	57%	0.565	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	146.3	-178.5	-68.3	-175.7	-34.6	0	0	111.3	K640 K641 I642	K640-Q759 PolarHBondContact O-N 3.5Å; K641-Q759 VanDerWaalsContact CA-O 3.28Å; K641-Q759 WeakPolarHBondContact CA-O 3.46Å; I642-Q759 PolarHBondContact N-O 3.25Å
760	L	84.4	Confident	87.6	Confident	7 Å²	7	51.7 Å²	51.7	4%	0.037	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	144.5	172.4	-63.8	177.5	0	0	0	110.5	I642 I644 L728 D732 T733 I735 L966	I642-L760 HydrophobicContact CB-CD2 3.96Å; I642-L760 HydrophobicContact CG2-CD2 3.81Å; I642-L760 CarbonylContact O-C 3.51Å; I642-L760 WeakPolarHBondContact O-CA 3.26Å; I644-L760 HydrophobicContact CD1-CB 4.16Å; I644-L760 HydrophobicContact CD1-CD1 4.33Å; I644-L760 HydrophobicContact CG1-CB 4.13Å; I644-L760 HydrophobicContact CG1-CD1 4.32Å; I644-L760 HydrophobicContact CG1-CD2 4.49Å; L728-L760 HydrophobicContact CD1-CD2 3.67Å; L728-L760 HydrophobicContact CD2-CD1 4.17Å; L728-L760 HydrophobicContact CD2-CD2 4.2Å; D732-L760 HydrophobicContact CB-CD1 3.83Å; D732-L760 WeakPolarHBondContact O-CD1 3.41Å; T733-L760 PolarHBondContact O-N 2.85Å; T733-L760 VanDerWaalsContact O-N 3.1Å; I735-L760 HydrophobicContact CD1-CD2 3.92Å; I735-L760 HydrophobicContact CG1-CD2 4.05Å; I735-L760 HydrophobicContact CG1-CG 4.44Å; L760-L966 HydrophobicContact CB-CD1 4.46Å; L760-L966 WeakPolarHBondContact O-CD2 3.5Å
761	D	80.5	Confident	87.7	Confident	31 Å²	31	51.8 Å²	51.8	17%	0.166	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	165.2	177	-152.6	-10	0	0	0	110.2	K641 I642 Y643 I644	K641-D761 HydrophobicContact CB-CB 4.33Å; K641-D761 HydrophobicContact CD-CB 4.26Å; K641-D761 VanDerWaalsContact CD-OD2 3.31Å; K641-D761 WeakPolarHBondContact CD-OD2 3.15Å; K641-D761 WeakPolarHBondContact CE-OD2 3.44Å; K641-D761 IonicContact NZ-OD2 3.64Å; K641-D761 PolarHBondContact NZ-OD2 3.12Å; I642-D761 PolarHBondContact O-N 2.74Å; Y643-D761 VanDerWaalsContact CA-O 3.31Å; Y643-D761 WeakPolarHBondContact CA-O 3.25Å; Y643-D761 HydrophobicContact CD1-CB 4.14Å; Y643-D761 HydrophobicContact CE1-CB 4.11Å; I644-D761 PolarHBondContact N-O 2.88Å; I644-D761 VanDerWaalsContact N-O 3.12Å
762	I	80	Confident	87.7	Confident	19 Å²	19	52.6 Å²	52.6	10%	0.097	29%	0.286	C	S	.	.			trans	-116.4	135.4	-173.2	-61.7	162.6	0	0	0	109.5	M961 Y963 L966 T968	I762-M961 HydrophobicContact CG2-SD 3.58Å; I762-M961 VanDerWaalsContact CG2-SD 3.58Å; I762-Y963 VanDerWaalsContact CD1-CB 3.42Å; I762-Y963 HydrophobicContact CD1-CD2 3.62Å; I762-Y963 HydrophobicContact CD1-CG 3.77Å; I762-Y963 HydrophobicContact CG1-CD2 3.9Å; I762-Y963 HydrophobicContact CG1-CG 4.21Å; I762-Y963 HydrophobicContact CG2-CD2 4.12Å; I762-Y963 HydrophobicContact CG2-CE2 4.31Å; I762-L966 HydrophobicContact CD1-CB 3.44Å; I762-L966 VanDerWaalsContact CD1-CB 3.44Å; I762-L966 HydrophobicContact CD1-CD1 3.82Å; I762-L966 HydrophobicContact CD1-CG 4.27Å; I762-L966 HydrophobicContact CG1-CB 4.27Å; I762-L966 HydrophobicContact CG1-CD1 3.92Å; I762-T968 HydrophobicContact CB-CG2 4.45Å; I762-T968 HydrophobicContact CD1-CG2 3.49Å; I762-T968 VanDerWaalsContact CD1-CG2 3.49Å; I762-T968 HydrophobicContact CG2-CG2 4.34Å
763	L	81	Confident	87.5	Confident	52 Å²	52	51.7 Å²	51.7	27%	0.272	28%	0.282	S	S	.	.			trans	-138.8	93.2	176	-174.4	67.9	0	0	0	109.9	Y643 K765 P811 S812	Y643-L763 HydrophobicContact CD1-CB 3.53Å; Y643-L763 HydrophobicContact CD1-CD2 4.42Å; Y643-L763 HydrophobicContact CD2-CD2 4.47Å; Y643-L763 HydrophobicContact CE1-CB 3.86Å; Y643-L763 HydrophobicContact CE1-CD2 4.35Å; Y643-L763 HydrophobicContact CE2-CD2 4.4Å; Y643-L763 HydrophobicContact CG-CB 4.06Å; Y643-L763 HydrophobicContact CG-CD2 4.47Å; L763-K765 HydrophobicContact CD1-CG 4.43Å; L763-K765 HydrophobicContact CG-CG 4.35Å; L763-P811 HydrophobicContact CB-CG 4.13Å; L763-P811 HydrophobicContact CD2-CG 4.46Å; L763-P811 WeakPolarHBondContact O-CD 3.45Å; L763-P811 WeakPolarHBondContact O-CG 3.23Å; L763-S812 PolarHBondContact N-OG 3.13Å; L763-S812 PolarHBondContact O-N 2.96Å; L763-S812 PolarHBondContact O-OG 2.79Å
764	A	79.4	Confident	87.3	Confident	13 Å²	13	47.8 Å²	47.8	11%	0.107	28%	0.275	C	S	.	.			trans	-95	120.8	170.2	0	0	0	0	0	109.6	M961 P971	A764-M961 HydrophobicContact CB-CE 4Å; A764-M961 HydrophobicContact CB-SD 4.21Å; A764-P971 HydrophobicContact CB-CG 4.2Å
765	K	84.5	Confident	86.8	Confident	124 Å²	124	49.9 Å²	49.9	54%	0.539	29%	0.291	S	S	.	.			trans	-117.4	84.9	176.5	-71.5	-176.1	179.1	176	0	109.4	L763 N809 G810	L763-K765 HydrophobicContact CD1-CG 4.43Å; L763-K765 HydrophobicContact CG-CG 4.35Å; K765-N809 WeakPolarHBondContact O-CA 3.36Å; K765-N809 WeakPolarHBondContact O-CB 3.31Å; K765-N809 PolarHBondContact O-N 2.85Å; K765-G810 PolarHBondContact O-N 2.91Å
766	A	87.9	Confident	86.5	Confident	13 Å²	13	51.2 Å²	51.2	11%	0.107	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	141.8	174.7	0	0	0	0	0	111.1	L806 L807 F814 F956 P971	A766-L806 HydrophobicContact CB-CD1 4.46Å; A766-L807 CarbonylContact C-O 3.34Å; A766-L807 WeakPolarHBondContact CA-O 3.29Å; A766-F814 HydrophobicContact CB-CE1 4.13Å; A766-F956 HydrophobicContact CB-CD2 4.37Å; A766-F956 HydrophobicContact CB-CE2 3.37Å; A766-F956 HydrophobicContact CB-CZ 3.47Å; A766-F956 VanDerWaalsContact CB-CZ 3.47Å; A766-F956 WeakPolarHBondContact O-CZ 3.4Å; A766-P971 HydrophobicContact CB-CG 4.25Å
767	S	90.2	Very high	86.3	Confident	23 Å²	23	51.2 Å²	51.2	16%	0.161	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	137.6	172.7	66.1	0	0	0	0	109.9	L807 N809	S767-L807 PolarHBondContact N-O 2.85Å; S767-L807 PolarHBondContact O-N 2.86Å; S767-N809 PolarHBondContact OG-ND2 2.8Å
768	I	92.3	Very high	85.9	Confident	8 Å²	8	52.2 Å²	52.2	4%	0.041	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	142.7	170.9	-171.5	169.6	0	0	0	109.4	E805 L806 L819 A954 F956 T975	I768-E805 CarbonylContact C-O 3.59Å; I768-E805 VanDerWaalsContact CA-O 3.29Å; I768-E805 WeakPolarHBondContact CA-O 3.29Å; I768-L806 HydrophobicContact CB-CD1 4.32Å; I768-L819 HydrophobicContact CD1-CD1 3.79Å; I768-L819 HydrophobicContact CD1-CG 4.35Å; I768-A954 HydrophobicContact CD1-CB 3.7Å; I768-F956 HydrophobicContact CB-CD1 3.6Å; I768-F956 HydrophobicContact CB-CE1 3.86Å; I768-F956 HydrophobicContact CD1-CD1 4.43Å; I768-F956 HydrophobicContact CG2-CD1 3.59Å; I768-F956 HydrophobicContact CG2-CE1 3.76Å; I768-T975 HydrophobicContact CG2-CG2 3.78Å; I768-T975 WeakPolarHBondContact CG2-OG1 3.41Å; I768-T975 WeakPolarHBondContact O-CG2 3.26Å
769	R	91.8	Very high	85.3	Confident	141 Å²	141	52.3 Å²	52.3	53%	0.532	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	148.4	175.1	-64.7	-179.9	-179.5	178.9	1.5	108.9	Y804 E805	R769-Y804 CarbonylContact O-C 3.59Å; R769-Y804 WeakPolarHBondContact O-CA 3.43Å; R769-E805 PolarHBondContact N-O 3.3Å; R769-E805 PolarHBondContact O-N 2.74Å
770	G	91.1	Very high	84.7	Confident	35 Å²	35	50.5 Å²	50.5	36%	0.361	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	144.9	179.5	0	0	0	0	0	111.6	V803 V977	G770-V803 CarbonylContact C-O 3.57Å; G770-V803 VanDerWaalsContact CA-O 3.23Å; G770-V803 WeakPolarHBondContact CA-O 3.45Å; G770-V977 VanDerWaalsContact C-CG2 3.42Å; G770-V977 VanDerWaalsContact CA-CG2 3.43Å
771	S	91.3	Very high	84.1	Confident	68 Å²	68	52.7 Å²	52.7	48%	0.476	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	154.4	173.9	67	0	0	0	0	111.5	H802 V803	S771-H802 WeakPolarHBondContact O-CA 3.43Å; S771-V803 PolarHBondContact N-O 2.94Å; S771-V803 PolarHBondContact O-N 2.99Å
772	S	90.1	Very high	83.6	Confident	20 Å²	20	55.3 Å²	55.3	14%	0.14	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	136.2	174.1	-174.1	0	0	0	0	111.1	P774 S775 L801 H802 V979	S772-P774 PolarHBondContact OG-O 3.13Å; S772-S775 PolarHBondContact O-N 2.79Å; S772-L801 CarbonylContact C-O 3.55Å; S772-L801 WeakPolarHBondContact CA-O 3.25Å; S772-H802 VanDerWaalsContact CB-CD2 3.49Å; S772-H802 WeakPolarHBondContact CB-CD2 3.36Å; S772-H802 WeakPolarHBondContact CB-NE2 3.47Å; S772-H802 PolarHBondContact OG-CD2 2.8Å; S772-H802 PolarHBondContact OG-NE2 3.23Å; S772-V979 WeakPolarHBondContact OG-CG2 3.31Å
773	S	87.6	Confident	83	Confident	79 Å²	79	62.2 Å²	62.2	55%	0.552	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.4	111.2	175.3	-173.3	0	0	0	0	109.5	L801	S773-L801 PolarHBondContact N-O 3.31Å; S773-L801 PolarHBondContact O-N 3.43Å
774	P	85.5	Confident	82.7	Confident	56 Å²	56	62 Å²	62	36%	0.364	36%	0.361	S	S	.	.	S	Bend	cis	-78.6	152.5	-3.9	33.5	-35.5	0	0	0	113.4	S772 Q776 V777 Q799	S772-P774 PolarHBondContact OG-O 3.13Å; P774-Q776 VanDerWaalsContact C-N 3.29Å; P774-Q776 PolarHBondContact O-N 2.82Å; P774-V777 HydrophobicContact CG-CG2 4.06Å; P774-Q799 WeakPolarHBondContact CD-O 3.39Å
775	S	82.7	Confident	82.4	Confident	82 Å²	82	69.2 Å²	69.2	57%	0.573	39%	0.389	S	S	*	.	S	Bend	trans	-75.5	-15.4	176.4	61.4	0	0	0	0	114.2	S772 S980	S772-S775 PolarHBondContact O-N 2.79Å; S775-S980 PolarHBondContact O-N 3.1Å; S775-S980 VanDerWaalsContact O-N 3.1Å; S775-S980 PolarHBondContact O-OG 3.42Å
776	Q	84.6	Confident	81.9	Confident	95 Å²	95	67.1 Å²	67.1	44%	0.444	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	139.8	178.5	-178.4	171.5	16.4	0	0	110.8	P774 L778 S980 T982	P774-Q776 VanDerWaalsContact C-N 3.29Å; P774-Q776 PolarHBondContact O-N 2.82Å; Q776-L778 HydrophobicContact CG-CD2 4.18Å; Q776-S980 CarbonylContact C-O 3.55Å; Q776-S980 VanDerWaalsContact CA-O 3.25Å; Q776-S980 WeakPolarHBondContact CA-O 3.32Å; Q776-S980 VanDerWaalsContact CB-OG 3.3Å; Q776-S980 WeakPolarHBondContact CB-OG 3.35Å; Q776-S980 VanDerWaalsContact CG-OG 3.25Å; Q776-S980 WeakPolarHBondContact CG-OG 3.45Å; Q776-T982 PolarHBondContact NE2-OG1 2.74Å
777	V	83.9	Confident	81.3	Confident	11 Å²	11	71.8 Å²	71.8	7%	0.067	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	131.3	173.3	-178.3	0	0	0	0	109.3	P774 P798 I800 L933 V979 S980 V981 T982	P774-V777 HydrophobicContact CG-CG2 4.06Å; V777-P798 HydrophobicContact CG1-CG 3.97Å; V777-I800 HydrophobicContact CG2-CD1 4.3Å; V777-L933 HydrophobicContact CB-CD2 4.2Å; V777-L933 HydrophobicContact CG1-CD2 3.83Å; V777-L933 HydrophobicContact CG2-CD2 4.42Å; V777-V979 HydrophobicContact CG2-CG1 4.2Å; V777-S980 PolarHBondContact N-O 3.35Å; V777-V981 WeakPolarHBondContact O-CA 3.45Å; V777-T982 PolarHBondContact O-N 3.25Å
778	L	81.3	Confident	80.6	Confident	99 Å²	99	77.4 Å²	77.4	52%	0.518	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	130.4	178.6	-56.8	-179.1	0	0	0	110.3	Q776 T982 V984	Q776-L778 HydrophobicContact CG-CD2 4.18Å; L778-T982 WeakPolarHBondContact CA-O 3.15Å; L778-T982 WeakPolarHBondContact CD2-OG1 3.44Å; L778-V984 HydrophobicContact CB-CG2 4.31Å; L778-V984 HydrophobicContact CD1-CG2 4.48Å; L778-V984 HydrophobicContact CD2-CG2 4.4Å
779	L	75.7	Confident	79.4	Confident	1 Å²	1	82.3 Å²	82.3	1%	0.005	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	146.2	173.4	-63.5	-178.4	0	0	0	110.5	I781 V935 F938 V981 T982 W983 V984	L779-I781 HydrophobicContact CD2-CD1 4.06Å; L779-I781 HydrophobicContact CD2-CG1 3.64Å; L779-V935 HydrophobicContact CD2-CG1 4.1Å; L779-F938 HydrophobicContact CD1-CB 3.54Å; L779-F938 HydrophobicContact CD1-CG 4.08Å; L779-V981 HydrophobicContact CD1-CG1 3.53Å; L779-V981 HydrophobicContact CG-CG1 3.9Å; L779-T982 PolarHBondContact N-O 3.02Å; L779-W983 HydrophobicContact CB-CD2 3.99Å; L779-W983 HydrophobicContact CB-CE3 4.11Å; L779-W983 HydrophobicContact CB-CG 4.49Å; L779-W983 HydrophobicContact CB-CH2 4.44Å; L779-W983 HydrophobicContact CB-CZ2 4.28Å; L779-W983 HydrophobicContact CB-CZ3 4.35Å; L779-W983 HydrophobicContact CD1-CZ2 3.95Å; L779-W983 WeakPolarHBondContact O-CA 3.38Å; L779-V984 PolarHBondContact O-N 2.98Å
780	P	72.5	Confident	78.6	Confident	84 Å²	84	76.9 Å²	76.9	55%	0.545	45%	0.45	S	S	.	.	S	Bend	cis	-78.4	150.2	0.3	31.8	-34.7	0	0	0	113.4
781	I	73.3	Confident	77.8	Confident	53 Å²	53	79.7 Å²	79.7	27%	0.272	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-80.2	125.7	178	-53.4	-175.7	0	0	0	109.5	L779 N783 W784 P798 V935	L779-I781 HydrophobicContact CD2-CD1 4.06Å; L779-I781 HydrophobicContact CD2-CG1 3.64Å; I781-N783 PolarHBondContact O-N 3.45Å; I781-W784 HydrophobicContact CB-CB 3.96Å; I781-W784 HydrophobicContact CG2-CB 4.09Å; I781-W784 PolarHBondContact O-N 3.08Å; I781-P798 VanDerWaalsContact CD1-CD 3.41Å; I781-P798 HydrophobicContact CD1-CG 3.73Å; I781-V935 HydrophobicContact CD1-CG1 4.41Å; I781-V935 HydrophobicContact CD1-CG2 3.58Å
782	A	68.7	Low	77.1	Confident	85 Å²	85	79.8 Å²	79.8	70%	0.702	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	131.8	178.2	0	0	0	0	0	111.2	W784	A782-W784 PolarHBondContact O-N 2.92Å
783	N	68.3	Low	76.1	Confident	165 Å²	165	78.8 Å²	78.8	88%	0.882	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	7.1	176.8	-51.8	-41	0	0	0	116.9	I781	I781-N783 PolarHBondContact O-N 3.45Å
784	W	74.6	Confident	75.6	Confident	48 Å²	48	79 Å²	79	18%	0.182	44%	0.443	C	S	.	.			trans	-80.2	136.8	176.2	-172.9	88.7	0	0	0	111.5	I781 A782 P786 D794 D795 I796 V935 N936 L939	I781-W784 HydrophobicContact CB-CB 3.96Å; I781-W784 HydrophobicContact CG2-CB 4.09Å; I781-W784 PolarHBondContact O-N 3.08Å; A782-W784 PolarHBondContact O-N 2.92Å; W784-P786 HydrophobicContact CH2-CB 4.01Å; W784-P786 HydrophobicContact CZ3-CB 4.23Å; W784-D794 PolarHBondContact NE1-O 2.99Å; W784-D795 WeakPolarHBondContact CZ2-O 3.38Å; W784-D795 PolarHBondContact NE1-O 3.25Å; W784-I796 WeakPolarHBondContact CZ2-O 3.2Å; W784-V935 HydrophobicContact CD2-CB 4.2Å; W784-V935 HydrophobicContact CD2-CG1 4.05Å; W784-V935 HydrophobicContact CE3-CB 4.31Å; W784-V935 HydrophobicContact CE3-CG1 3.83Å; W784-V935 HydrophobicContact CH2-CB 3.9Å; W784-V935 HydrophobicContact CH2-CG1 4.15Å; W784-V935 HydrophobicContact CZ2-CB 3.78Å; W784-V935 HydrophobicContact CZ2-CG1 4.35Å; W784-V935 HydrophobicContact CZ3-CB 4.18Å; W784-V935 HydrophobicContact CZ3-CG1 3.91Å; W784-N936 HydrophobicContact CH2-CB 4.1Å; W784-L939 HydrophobicContact CE3-CD1 3.81Å; W784-L939 HydrophobicContact CH2-CD1 4.2Å; W784-L939 HydrophobicContact CZ3-CD1 3.28Å
785	K	73.6	Confident	75.2	Confident	163 Å²	163	77.2 Å²	77.2	71%	0.709	43%	0.43	S	S	*	.			trans	-137.7	140.6	176.1	-67.5	-176.6	-178.8	178.7	0	109.9	K787	K785-K787 PolarHBondContact O-N 3.33Å
786	P	73.7	Confident	74.9	Confident	80 Å²	80	74 Å²	74	52%	0.519	41%	0.406	S	S	.	.			trans	-66.6	131.2	179.3	26.8	-33.1	0	0	0	110.9	W784	W784-P786 HydrophobicContact CH2-CB 4.01Å; W784-P786 HydrophobicContact CZ3-CB 4.23Å
787	K	74.3	Confident	74.8	Confident	111 Å²	111	69.6 Å²	69.6	48%	0.483	39%	0.386	S	S	.	.			trans	-119.5	132.5	172.3	-65.7	-172.1	-163.9	154.5	0	110.2	K785 D795	K785-K787 PolarHBondContact O-N 3.33Å; K787-D795 HydrophobicContact CB-CB 4.43Å; K787-D795 HydrophobicContact CD-CB 4.49Å; K787-D795 WeakPolarHBondContact CD-OD1 3.1Å; K787-D795 WeakPolarHBondContact CE-OD1 3.49Å; K787-D795 IonicContact NZ-OD1 3.99Å; K787-D795 PolarHBondContact NZ-OD1 3.06Å; K787-D795 IonicContact NZ-OD2 3.36Å
788	N	75.8	Confident	74.8	Confident	142 Å²	142	70.8 Å²	70.8	76%	0.759	40%	0.395	S	S	*	.	S	Bend	trans	-128.1	117.1	179.4	-69.7	-25	0	0	0	110.1
789	P	68.1	Low	75	Confident	110 Å²	110	69.2 Å²	69.2	71%	0.714	38%	0.384	S	S	*	.	S	Bend	cis	-75.9	149.9	-6.3	31.9	-34	0	0	0	112.7
790	P	74.8	Confident	75.6	Confident	27 Å²	27	69.1 Å²	69.1	18%	0.175	38%	0.384	C	S	.	.			trans	-70.3	139	172.4	29.6	-33.5	0	0	0	110.6	D795 I796 L855	P790-D795 HydrophobicContact CB-CB 3.81Å; P790-I796 HydrophobicContact CB-CG1 3.95Å; P790-I796 HydrophobicContact CG-CD1 4.46Å; P790-I796 HydrophobicContact CG-CG1 4.15Å; P790-L855 HydrophobicContact CG-CD1 4.21Å
791	V	74.4	Confident	76.4	Confident	95 Å²	95	67 Å²	67	58%	0.576	37%	0.368	S	S	*	.			trans	-115.1	-33.9	180	-177.9	0	0	0	0	111.3	D795 S858	V791-D795 PolarHBondContact N-OD2 2.79Å; V791-D795 VanDerWaalsContact N-OD2 3.11Å; V791-S858 PolarHBondContact O-N 2.83Å; V791-S858 VanDerWaalsContact O-N 3.16Å; V791-S858 PolarHBondContact O-OG 2.82Å; V791-S858 VanDerWaalsContact O-OG 3.05Å
792	L	75.7	Confident	77.3	Confident	69 Å²	69	64.5 Å²	64.5	36%	0.361	36%	0.355	S	S	.	.	B	Isolated β-bridge	trans	-107.5	148.3	177	-75.1	152.3	0	0	0	111	D794 D795 V857	L792-D794 PolarHBondContact O-N 3.25Å; L792-D794 VanDerWaalsContact O-N 3.13Å; L792-D795 PolarHBondContact N-OD2 3.17Å; L792-D795 VanDerWaalsContact O-CB 3.24Å; L792-D795 WeakPolarHBondContact O-CB 3.35Å; L792-D795 PolarHBondContact O-N 2.93Å; L792-V857 WeakPolarHBondContact O-CG1 3.13Å
793	G	68.5	Low	78.4	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-56.1	-32.4	178.3	0	0	0	0	0	113	D795 I796 G797 S858 R932	G793-D795 VanDerWaalsContact C-N 3.27Å; G793-D795 PolarHBondContact O-N 3.07Å; G793-I796 PolarHBondContact O-N 2.88Å; G793-G797 PolarHBondContact O-N 3.01Å; G793-S858 PolarHBondContact N-O 3.44Å; G793-R932 WeakPolarHBondContact O-CD 3.27Å
794	D	77.2	Confident	79.6	Confident	83 Å²	83	54 Å²	54	44%	0.444	29%	0.288	S	S	.	.	H	α-helix	trans	-70.8	-20.4	177.9	-59.4	-26.5	0	0	0	113.2	W784 L792 I796 G797 R932	W784-D794 PolarHBondContact NE1-O 2.99Å; L792-D794 PolarHBondContact O-N 3.25Å; L792-D794 VanDerWaalsContact O-N 3.13Å; D794-I796 PolarHBondContact O-N 2.74Å; D794-G797 PolarHBondContact O-N 3.16Å; D794-R932 IonicContact OD1-CZ 3.94Å; D794-R932 IonicContact OD1-NH1 2.66Å; D794-R932 PolarHBondContact OD1-NH1 3.31Å; D794-R932 IonicContact OD1-NH2 2.71Å; D794-R932 PolarHBondContact OD1-NH2 3.35Å
795	D	77.6	Confident	80.5	Confident	18 Å²	18	54.2 Å²	54.2	10%	0.096	29%	0.291	C	S	.	.	H	α-helix	trans	-68.9	-24.5	174.7	-62.6	-31.6	0	0	0	111.5	W784 K787 P790 V791 L792 G793	W784-D795 WeakPolarHBondContact CZ2-O 3.38Å; W784-D795 PolarHBondContact NE1-O 3.25Å; K787-D795 HydrophobicContact CB-CB 4.43Å; K787-D795 HydrophobicContact CD-CB 4.49Å; K787-D795 WeakPolarHBondContact CD-OD1 3.1Å; K787-D795 WeakPolarHBondContact CE-OD1 3.49Å; K787-D795 IonicContact NZ-OD1 3.99Å; K787-D795 PolarHBondContact NZ-OD1 3.06Å; K787-D795 IonicContact NZ-OD2 3.36Å; P790-D795 HydrophobicContact CB-CB 3.81Å; V791-D795 PolarHBondContact N-OD2 2.79Å; V791-D795 VanDerWaalsContact N-OD2 3.11Å; L792-D795 PolarHBondContact N-OD2 3.17Å; L792-D795 VanDerWaalsContact O-CB 3.24Å; L792-D795 WeakPolarHBondContact O-CB 3.35Å; L792-D795 PolarHBondContact O-N 2.93Å; G793-D795 VanDerWaalsContact C-N 3.27Å; G793-D795 PolarHBondContact O-N 3.07Å
796	I	77.1	Confident	81.4	Confident	14 Å²	14	46.4 Å²	46.4	7%	0.072	26%	0.257	C	S	.	.	H	α-helix	trans	-83.6	-47.7	174.3	-62.2	175.4	0	0	0	110.1	W784 P790 G793 D794 Y834 V857 R932 L933 D934 V935	W784-I796 WeakPolarHBondContact CZ2-O 3.2Å; P790-I796 HydrophobicContact CB-CG1 3.95Å; P790-I796 HydrophobicContact CG-CD1 4.46Å; P790-I796 HydrophobicContact CG-CG1 4.15Å; G793-I796 PolarHBondContact O-N 2.88Å; D794-I796 PolarHBondContact O-N 2.74Å; I796-Y834 HydrophobicContact CD1-CD1 3.81Å; I796-Y834 HydrophobicContact CD1-CE1 3.98Å; I796-Y834 HydrophobicContact CD1-CG 4.25Å; I796-V857 HydrophobicContact CD1-CG2 4.03Å; I796-R932 HydrophobicContact CB-CB 4.36Å; I796-R932 HydrophobicContact CG2-CB 4.03Å; I796-L933 CarbonylContact C-O 3.55Å; I796-D934 HydrophobicContact CG2-CB 4.17Å; I796-V935 PolarHBondContact O-N 2.81Å
797	G	82.3	Confident	82.2	Confident	3 Å²	3	43.7 Å²	43.7	3%	0.031	24%	0.238	C	C	.	.			trans	157.8	-166.6	177.8	0	0	0	0	0	115.1	G793 D794 R932 L933	G793-G797 PolarHBondContact O-N 3.01Å; D794-G797 PolarHBondContact O-N 3.16Å; G797-R932 WeakPolarHBondContact O-CD 3.43Å; G797-R932 PolarHBondContact O-NH1 3.24Å; G797-L933 WeakPolarHBondContact CA-O 3.49Å
798	P	84.6	Confident	82.9	Confident	37 Å²	37	38.4 Å²	38.4	24%	0.24	22%	0.215	C	C	.	.			trans	-67.2	146.7	-175.8	28.1	-34	0	0	0	111.2	V777 I781 R932 L933	V777-P798 HydrophobicContact CG1-CG 3.97Å; I781-P798 VanDerWaalsContact CD1-CD 3.41Å; I781-P798 HydrophobicContact CD1-CG 3.73Å; P798-R932 WeakPolarHBondContact O-CA 3.47Å; P798-L933 HydrophobicContact CG-CB 4.03Å; P798-L933 HydrophobicContact CG-CD2 4.38Å; P798-L933 PolarHBondContact O-N 2.94Å; P798-L933 VanDerWaalsContact O-N 3.07Å
799	Q	84.7	Confident	83.4	Confident	65 Å²	65	35.1 Å²	35.1	30%	0.304	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	134.5	174.8	-168.1	172.8	-44.6	0	0	111	P774 S931	P774-Q799 WeakPolarHBondContact CD-O 3.39Å; Q799-S931 CarbonylContact C-O 3.56Å; Q799-S931 WeakPolarHBondContact CA-O 3.44Å
800	I	88.7	Confident	84.1	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	119.1	174.5	-66.5	168.7	0	0	0	107.2	V777 L833 S931 L933 V979	V777-I800 HydrophobicContact CG2-CD1 4.3Å; I800-L833 HydrophobicContact CD1-CD2 3.41Å; I800-L833 VanDerWaalsContact CD1-CD2 3.41Å; I800-S931 PolarHBondContact N-O 3.17Å; I800-S931 PolarHBondContact O-N 2.81Å; I800-S931 PolarHBondContact O-OG 2.84Å; I800-L933 HydrophobicContact CD1-CB 3.79Å; I800-L933 HydrophobicContact CD1-CD1 4.08Å; I800-L933 HydrophobicContact CD1-CG 4.41Å; I800-V979 HydrophobicContact CD1-CG1 4.11Å; I800-V979 HydrophobicContact CG2-CG2 3.91Å
801	L	89.4	Confident	84.4	Confident	38 Å²	38	29.3 Å²	29.3	20%	0.199	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	119	175.3	172.8	63.1	0	0	0	109.3	S772 S773 V803 F928 I929 Y930	S772-L801 CarbonylContact C-O 3.55Å; S772-L801 WeakPolarHBondContact CA-O 3.25Å; S773-L801 PolarHBondContact N-O 3.31Å; S773-L801 PolarHBondContact O-N 3.43Å; L801-V803 HydrophobicContact CD1-CG2 4.2Å; L801-V803 HydrophobicContact CD2-CG2 3.94Å; L801-V803 HydrophobicContact CG-CG2 3.79Å; L801-F928 HydrophobicContact CD1-CB 4.14Å; L801-F928 HydrophobicContact CD1-CD1 4.35Å; L801-I929 WeakPolarHBondContact CA-O 3.36Å; L801-Y930 HydrophobicContact CD1-CD1 3.84Å; L801-Y930 HydrophobicContact CD1-CE1 3.75Å; L801-Y930 HydrophobicContact CD1-CG 4.35Å
802	H	91.3	Very high	84.9	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.005	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	129.8	167	-76	-160.6	0	0	0	109.2	S771 S772 Y804 W823 I929 S952 V979	S771-H802 WeakPolarHBondContact O-CA 3.43Å; S772-H802 VanDerWaalsContact CB-CD2 3.49Å; S772-H802 WeakPolarHBondContact CB-CD2 3.36Å; S772-H802 WeakPolarHBondContact CB-NE2 3.47Å; S772-H802 PolarHBondContact OG-CD2 2.8Å; S772-H802 PolarHBondContact OG-NE2 3.23Å; H802-Y804 HydrophobicContact CB-CE2 4.19Å; H802-W823 HydrophobicContact CB-CH2 3.99Å; H802-W823 HydrophobicContact CB-CZ3 3.85Å; H802-W823 AromaticContact CE1-CH2 3.83Å; H802-W823 AromaticContact CE1-CZ3 3.99Å; H802-W823 AromaticContact CG-CH2 3.59Å; H802-W823 AromaticContact CG-CZ3 3.66Å; H802-W823 AromaticContact ND1-CH2 3.37Å; H802-W823 WeakPolarHBondContact ND1-CH2 3.17Å; H802-W823 AromaticContact ND1-CZ3 3.2Å; H802-W823 WeakPolarHBondContact ND1-CZ3 3.34Å; H802-I929 HydrophobicContact CB-CB 4.4Å; H802-I929 PolarHBondContact N-O 2.88Å; H802-I929 PolarHBondContact O-N 3.46Å; H802-S952 PolarHBondContact CE1-OG 3.19Å; H802-S952 VanDerWaalsContact CE1-OG 3.29Å; H802-S952 PolarHBondContact ND1-OG 3.18Å; H802-V979 WeakPolarHBondContact NE2-CG2 3.46Å
803	V	92.1	Very high	85.3	Confident	29 Å²	29	22.3 Å²	22.3	18%	0.176	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	125.8	178.5	-172.5	0	0	0	0	108.7	G770 S771 L801 I926 L927 F928	G770-V803 CarbonylContact C-O 3.57Å; G770-V803 VanDerWaalsContact CA-O 3.23Å; G770-V803 WeakPolarHBondContact CA-O 3.45Å; S771-V803 PolarHBondContact N-O 2.94Å; S771-V803 PolarHBondContact O-N 2.99Å; L801-V803 HydrophobicContact CD1-CG2 4.2Å; L801-V803 HydrophobicContact CD2-CG2 3.94Å; L801-V803 HydrophobicContact CG-CG2 3.79Å; V803-I926 HydrophobicContact CG1-CG2 3.62Å; V803-L927 WeakPolarHBondContact CA-O 3.38Å; V803-F928 HydrophobicContact CB-CD1 4.4Å; V803-F928 HydrophobicContact CG1-CD1 3.93Å; V803-F928 HydrophobicContact CG1-CE1 3.75Å; V803-F928 HydrophobicContact CG1-CZ 4.47Å; V803-F928 HydrophobicContact CG2-CD1 3.75Å; V803-F928 HydrophobicContact CG2-CE1 4.05Å
804	Y	93.4	Very high	86.2	Confident	1 Å²	1	22.3 Å²	22.3	0%	0.004	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	125.4	174.4	-68.4	-77.2	0	0	0	110.2	R769 H802 V821 I926 L927 I929 S952 A954 V977	R769-Y804 CarbonylContact O-C 3.59Å; R769-Y804 WeakPolarHBondContact O-CA 3.43Å; H802-Y804 HydrophobicContact CB-CE2 4.19Å; Y804-V821 HydrophobicContact CD2-CG1 4.46Å; Y804-V821 HydrophobicContact CD2-CG2 4.28Å; Y804-V821 HydrophobicContact CE2-CG1 3.77Å; Y804-V821 HydrophobicContact CE2-CG2 4.37Å; Y804-I926 CarbonylContact O-C 3.56Å; Y804-I926 VanDerWaalsContact O-CA 3.29Å; Y804-I926 WeakPolarHBondContact O-CA 3.48Å; Y804-L927 PolarHBondContact N-O 3.13Å; Y804-L927 PolarHBondContact O-N 2.91Å; Y804-I929 HydrophobicContact CD2-CD1 4.26Å; Y804-I929 HydrophobicContact CE2-CD1 4.11Å; Y804-S952 VanDerWaalsContact OH-CB 3.29Å; Y804-S952 WeakPolarHBondContact OH-CB 3.41Å; Y804-S952 PolarHBondContact OH-O 3.19Å; Y804-S952 PolarHBondContact OH-OG 3.43Å; Y804-A954 HydrophobicContact CD1-CB 3.38Å; Y804-A954 HydrophobicContact CE1-CB 3.25Å; Y804-A954 HydrophobicContact CG-CB 4.07Å; Y804-V977 HydrophobicContact CD1-CG2 4.36Å; Y804-V977 HydrophobicContact CE1-CB 4.41Å; Y804-V977 HydrophobicContact CE1-CG2 3.57Å
805	E	92.8	Very high	86.6	Confident	52 Å²	52	19.5 Å²	19.5	24%	0.243	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	118.4	-180	177.3	-177.1	-149	0	0	109.5	I768 R769 N924 I926	I768-E805 CarbonylContact C-O 3.59Å; I768-E805 VanDerWaalsContact CA-O 3.29Å; I768-E805 WeakPolarHBondContact CA-O 3.29Å; R769-E805 PolarHBondContact N-O 3.3Å; R769-E805 PolarHBondContact O-N 2.74Å; E805-N924 HydrophobicContact CG-CB 4.1Å; E805-N924 PolarHBondContact OE1-ND2 2.89Å; E805-I926 HydrophobicContact CB-CG1 4.4Å; E805-I926 HydrophobicContact CG-CG1 4.19Å
806	L	92.4	Very high	87.1	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	120.5	168.8	179.3	64.9	0	0	0	109.1	A766 I768 F814 A817 L819 V916 L919 N924 A925 F956	A766-L806 HydrophobicContact CB-CD1 4.46Å; I768-L806 HydrophobicContact CB-CD1 4.32Å; L806-F814 HydrophobicContact CD2-CZ 4.43Å; L806-A817 HydrophobicContact CD2-CB 4.47Å; L806-L819 HydrophobicContact CB-CD1 4.2Å; L806-V916 HydrophobicContact CD2-CB 4.44Å; L806-V916 HydrophobicContact CD2-CG1 4.28Å; L806-V916 HydrophobicContact CD2-CG2 3.97Å; L806-L919 HydrophobicContact CD2-CD1 4.12Å; L806-L919 HydrophobicContact CG-CD1 4.33Å; L806-N924 CarbonylContact O-C 3.57Å; L806-N924 WeakPolarHBondContact O-CA 3.18Å; L806-N924 WeakPolarHBondContact O-CB 3.17Å; L806-A925 PolarHBondContact N-O 2.71Å; L806-A925 PolarHBondContact O-N 2.98Å; L806-F956 HydrophobicContact CD1-CB 4.12Å; L806-F956 HydrophobicContact CD1-CD1 3.59Å; L806-F956 HydrophobicContact CD1-CD2 3.79Å; L806-F956 HydrophobicContact CD1-CE1 3.85Å; L806-F956 HydrophobicContact CD1-CE2 4.12Å; L806-F956 HydrophobicContact CD1-CG 3.53Å; L806-F956 HydrophobicContact CD1-CZ 4.14Å
807	L	91.3	Very high	87.8	Confident	23 Å²	23	23.3 Å²	23.3	12%	0.12	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	131.8	-176.1	175.2	66.1	0	0	0	110.8	A766 S767 N809 N924	A766-L807 CarbonylContact C-O 3.34Å; A766-L807 WeakPolarHBondContact CA-O 3.29Å; S767-L807 PolarHBondContact N-O 2.85Å; S767-L807 PolarHBondContact O-N 2.86Å; L807-N809 WeakPolarHBondContact CD2-OD1 3.43Å; L807-N809 WeakPolarHBondContact CG-OD1 3.45Å; L807-N924 HydrophobicContact CB-CB 4.44Å; L807-N924 HydrophobicContact CD1-CB 4.05Å
808	N	89.9	Confident	88.3	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	103.4	169.3	-171.1	8.4	0	0	0	110.8	G810 S812 F814 L919 N922 K923	N808-G810 PolarHBondContact OD1-N 2.81Å; N808-S812 PolarHBondContact ND2-O 2.8Å; N808-F814 HydrophobicContact CB-CD1 4.44Å; N808-F814 HydrophobicContact CB-CE1 3.71Å; N808-F814 HydrophobicContact CB-CZ 4.48Å; N808-L919 PolarHBondContact ND2-O 3.4Å; N808-L919 VanDerWaalsContact ND2-O 3.08Å; N808-N922 WeakPolarHBondContact O-CA 3.29Å; N808-N922 PolarHBondContact O-N 3.49Å; N808-K923 PolarHBondContact N-O 3.11Å; N808-K923 VanDerWaalsContact N-O 3.17Å
809	N	85.4	Confident	88.7	Confident	72 Å²	72	23.4 Å²	23.4	39%	0.385	12%	0.123	S	C	.	.			trans	-88.1	-8.1	173.4	-59.5	-56.7	0	0	0	112.7	K765 S767 L807	K765-N809 WeakPolarHBondContact O-CA 3.36Å; K765-N809 WeakPolarHBondContact O-CB 3.31Å; K765-N809 PolarHBondContact O-N 2.85Å; S767-N809 PolarHBondContact OG-ND2 2.8Å; L807-N809 WeakPolarHBondContact CD2-OD1 3.43Å; L807-N809 WeakPolarHBondContact CG-OD1 3.45Å
810	G	83.1	Confident	89	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.119	C	C	.	.	S	Bend	trans	-76.6	156.5	-178.7	0	0	0	0	0	112.1	K765 N808 S812	K765-G810 PolarHBondContact O-N 2.91Å; N808-G810 PolarHBondContact OD1-N 2.81Å; G810-S812 VanDerWaalsContact C-N 3.32Å
811	P	81.4	Confident	89.1	Confident	16 Å²	16	22.4 Å²	22.4	10%	0.104	12%	0.119	C	C	.	.	S	Bend	trans	-64.9	-37.2	170.7	28	-37.2	0	0	0	112.1	I644 G645 D646 L763	I644-P811 CarbonylContact O-C 3.6Å; G645-P811 CarbonylContact C-O 3.17Å; G645-P811 VanDerWaalsContact CA-O 3.27Å; G645-P811 WeakPolarHBondContact CA-O 3.41Å; D646-P811 HydrophobicContact CB-CB 3.7Å; L763-P811 HydrophobicContact CB-CG 4.13Å; L763-P811 HydrophobicContact CD2-CG 4.46Å; L763-P811 WeakPolarHBondContact O-CD 3.45Å; L763-P811 WeakPolarHBondContact O-CG 3.23Å
812	S	84.4	Confident	89.2	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.123	C	C	.	.	S	Bend	trans	-82.6	144	-175	-50.1	0	0	0	0	112.8	I644 L763 N808 G810	I644-S812 VanDerWaalsContact O-CA 3.26Å; I644-S812 WeakPolarHBondContact O-CA 3.38Å; I644-S812 WeakPolarHBondContact O-CB 3.24Å; I644-S812 PolarHBondContact O-N 2.94Å; I644-S812 PolarHBondContact O-OG 2.85Å; L763-S812 PolarHBondContact N-OG 3.13Å; L763-S812 PolarHBondContact O-N 2.96Å; L763-S812 PolarHBondContact O-OG 2.79Å; N808-S812 PolarHBondContact ND2-O 2.8Å; G810-S812 VanDerWaalsContact C-N 3.32Å
813	T	84.7	Confident	89	Confident	16 Å²	16	23.4 Å²	23.4	10%	0.098	12%	0.122	C	C	.	.			trans	-86.6	143.1	179.2	-63.1	0	0	0	0	110.3	R918 E920 P962 Y963	T813-R918 HydrophobicContact CG2-CG 3.67Å; T813-E920 HydrophobicContact CG2-CG 4.14Å; T813-P962 WeakPolarHBondContact O-CD 3.33Å; T813-Y963 PolarHBondContact N-OH 3.04Å; T813-Y963 WeakPolarHBondContact O-CE2 3.28Å
814	F	86.5	Confident	88.7	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.114	C	C	.	.	B	Isolated β-bridge	trans	-111.8	146.9	167.2	60	-97.1	0	0	0	110.7	A766 L806 N808 A817 R918 L919 V958 M961	A766-F814 HydrophobicContact CB-CE1 4.13Å; L806-F814 HydrophobicContact CD2-CZ 4.43Å; N808-F814 HydrophobicContact CB-CD1 4.44Å; N808-F814 HydrophobicContact CB-CE1 3.71Å; N808-F814 HydrophobicContact CB-CZ 4.48Å; F814-A817 HydrophobicContact CD2-CB 4.07Å; F814-A817 HydrophobicContact CE2-CB 3.67Å; F814-R918 WeakPolarHBondContact O-CA 3.23Å; F814-L919 HydrophobicContact CD2-CB 4.27Å; F814-L919 HydrophobicContact CE1-CB 4Å; F814-L919 HydrophobicContact CE2-CB 3.65Å; F814-L919 HydrophobicContact CE2-CD1 3.75Å; F814-L919 HydrophobicContact CE2-CG 4.1Å; F814-L919 HydrophobicContact CZ-CB 3.51Å; F814-L919 HydrophobicContact CZ-CD1 3.46Å; F814-L919 VanDerWaalsContact CZ-CD1 3.46Å; F814-L919 HydrophobicContact CZ-CG 4.06Å; F814-L919 PolarHBondContact N-O 3.36Å; F814-L919 PolarHBondContact O-N 3.01Å; F814-V958 HydrophobicContact CB-CG1 3.62Å; F814-V958 HydrophobicContact CD1-CG2 4.21Å; F814-V958 HydrophobicContact CD2-CG1 4.32Å; F814-V958 HydrophobicContact CD2-CG2 4.24Å; F814-V958 HydrophobicContact CE1-CG2 4.4Å; F814-V958 HydrophobicContact CE2-CG2 4.44Å; F814-V958 HydrophobicContact CG-CG1 4.02Å; F814-V958 HydrophobicContact CG-CG2 4.11Å; F814-V958 HydrophobicContact CZ-CG2 4.5Å; F814-M961 HydrophobicContact CB-CG 4.33Å
815	S	85.7	Confident	88.1	Confident	24 Å²	24	23.5 Å²	23.5	17%	0.168	12%	0.12	C	C	.	.	S	Bend	trans	-93.2	-34.3	-173.2	53.5	0	0	0	0	112.6	G917 R918 E960	S815-G917 CarbonylContact O-C 3.55Å; S815-R918 PolarHBondContact O-N 3.34Å; S815-E960 PolarHBondContact N-O 3.3Å; S815-E960 WeakPolarHBondContact OG-CB 3.31Å; S815-E960 WeakPolarHBondContact OG-CG 3.07Å; S815-E960 PolarHBondContact OG-O 2.79Å
816	K	88.9	Confident	87.4	Confident	111 Å²	111	23.7 Å²	23.7	48%	0.483	12%	0.12	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	138.2	176	-64.2	-176.7	-171.3	133.1	0	112.3	V916 I959 E960	K816-V916 WeakPolarHBondContact CA-O 3.46Å; K816-I959 HydrophobicContact CB-CB 4.47Å; K816-I959 PolarHBondContact O-N 2.89Å; K816-E960 HydrophobicContact CB-CB 4.03Å; K816-E960 WeakPolarHBondContact CD-OE2 3.38Å; K816-E960 WeakPolarHBondContact CE-OE2 3.5Å; K816-E960 HydrophobicContact CG-CB 4.43Å; K816-E960 PolarHBondContact N-O 2.88Å; K816-E960 IonicContact NZ-OE2 3.63Å; K816-E960 PolarHBondContact NZ-OE2 2.97Å; K816-E960 PolarHBondContact O-N 3.41Å
817	A	90.9	Very high	86.4	Confident	2 Å²	2	25 Å²	25	2%	0.017	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	150.6	167.2	0	0	0	0	0	111.1	L806 F814 V916 E957 V958	L806-A817 HydrophobicContact CD2-CB 4.47Å; F814-A817 HydrophobicContact CD2-CB 4.07Å; F814-A817 HydrophobicContact CE2-CB 3.67Å; A817-V916 HydrophobicContact CB-CB 4.2Å; A817-V916 PolarHBondContact N-O 3.41Å; A817-V916 PolarHBondContact O-N 2.76Å; A817-E957 CarbonylContact C-O 3.49Å; A817-E957 VanDerWaalsContact CA-O 3.31Å; A817-E957 WeakPolarHBondContact CA-O 3.18Å; A817-V958 HydrophobicContact CB-CG2 4.14Å
818	S	92.5	Very high	85.2	Confident	40 Å²	40	30.1 Å²	30.1	28%	0.28	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	131	169.9	-178.7	0	0	0	0	108.8	C914 F956 E957	S818-C914 WeakPolarHBondContact CA-O 3.36Å; S818-F956 CarbonylContact O-C 3.5Å; S818-F956 WeakPolarHBondContact O-CA 3.01Å; S818-E957 PolarHBondContact N-O 3.29Å; S818-E957 PolarHBondContact O-N 2.92Å
819	L	92.7	Very high	84	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	122.3	171.9	177.8	151.9	0	0	0	108.3	I768 L806 V821 C914 V916 L927 S955 F956	I768-L819 HydrophobicContact CD1-CD1 3.79Å; I768-L819 HydrophobicContact CD1-CG 4.35Å; L806-L819 HydrophobicContact CB-CD1 4.2Å; L819-V821 HydrophobicContact CD2-CG2 3.6Å; L819-C914 HydrophobicContact CB-CB 4.08Å; L819-C914 HydrophobicContact CD2-CB 4.03Å; L819-C914 PolarHBondContact N-O 2.94Å; L819-C914 WeakPolarHBondContact O-CB 3.25Å; L819-C914 PolarHBondContact O-N 2.91Å; L819-V916 HydrophobicContact CB-CG2 4.3Å; L819-L927 HydrophobicContact CD2-CD2 4.24Å; L819-S955 CarbonylContact C-O 3.54Å; L819-S955 WeakPolarHBondContact CA-O 3.33Å; L819-F956 HydrophobicContact CB-CB 4.41Å
820	E	92.1	Very high	83.2	Confident	45 Å²	45	34.3 Å²	34.3	21%	0.21	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	123.5	-179.8	-173.7	173.1	-177.4	0	0	109.1	K911 L912 R913 A954 S955	E820-K911 WeakPolarHBondContact OE1-CD 3.24Å; E820-K911 IonicContact OE1-NZ 2.75Å; E820-K911 PolarHBondContact OE1-NZ 3.35Å; E820-L912 WeakPolarHBondContact CA-O 3.47Å; E820-R913 HydrophobicContact CG-CG 4.47Å; E820-A954 CarbonylContact O-C 3.6Å; E820-A954 VanDerWaalsContact O-CA 3.31Å; E820-A954 WeakPolarHBondContact O-CA 3.32Å; E820-S955 PolarHBondContact N-O 3.08Å; E820-S955 PolarHBondContact O-N 2.9Å; E820-S955 PolarHBondContact O-OG 3.4Å
821	V	91.1	Very high	82.7	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	123.7	174.2	-173.6	0	0	0	0	109	Y804 L819 L912 L927 I929 T953 A954	Y804-V821 HydrophobicContact CD2-CG1 4.46Å; Y804-V821 HydrophobicContact CD2-CG2 4.28Å; Y804-V821 HydrophobicContact CE2-CG1 3.77Å; Y804-V821 HydrophobicContact CE2-CG2 4.37Å; L819-V821 HydrophobicContact CD2-CG2 3.6Å; V821-L912 HydrophobicContact CB-CB 4.29Å; V821-L912 HydrophobicContact CG2-CD2 4.39Å; V821-L912 PolarHBondContact N-O 2.72Å; V821-L912 PolarHBondContact O-N 2.86Å; V821-L927 HydrophobicContact CG2-CD2 3.82Å; V821-I929 HydrophobicContact CG1-CD1 4.08Å; V821-T953 CarbonylContact C-O 3.57Å; V821-T953 WeakPolarHBondContact CA-O 3.3Å; V821-A954 HydrophobicContact CG2-CB 3.97Å
822	E	90.1	Very high	82.7	Confident	59 Å²	59	34.6 Å²	34.6	28%	0.276	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	118	173.5	-45.3	-172	129.6	0	0	109.1	C904 C909 K911 S952 T953	E822-C904 HydrophobicContact CB-CB 4.35Å; E822-C909 VanDerWaalsContact CB-SG 3.52Å; E822-K911 IonicContact OE1-NZ 3.74Å; E822-S952 WeakPolarHBondContact O-CA 3.5Å; E822-T953 VanDerWaalsContact CB-OG1 3.27Å; E822-T953 WeakPolarHBondContact CB-OG1 3.49Å; E822-T953 WeakPolarHBondContact CG-OG1 3.47Å; E822-T953 PolarHBondContact N-O 2.93Å; E822-T953 PolarHBondContact O-N 2.94Å; E822-T953 PolarHBondContact OE2-OG1 3.02Å
823	W	87.8	Confident	82.6	Confident	1 Å²	1	34.6 Å²	34.6	0%	0.004	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	122.8	-171.9	-169.2	-89.9	0	0	0	112.4	H802 Y825 L833 I835 C904 C909 L910 I929 S931	H802-W823 HydrophobicContact CB-CH2 3.99Å; H802-W823 HydrophobicContact CB-CZ3 3.85Å; H802-W823 AromaticContact CE1-CH2 3.83Å; H802-W823 AromaticContact CE1-CZ3 3.99Å; H802-W823 AromaticContact CG-CH2 3.59Å; H802-W823 AromaticContact CG-CZ3 3.66Å; H802-W823 AromaticContact ND1-CH2 3.37Å; H802-W823 WeakPolarHBondContact ND1-CH2 3.17Å; H802-W823 AromaticContact ND1-CZ3 3.2Å; H802-W823 WeakPolarHBondContact ND1-CZ3 3.34Å; W823-Y825 PolarHBondContact O-N 2.82Å; W823-Y825 VanDerWaalsContact O-N 3.12Å; W823-L833 HydrophobicContact CH2-CD1 4.13Å; W823-L833 HydrophobicContact CZ2-CB 3.64Å; W823-L833 HydrophobicContact CZ2-CD1 3.54Å; W823-L833 HydrophobicContact CZ2-CG 4.18Å; W823-L833 PolarHBondContact NE1-O 2.83Å; W823-L833 VanDerWaalsContact NE1-O 3.15Å; W823-I835 HydrophobicContact CB-CD1 4.48Å; W823-I835 HydrophobicContact CD2-CD1 4.09Å; W823-I835 HydrophobicContact CD2-CG1 4.39Å; W823-I835 HydrophobicContact CG-CD1 3.84Å; W823-I835 HydrophobicContact CG-CG1 4.39Å; W823-I835 HydrophobicContact CZ2-CG1 4.4Å; W823-C904 VanDerWaalsContact C-SG 3.6Å; W823-C909 PolarHBondContact N-SG 2.83Å; W823-C909 VanDerWaalsContact N-SG 3.38Å; W823-C909 CarbonylContact O-C 3.49Å; W823-C909 WeakPolarHBondContact O-CA 3.5Å; W823-L910 HydrophobicContact CB-CB 4.29Å; W823-L910 HydrophobicContact CB-CD2 4.43Å; W823-L910 WeakPolarHBondContact CB-O 3.31Å; W823-L910 PolarHBondContact N-O 2.96Å; W823-L910 PolarHBondContact O-N 2.89Å; W823-I929 HydrophobicContact CE3-CD1 4.13Å; W823-I929 HydrophobicContact CE3-CG2 4.32Å; W823-I929 HydrophobicContact CH2-CB 4.48Å; W823-I929 HydrophobicContact CH2-CG2 3.89Å; W823-I929 HydrophobicContact CZ2-CG2 4.31Å; W823-I929 HydrophobicContact CZ3-CB 4.27Å; W823-I929 HydrophobicContact CZ3-CD1 4.06Å; W823-I929 HydrophobicContact CZ3-CG2 3.89Å; W823-S931 WeakPolarHBondContact CZ2-OG 3.5Å
824	P	85.8	Confident	82.6	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	103.6	178	30.1	-34.3	0	0	0	111	L832 A907 V950 R951	P824-L832 HydrophobicContact CB-CD1 4.31Å; P824-A907 HydrophobicContact CB-CB 4.15Å; P824-V950 HydrophobicContact CB-CG1 4.3Å; P824-V950 HydrophobicContact CG-CG1 3.42Å; P824-V950 VanDerWaalsContact CG-CG1 3.42Å; P824-R951 WeakPolarHBondContact CG-O 3.08Å
825	Y	79.8	Confident	82.6	Confident	31 Å²	31	34.3 Å²	34.3	12%	0.122	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-52.6	-171.6	-176.1	-122.1	0	0	0	112.8	W823 L832 Y834 E908	W823-Y825 PolarHBondContact O-N 2.82Å; W823-Y825 VanDerWaalsContact O-N 3.12Å; Y825-L832 PolarHBondContact O-N 3.31Å; Y825-Y834 HydrophobicContact CE2-CD2 4.29Å; Y825-E908 PolarHBondContact N-O 2.7Å
826	H	78.4	Confident	82.5	Confident	56 Å²	56	33.5 Å²	33.5	26%	0.259	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	140	-176.7	-81.4	-53.5	0	0	0	113.7	G830 S831 A907 E908	H826-G830 PolarHBondContact ND1-O 2.79Å; H826-S831 PolarHBondContact CE1-OG 2.74Å; H826-A907 WeakPolarHBondContact O-CA 3.33Å; H826-A907 VanDerWaalsContact O-CB 3.26Å; H826-A907 WeakPolarHBondContact O-CB 3.21Å; H826-E908 HydrophobicContact CB-CB 4.04Å; H826-E908 IonicContact CD2-OE2 3.44Å; H826-E908 PolarHBondContact N-O 2.97Å; H826-E908 PolarHBondContact O-N 3.19Å
827	F	72.8	Confident	82.3	Confident	27 Å²	27	30.3 Å²	30.3	12%	0.118	15%	0.153	C	C	.	.	S	Bend	trans	-143	122.8	173.1	-178.5	-110.3	0	0	0	110.8	N829 G830 L832 Q902 T906 A907	F827-N829 PolarHBondContact O-N 2.94Å; F827-G830 PolarHBondContact N-O 2.81Å; F827-G830 PolarHBondContact O-N 2.84Å; F827-L832 HydrophobicContact CB-CD1 3.67Å; F827-L832 HydrophobicContact CB-CD2 4.07Å; F827-L832 HydrophobicContact CB-CG 3.81Å; F827-Q902 VanDerWaalsContact CD2-CD 3.44Å; F827-T906 WeakPolarHBondContact CD2-O 3.09Å; F827-A907 HydrophobicContact CB-CB 4.42Å
828	R	65.3	Low	82.2	Confident	131 Å²	131	33.1 Å²	33.1	49%	0.494	17%	0.165	S	C	.	.	S	Bend	trans	49.4	53.6	176.6	-59.7	-178.2	178.9	-158.6	-5.5	114	G830	R828-G830 VanDerWaalsContact C-N 3.32Å; R828-G830 PolarHBondContact O-N 3.2Å
829	N	65.6	Low	81.9	Confident	154 Å²	154	36.3 Å²	36.3	82%	0.824	18%	0.176	S	C	*	.	S	Bend	trans	59.4	35.8	179.6	-63.2	-10.4	0	0	0	114.4	F827 R940	F827-N829 PolarHBondContact O-N 2.94Å; N829-R940 PolarHBondContact O-NH1 3.34Å; N829-R940 PolarHBondContact O-NH2 3.25Å
830	G	67.5	Low	81.8	Confident	6 Å²	6	39.2 Å²	39.2	6%	0.062	19%	0.194	C	C	.	.	S	Bend	trans	-148.3	153.8	170.1	0	0	0	0	0	110.8	H826 F827 R828	H826-G830 PolarHBondContact ND1-O 2.79Å; F827-G830 PolarHBondContact N-O 2.81Å; F827-G830 PolarHBondContact O-N 2.84Å; R828-G830 VanDerWaalsContact C-N 3.32Å; R828-G830 PolarHBondContact O-N 3.2Å
831	S	73.3	Confident	81.6	Confident	21 Å²	21	42.6 Å²	42.6	15%	0.147	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-75.9	150.6	175.4	-58.2	0	0	0	0	109.6	H826 D934 N937	H826-S831 PolarHBondContact CE1-OG 2.74Å; S831-D934 WeakPolarHBondContact CB-OD2 3.09Å; S831-D934 PolarHBondContact N-OD2 3.12Å; S831-D934 WeakPolarHBondContact O-CB 3.48Å; S831-N937 WeakPolarHBondContact O-CB 3.4Å; S831-N937 PolarHBondContact O-ND2 2.04Å
832	L	80	Confident	81.4	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.01	23%	0.233	C	C	.	.	S	Bend	trans	-102.3	-71.2	171.1	-71.6	171	0	0	0	109.5	P824 Y825 F827 Q902 A907 D934 F938	P824-L832 HydrophobicContact CB-CD1 4.31Å; Y825-L832 PolarHBondContact O-N 3.31Å; F827-L832 HydrophobicContact CB-CD1 3.67Å; F827-L832 HydrophobicContact CB-CD2 4.07Å; F827-L832 HydrophobicContact CB-CG 3.81Å; L832-Q902 HydrophobicContact CD1-CG 3.41Å; L832-Q902 VanDerWaalsContact CD1-CG 3.41Å; L832-A907 HydrophobicContact CD1-CB 4.1Å; L832-D934 PolarHBondContact O-N 2.93Å; L832-F938 HydrophobicContact CD2-CE1 4.2Å; L832-F938 HydrophobicContact CD2-CE2 4.33Å; L832-F938 HydrophobicContact CD2-CZ 3.63Å
833	L	82.4	Confident	81.3	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	104.8	176.4	-67.9	177.2	0	0	0	108.8	I800 W823 I835 L933 V950	I800-L833 HydrophobicContact CD1-CD2 3.41Å; I800-L833 VanDerWaalsContact CD1-CD2 3.41Å; W823-L833 HydrophobicContact CH2-CD1 4.13Å; W823-L833 HydrophobicContact CZ2-CB 3.64Å; W823-L833 HydrophobicContact CZ2-CD1 3.54Å; W823-L833 HydrophobicContact CZ2-CG 4.18Å; W823-L833 PolarHBondContact NE1-O 2.83Å; W823-L833 VanDerWaalsContact NE1-O 3.15Å; L833-I835 PolarHBondContact O-N 2.85Å; L833-L933 HydrophobicContact CD2-CD1 3.77Å; L833-V950 HydrophobicContact CD1-CB 4.32Å; L833-V950 HydrophobicContact CD1-CG1 3.49Å; L833-V950 VanDerWaalsContact CD1-CG1 3.49Å; L833-V950 HydrophobicContact CG-CG1 3.96Å
834	Y	85	Confident	81.4	Confident	4 Å²	4	45 Å²	45	2%	0.016	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	110	178.5	-176.6	-98.9	0	0	0	110.4	I796 Y825 T836 N853 P854 L855 S931 R932	I796-Y834 HydrophobicContact CD1-CD1 3.81Å; I796-Y834 HydrophobicContact CD1-CE1 3.98Å; I796-Y834 HydrophobicContact CD1-CG 4.25Å; Y825-Y834 HydrophobicContact CE2-CD2 4.29Å; Y834-T836 HydrophobicContact CD1-CG2 4.06Å; Y834-T836 HydrophobicContact CE1-CG2 4.27Å; Y834-T836 PolarHBondContact O-N 2.87Å; Y834-N853 WeakPolarHBondContact OH-CA 3.43Å; Y834-N853 PolarHBondContact OH-OD1 3.03Å; Y834-P854 HydrophobicContact CE2-CG 4.1Å; Y834-P854 VanDerWaalsContact OH-CD 3.32Å; Y834-P854 WeakPolarHBondContact OH-CD 3.3Å; Y834-L855 HydrophobicContact CE2-CD1 4.13Å; Y834-L855 HydrophobicContact CE2-CG 4.34Å; Y834-L855 VanDerWaalsContact OH-CB 3.3Å; Y834-L855 WeakPolarHBondContact OH-CB 3.05Å; Y834-L855 PolarHBondContact OH-N 3.34Å; Y834-S931 CarbonylContact O-C 3.57Å; Y834-S931 WeakPolarHBondContact O-CA 3.5Å; Y834-R932 PolarHBondContact N-O 3.36Å; Y834-R932 PolarHBondContact O-N 2.66Å
835	I	86.2	Confident	81.6	Confident	5 Å²	5	50.9 Å²	50.9	3%	0.026	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	127.1	178	-53	178.6	0	0	0	109.2	W823 L833 I852 N853 L910 I929	W823-I835 HydrophobicContact CB-CD1 4.48Å; W823-I835 HydrophobicContact CD2-CD1 4.09Å; W823-I835 HydrophobicContact CD2-CG1 4.39Å; W823-I835 HydrophobicContact CG-CD1 3.84Å; W823-I835 HydrophobicContact CG-CG1 4.39Å; W823-I835 HydrophobicContact CZ2-CG1 4.4Å; L833-I835 PolarHBondContact O-N 2.85Å; I835-I852 HydrophobicContact CB-CG2 4.05Å; I835-I852 HydrophobicContact CG2-CD1 4.48Å; I835-I852 HydrophobicContact CG2-CG1 4.46Å; I835-I852 HydrophobicContact CG2-CG2 3.61Å; I835-I852 WeakPolarHBondContact O-CG2 3.49Å; I835-N853 PolarHBondContact O-N 2.96Å; I835-L910 HydrophobicContact CD1-CD1 4.2Å; I835-L910 HydrophobicContact CD1-CD2 4.06Å; I835-I929 HydrophobicContact CD1-CG2 4.34Å; I835-I929 HydrophobicContact CG1-CG2 4.36Å; I835-I929 HydrophobicContact CG2-CG2 4.08Å
836	T	83.4	Confident	82	Confident	8 Å²	8	50.3 Å²	50.3	5%	0.049	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-43.8	176.6	57.6	0	0	0	0	111.9	Y834 N859 Y930 R932	Y834-T836 HydrophobicContact CD1-CG2 4.06Å; Y834-T836 HydrophobicContact CE1-CG2 4.27Å; Y834-T836 PolarHBondContact O-N 2.87Å; T836-N859 PolarHBondContact OG1-ND2 2.81Å; T836-Y930 PolarHBondContact N-O 3.01Å; T836-Y930 PolarHBondContact OG1-O 3.1Å; T836-R932 HydrophobicContact CG2-CG 3.61Å
837	S	84.9	Confident	82.5	Confident	43 Å²	43	52.1 Å²	52.1	30%	0.301	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	164	-179.6	53.4	0	0	0	0	109.7	Y930	S837-Y930 PolarHBondContact N-O 2.8Å; S837-Y930 WeakPolarHBondContact O-CA 3.42Å; S837-Y930 WeakPolarHBondContact O-CB 3.22Å; S837-Y930 PolarHBondContact O-N 2.92Å
838	F	88.6	Confident	83.1	Confident	62 Å²	62	52.7 Å²	52.7	27%	0.272	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	149.5	166.6	66.4	-88.6	0	0	0	109.2	T840 C846 T848 I852 L912 L927 F928 I929	F838-T840 HydrophobicContact CD2-CG2 4.35Å; F838-C846 HydrophobicContact CD2-CB 4.4Å; F838-C846 HydrophobicContact CE2-CB 3.81Å; F838-C846 HydrophobicContact CZ-CB 4.34Å; F838-T848 HydrophobicContact CE1-CG2 4.4Å; F838-I852 HydrophobicContact CD1-CD1 3.35Å; F838-I852 HydrophobicContact CE1-CD1 3.34Å; F838-L912 HydrophobicContact CD1-CD1 4.47Å; F838-L912 HydrophobicContact CG-CD1 4.48Å; F838-L927 HydrophobicContact CB-CD1 4.31Å; F838-L927 HydrophobicContact CD2-CD1 4.01Å; F838-F928 CarbonylContact C-O 3.58Å; F838-F928 WeakPolarHBondContact CA-O 3.2Å; F838-F928 VanDerWaalsContact CB-O 3.28Å; F838-F928 WeakPolarHBondContact CB-O 3.37Å; F838-I929 HydrophobicContact CB-CG1 4.48Å
839	E	87.8	Confident	83.8	Confident	107 Å²	107	51.1 Å²	51.1	50%	0.5	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	147.8	175.8	-69.8	175.2	160.5	0	0	109	F928 Y930	E839-F928 HydrophobicContact CB-CB 4.21Å; E839-F928 HydrophobicContact CB-CD2 4.4Å; E839-F928 PolarHBondContact N-O 3.05Å; E839-F928 PolarHBondContact O-N 3.37Å; E839-Y930 HydrophobicContact CB-CE2 4.14Å; E839-Y930 HydrophobicContact CG-CE2 3.79Å; E839-Y930 WeakPolarHBondContact OE2-CE2 3.46Å; E839-Y930 PolarHBondContact OE2-OH 2.79Å
840	T	90.1	Very high	84.4	Confident	62 Å²	62	47 Å²	47	38%	0.38	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	141.3	179.9	50.3	0	0	0	0	110.7	F838 I844 L927	F838-T840 HydrophobicContact CD2-CG2 4.35Å; T840-I844 HydrophobicContact CG2-CG2 3.83Å; T840-L927 HydrophobicContact CG2-CD1 3.88Å
841	E	87.4	Confident	84.9	Confident	115 Å²	115	54 Å²	54	54%	0.537	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	126.7	174.4	-172.5	178	-179.6	0	0	109.4	I926 F928	E841-I926 HydrophobicContact CB-CB 4.29Å; E841-I926 PolarHBondContact N-O 3.41Å; E841-I926 PolarHBondContact O-N 3.26Å; E841-F928 HydrophobicContact CB-CE2 4.07Å
842	G	86.3	Confident	85.2	Confident	49 Å²	49	54.7 Å²	54.7	51%	0.505	31%	0.306	S	S	.	.	S	Bend	trans	95.1	-170	-172.9	0	0	0	0	0	113.6	I844	G842-I844 PolarHBondContact O-N 3.19Å
843	P	87.9	Confident	85.3	Confident	60 Å²	60	56 Å²	56	39%	0.39	31%	0.313	S	S	.	.	S	Bend	trans	-79.7	62.9	-173.7	34	-36.3	0	0	0	111.5	V916 G917 L919	P843-V916 CarbonylContact O-C 3.5Å; P843-V916 WeakPolarHBondContact O-CA 3.49Å; P843-G917 PolarHBondContact O-N 2.82Å; P843-L919 HydrophobicContact CG-CD2 4.02Å; P843-L919 HydrophobicContact CG-CG 4.41Å
844	I	90	Very high	85.2	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.005	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	125.2	-176.8	-171.8	176.1	0	0	0	111.8	T840 G842 C914 Q915 V916 A925	T840-I844 HydrophobicContact CG2-CG2 3.83Å; G842-I844 PolarHBondContact O-N 3.19Å; I844-C914 HydrophobicContact CD1-CB 3.68Å; I844-C914 HydrophobicContact CG1-CB 3.7Å; I844-Q915 WeakPolarHBondContact CA-O 3.41Å; I844-V916 HydrophobicContact CB-CG2 4.35Å; I844-V916 HydrophobicContact CD1-CG2 3.89Å; I844-V916 HydrophobicContact CG1-CG2 3.86Å; I844-A925 HydrophobicContact CB-CB 4.15Å; I844-A925 HydrophobicContact CG2-CB 4.31Å
845	N	90.4	Very high	84.8	Confident	124 Å²	124	63.9 Å²	63.9	66%	0.663	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.3	121.7	177.3	-71.2	-16	0	0	0	109.5	C914 Q915	N845-C914 CarbonylContact O-C 3.54Å; N845-C914 VanDerWaalsContact O-CA 3.3Å; N845-C914 WeakPolarHBondContact O-CA 3.3Å; N845-Q915 PolarHBondContact N-O 3.37Å; N845-Q915 PolarHBondContact O-N 2.85Å
846	C	89.3	Confident	84.4	Confident	20 Å²	20	70.4 Å²	70.4	14%	0.135	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	143	-175.2	-55.7	0	0	0	0	112.2	F838 L912 R913 C914	F838-C846 HydrophobicContact CD2-CB 4.4Å; F838-C846 HydrophobicContact CE2-CB 3.81Å; F838-C846 HydrophobicContact CZ-CB 4.34Å; C846-L912 HydrophobicContact CB-CD2 3.9Å; C846-R913 CarbonylContact C-O 3.39Å; C846-R913 WeakPolarHBondContact CA-O 3.29Å; C846-C914 HydrophobicContact CB-CB 4.09Å; C846-C914 WeakPolarHBondContact CB-SG 3.37Å; C846-C914 WeakPolarHBondContact SG-CB 3.41Å; C846-C914 CovalentContact SG-SG 2.04Å; C846-C914 PolarHBondContact SG-SG 3.4Å
847	T	88.1	Confident	84.1	Confident	94 Å²	94	70.3 Å²	70.3	58%	0.577	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.4	142.4	175.7	53.2	0	0	0	0	109.2	R913	T847-R913 PolarHBondContact N-O 3.21Å; T847-R913 PolarHBondContact O-N 2.83Å; T847-R913 PolarHBondContact OG1-O 3.38Å
848	T	84.9	Confident	83.4	Confident	39 Å²	39	71.1 Å²	71.1	24%	0.239	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	145.5	175.1	54.3	0	0	0	0	110.8	F838 V850 I852 L910 L912	F838-T848 HydrophobicContact CE1-CG2 4.4Å; T848-V850 WeakPolarHBondContact CB-O 3.5Å; T848-V850 PolarHBondContact O-N 2.9Å; T848-V850 PolarHBondContact OG1-O 2.88Å; T848-I852 HydrophobicContact CG2-CD1 3.46Å; T848-I852 VanDerWaalsContact CG2-CD1 3.46Å; T848-I852 HydrophobicContact CG2-CG1 4.11Å; T848-L910 HydrophobicContact CG2-CD2 4.3Å; T848-L912 HydrophobicContact CG2-CB 4.06Å; T848-L912 HydrophobicContact CG2-CD1 3.79Å; T848-L912 HydrophobicContact CG2-CG 3.77Å
849	D	80.4	Confident	82.1	Confident	97 Å²	97	69.8 Å²	69.8	52%	0.519	40%	0.395	S	S	.	.	S	Bend	trans	-75.8	-14.3	178.2	-64.5	-15.8	0	0	0	112.4	K911	D849-K911 PolarHBondContact N-O 3.41Å; D849-K911 WeakPolarHBondContact OD2-CB 3.35Å
850	V	78.6	Confident	80.5	Confident	69 Å²	69	68.3 Å²	68.3	42%	0.418	39%	0.394	S	S	.	.	S	Bend	trans	-128.2	148.2	-179.1	-173.1	0	0	0	0	109.6	T848 I852 L910	T848-V850 WeakPolarHBondContact CB-O 3.5Å; T848-V850 PolarHBondContact O-N 2.9Å; T848-V850 PolarHBondContact OG1-O 2.88Å; V850-I852 PolarHBondContact O-N 3.47Å; V850-L910 HydrophobicContact CB-CD1 4.01Å; V850-L910 HydrophobicContact CB-CG 4.47Å
851	E	78.9	Confident	78.6	Confident	153 Å²	153	72.5 Å²	72.5	72%	0.715	41%	0.414	S	S	*	.			trans	-62.5	126.1	172.9	-171.9	174	-171.9	0	0	110.7
852	I	79.6	Confident	76.5	Confident	34 Å²	34	71.2 Å²	71.2	17%	0.174	42%	0.423	C	S	.	.	S	Bend	trans	-84.7	144.8	177.8	-64.8	165.7	0	0	0	109.1	I835 F838 T848 V850	I835-I852 HydrophobicContact CB-CG2 4.05Å; I835-I852 HydrophobicContact CG2-CD1 4.48Å; I835-I852 HydrophobicContact CG2-CG1 4.46Å; I835-I852 HydrophobicContact CG2-CG2 3.61Å; I835-I852 WeakPolarHBondContact O-CG2 3.49Å; F838-I852 HydrophobicContact CD1-CD1 3.35Å; F838-I852 HydrophobicContact CE1-CD1 3.34Å; T848-I852 HydrophobicContact CG2-CD1 3.46Å; T848-I852 VanDerWaalsContact CG2-CD1 3.46Å; T848-I852 HydrophobicContact CG2-CG1 4.11Å; V850-I852 PolarHBondContact O-N 3.47Å
853	N	81.8	Confident	74.1	Confident	30 Å²	30	74.8 Å²	74.8	16%	0.16	44%	0.435	C	S	.	.			trans	56	52.7	-178.2	-164.3	15.6	0	0	0	114.9	Y834 I835 L855 N856 V857	Y834-N853 WeakPolarHBondContact OH-CA 3.43Å; Y834-N853 PolarHBondContact OH-OD1 3.03Å; I835-N853 PolarHBondContact O-N 2.96Å; N853-L855 PolarHBondContact O-N 2.87Å; N853-N856 PolarHBondContact O-N 2.64Å; N853-N856 PolarHBondContact OD1-N 3Å; N853-V857 PolarHBondContact ND2-N 3Å; N853-V857 PolarHBondContact ND2-O 3.24Å; N853-V857 VanDerWaalsContact ND2-O 3.15Å; N853-V857 PolarHBondContact OD1-N 2.87Å
854	P	78.8	Confident	71.6	Confident	69 Å²	69	79.9 Å²	79.9	45%	0.448	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-13.8	-179.1	26.3	-36.7	0	0	0	114.8	Y834	Y834-P854 HydrophobicContact CE2-CG 4.1Å; Y834-P854 VanDerWaalsContact OH-CD 3.32Å; Y834-P854 WeakPolarHBondContact OH-CD 3.3Å
855	L	77	Confident	69.1	Low	100 Å²	100	89.4 Å²	89.4	52%	0.524	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	1.7	177.9	-60.6	173.8	0	0	0	111.9	P790 Y834 N853 V857	P790-L855 HydrophobicContact CG-CD1 4.21Å; Y834-L855 HydrophobicContact CE2-CD1 4.13Å; Y834-L855 HydrophobicContact CE2-CG 4.34Å; Y834-L855 VanDerWaalsContact OH-CB 3.3Å; Y834-L855 WeakPolarHBondContact OH-CB 3.05Å; Y834-L855 PolarHBondContact OH-N 3.34Å; N853-L855 PolarHBondContact O-N 2.87Å; L855-V857 VanDerWaalsContact C-N 3.26Å; L855-V857 HydrophobicContact CB-CG2 3.73Å; L855-V857 PolarHBondContact O-N 2.82Å
856	N	78.6	Confident	66.4	Low	143 Å²	143	90.5 Å²	90.5	77%	0.765	50%	0.501	S	S	*	.			trans	45.4	48.1	-178.8	-161.3	13	0	0	0	113.4	N853	N853-N856 PolarHBondContact O-N 2.64Å; N853-N856 PolarHBondContact OD1-N 3Å
857	V	77.3	Confident	63.7	Low	5 Å²	5	96.1 Å²	96.1	3%	0.03	53%	0.534	C	S	.	.	P	Polyproline II helix	trans	-80.8	133.8	-175.1	177	0	0	0	0	109.9	L792 I796 N853 L855	L792-V857 WeakPolarHBondContact O-CG1 3.13Å; I796-V857 HydrophobicContact CD1-CG2 4.03Å; N853-V857 PolarHBondContact ND2-N 3Å; N853-V857 PolarHBondContact ND2-O 3.24Å; N853-V857 VanDerWaalsContact ND2-O 3.15Å; N853-V857 PolarHBondContact OD1-N 2.87Å; L855-V857 VanDerWaalsContact C-N 3.26Å; L855-V857 HydrophobicContact CB-CG2 3.73Å; L855-V857 PolarHBondContact O-N 2.82Å
858	S	69.1	Low	60.9	Low	60 Å²	60	96.5 Å²	96.5	42%	0.42	54%	0.541	S	S	.	.	B	Isolated β-bridge	trans	-82	134.1	-179	60.8	0	0	0	0	111.8	V791 G793	V791-S858 PolarHBondContact O-N 2.83Å; V791-S858 VanDerWaalsContact O-N 3.16Å; V791-S858 PolarHBondContact O-OG 2.82Å; V791-S858 VanDerWaalsContact O-OG 3.05Å; G793-S858 PolarHBondContact N-O 3.44Å
859	N	62.3	Low	58.3	Low	34 Å²	34	100.7 Å²	100.7	18%	0.182	57%	0.567	C	S	.	*	P	Polyproline II helix	trans	-95.6	126.6	171.9	-92.1	-22.9	0	0	0	109.3	T836 L861 A862 R932	T836-N859 PolarHBondContact OG1-ND2 2.81Å; N859-L861 PolarHBondContact O-N 2.84Å; N859-A862 PolarHBondContact O-N 3.45Å; N859-R932 PolarHBondContact OD1-NH2 2.96Å; N859-R932 VanDerWaalsContact OD1-NH2 3.08Å
860	P	54.3	Low	55.9	Low	76 Å²	76	102.1 Å²	102.1	49%	0.494	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.6	2.4	-177.1	24.4	-31.2	0	0	0	115.2
861	L	50.5	Low	53.5	Low	150 Å²	150	109.5 Å²	109.5	79%	0.785	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.4	-0.1	-178.3	-88.2	142.8	0	0	0	115	N859 T863	N859-L861 PolarHBondContact O-N 2.84Å; L861-T863 VanDerWaalsContact C-N 3.35Å
862	A	42.4	Very low	51.2	Low	88 Å²	88	109.1 Å²	109.1	73%	0.727	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	-2.3	176.1	0	0	0	0	0	113.7	N859	N859-A862 PolarHBondContact O-N 3.45Å
863	T	34.9	Very low	48.9	Very low	125 Å²	125	119 Å²	119	77%	0.767	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.8	27.8	-173.7	-12.9	0	0	0	0	114.4	L861	L861-T863 VanDerWaalsContact C-N 3.35Å
864	Q	35.4	Very low	46.4	Very low	167 Å²	167	126.1 Å²	126.1	78%	0.78	67%	0.669	S	S	*	*			trans	-139.8	59.9	165	-77.1	-166.2	-9.8	0	0	112
865	K	37.6	Very low	44.1	Very low	201 Å²	201	128 Å²	128	87%	0.874	69%	0.69	S	S	*	*	S	Bend	trans	-110.1	69.4	143.9	-88.6	-176.7	178.8	171.6	0	106.9
866	N	34.7	Very low	41.8	Very low	147 Å²	147	132.1 Å²	132.1	79%	0.786	71%	0.707	S	S	*	*	S	Bend	trans	-168.9	123.2	153.7	-87.7	-23.2	0	0	0	108.7
867	T	32.5	Very low	40	Very low	137 Å²	137	129.6 Å²	129.6	84%	0.84	71%	0.714	S	S	*	*			trans	60.2	98.8	170.6	38.7	0	0	0	0	118.9
868	S	29.6	Very low	37.7	Very low	102 Å²	102	132.8 Å²	132.8	71%	0.713	75%	0.748	S	S	*	*				-176.5	111.4	116.7	40.6	0	0	0	0	112.9
869	V	30.1	Very low	35.8	Very low	128 Å²	128	137.3 Å²	137.3	78%	0.776	77%	0.768	S	S	*	*			trans	34.9	94.6	137	-168.1	0	0	0	0	116.5	R871	V869-R871 HydrophobicContact CG1-CG 4.5Å; V869-R871 PolarHBondContact O-N 2.86Å
870	V	29.3	Very low	34.5	Very low	126 Å²	126	141.5 Å²	141.5	76%	0.764	80%	0.797	S	S	*	*			trans	-65	101.8	156.4	178.2	0	0	0	0	107.3	D872	V870-D872 PolarHBondContact O-N 2.89Å
871	R	28.1	Very low	33.5	Very low	224 Å²	224	149.1 Å²	149.1	85%	0.845	82%	0.816	S	S	*	*			trans	-79.1	105.5	157.8	-99.6	-177	177.5	177.6	-0.4	107	V869 R873	V869-R871 HydrophobicContact CG1-CG 4.5Å; V869-R871 PolarHBondContact O-N 2.86Å; R871-R873 PolarHBondContact O-N 2.87Å
872	D	30.8	Very low	32.9	Very low	145 Å²	145	153.6 Å²	153.6	78%	0.775	82%	0.822	S	S	*	*			trans	-52.7	123.9	158.6	-72.2	-43.4	0	0	0	109	V870	V870-D872 PolarHBondContact O-N 2.89Å
873	R	30.8	Very low	32.5	Very low	241 Å²	241	157.4 Å²	157.4	91%	0.909	83%	0.83	S	S	*	*			trans	-112	118.5	156.9	-92.7	-171.4	172.7	179	-1.5	107.8	R871	R871-R873 PolarHBondContact O-N 2.87Å
874	E	30.2	Very low	32.2	Very low	181 Å²	181	162.5 Å²	162.5	85%	0.846	84%	0.835	S	S	*	*			trans	-45.1	139.7	179.6	-67	154.9	143.3	0	0	113.3	E876	E874-E876 PolarHBondContact O-N 3.09Å
875	A	29.7	Very low	32.1	Very low	108 Å²	108	163.4 Å²	163.4	89%	0.893	84%	0.836	S	S	*	*			trans	-73.8	99.5	165.6	0	0	0	0	0	109.4
876	E	29.8	Very low	31.7	Very low	186 Å²	186	164.4 Å²	164.4	87%	0.869	83%	0.834	S	S	*	*			trans	-92.6	133.9	155	-83.4	-166.4	151	0	0	110.2	E874	E874-E876 PolarHBondContact O-N 3.09Å
877	G	40.8	Very low	31.6	Very low	90 Å²	90	163.8 Å²	163.8	93%	0.928	83%	0.831	S	S	*	*			trans	-59.5	131.4	-172.2	0	0	0	0	0	114.4
878	G	28.1	Very low	31.6	Very low	72 Å²	72	165.1 Å²	165.1	74%	0.742	83%	0.832	S	S	*	*			trans	-142.9	115.3	166.3	0	0	0	0	0	110.1
879	N	30.1	Very low	31.7	Very low	156 Å²	156	168.6 Å²	168.6	83%	0.834	84%	0.837	S	S	*	*			trans	-34.1	141.4	176.6	-93.3	-29.5	0	0	0	115.3	R881	N879-R881 PolarHBondContact O-N 3.47Å
880	P	35.1	Very low	31.9	Very low	121 Å²	121	167.1 Å²	167.1	79%	0.786	84%	0.839	S	S	*	*			trans	-70.5	98.9	170.8	29.6	-30.8	0	0	0	109.2	R882	P880-R882 PolarHBondContact O-N 3.44Å; P880-R882 VanDerWaalsContact O-N 3.07Å
881	R	32.7	Very low	31.9	Very low	236 Å²	236	172.1 Å²	172.1	89%	0.891	84%	0.844	S	S	*	*			trans	-66.3	108.4	163.8	-83.2	-174.8	176.3	176.9	0.6	108	N879 L883	N879-R881 PolarHBondContact O-N 3.47Å; R881-L883 PolarHBondContact O-N 2.68Å
882	R	38.8	Very low	32.4	Very low	244 Å²	244	170.3 Å²	170.3	92%	0.921	85%	0.845	S	S	*	*			trans	-42.4	97.4	163.2	-73.7	175.6	169.5	176.7	-4.3	110.7	P880 R884	P880-R882 PolarHBondContact O-N 3.44Å; P880-R882 VanDerWaalsContact O-N 3.07Å; R882-R884 PolarHBondContact O-N 3.1Å
883	L	33.3	Very low	32.4	Very low	169 Å²	169	168.9 Å²	168.9	89%	0.885	84%	0.841	S	S	*	*			trans	-80.9	98.7	155.6	-86.6	156	0	0	0	106.4	R881 K885	R881-L883 PolarHBondContact O-N 2.68Å; L883-K885 PolarHBondContact O-N 3.33Å
884	R	29.5	Very low	32.7	Very low	232 Å²	232	166.4 Å²	166.4	88%	0.875	84%	0.84	S	S	*	*			trans	-51.2	107.9	165.3	-84.6	178.3	166.9	178.6	-5	107.7	R882 R886	R882-R884 PolarHBondContact O-N 3.1Å; R884-R886 VanDerWaalsContact C-N 3.33Å; R884-R886 PolarHBondContact O-N 3.17Å
885	K	32.3	Very low	32.9	Very low	186 Å²	186	164.2 Å²	164.2	81%	0.809	83%	0.834	S	S	*	*			trans	-58	102.9	157.5	-141.9	179.6	-175.5	-174.2	0	105.1	L883 D887	L883-K885 PolarHBondContact O-N 3.33Å; K885-D887 PolarHBondContact O-N 3.08Å
886	R	30	Very low	33.3	Very low	221 Å²	221	167.1 Å²	167.1	83%	0.834	84%	0.835	S	S	*	*			trans	-71.2	109	158.5	-92.1	-179.5	178.8	154.7	-0.9	103.9	R884 L888	R884-R886 VanDerWaalsContact C-N 3.33Å; R884-R886 PolarHBondContact O-N 3.17Å; R886-L888 VanDerWaalsContact C-N 3.27Å; R886-L888 PolarHBondContact O-N 3.04Å
887	D	31.5	Very low	34.3	Very low	135 Å²	135	163.9 Å²	163.9	72%	0.722	82%	0.823	S	S	*	*			trans	-57.6	100.3	161.1	-65.7	-43.1	0	0	0	106.5	K885 E889	K885-D887 PolarHBondContact O-N 3.08Å; D887-E889 PolarHBondContact O-N 2.8Å
888	L	33.4	Very low	34.6	Very low	164 Å²	164	167 Å²	167	86%	0.859	81%	0.813	S	S	*	*			trans	-79	89.1	162.3	-93.3	153.4	0	0	0	104.9	R886 A890	R886-L888 VanDerWaalsContact C-N 3.27Å; R886-L888 PolarHBondContact O-N 3.04Å; L888-A890 PolarHBondContact O-N 3.07Å
889	E	31.8	Very low	36.1	Very low	176 Å²	176	168.3 Å²	168.3	82%	0.822	80%	0.803	S	S	*	*			trans	-46.9	122.6	158.1	-71.7	176.9	157	0	0	107.7	D887 R891	D887-E889 PolarHBondContact O-N 2.8Å; E889-R891 PolarHBondContact O-N 2.87Å
890	A	33.7	Very low	37.8	Very low	97 Å²	97	165.6 Å²	165.6	80%	0.802	78%	0.781	S	S	*	*			trans	-59.5	100	172.9	0	0	0	0	0	108	L888 E892	L888-A890 PolarHBondContact O-N 3.07Å; A890-E892 PolarHBondContact O-N 2.91Å; A890-E892 VanDerWaalsContact O-N 3.09Å
891	R	29.5	Very low	39.4	Very low	230 Å²	230	163.2 Å²	163.2	87%	0.868	76%	0.764	S	S	*	*			trans	-69.7	102.9	162.3	-103.8	178.9	165.7	174	-4.6	106.7	E889 T893	E889-R891 PolarHBondContact O-N 2.87Å; R891-T893 PolarHBondContact O-N 3.29Å
892	E	38.1	Very low	41.3	Very low	187 Å²	187	152.3 Å²	152.3	87%	0.874	72%	0.723	S	S	*	*			trans	-57.5	86.3	158	-73.6	-177.4	155	0	0	108.4	A890 Q894	A890-E892 PolarHBondContact O-N 2.91Å; A890-E892 VanDerWaalsContact O-N 3.09Å; E892-Q894 PolarHBondContact O-N 2.84Å
893	T	31.2	Very low	42.8	Very low	114 Å²	114	141.8 Å²	141.8	70%	0.699	69%	0.685	S	S	*	*			trans	-81.7	96.8	155.9	39.1	0	0	0	0	106.8	R891 N895	R891-T893 PolarHBondContact O-N 3.29Å; T893-N895 PolarHBondContact O-N 2.87Å
894	Q	37.3	Very low	44.4	Very low	189 Å²	189	135 Å²	135	88%	0.883	65%	0.652	S	S	*	*			trans	-53.2	89.6	155.2	-81.6	171.6	-43.6	0	0	108.5	E892	E892-Q894 PolarHBondContact O-N 2.84Å
895	N	33.6	Very low	46.5	Very low	136 Å²	136	131.2 Å²	131.2	73%	0.727	65%	0.649	S	S	*	*			trans	-121.7	122.2	152.4	-84.8	-20.6	0	0	0	106	T893 L897	T893-N895 PolarHBondContact O-N 2.87Å; N895-L897 PolarHBondContact O-N 3.05Å
896	D	39.5	Very low	48.4	Very low	168 Å²	168	126.1 Å²	126.1	90%	0.898	63%	0.633	S	S	*	*			trans	-68.7	67.8	-165.7	-145.9	3.8	0	0	0	112.5
897	L	49.3	Very low	50.5	Low	119 Å²	119	116.1 Å²	116.1	62%	0.623	60%	0.598	S	S	*	*			trans	-91	97.2	164.2	-85.5	155.3	0	0	0	107.2	N895 L899	N895-L897 PolarHBondContact O-N 3.05Å; L897-L899 VanDerWaalsContact C-N 3.32Å; L897-L899 PolarHBondContact O-N 3.16Å
898	Q	48.7	Very low	52.7	Low	154 Å²	154	116.2 Å²	116.2	72%	0.72	59%	0.594	S	S	*	*			trans	-55.7	88	178.9	-156.6	177	31.8	0	0	111	R900	Q898-R900 PolarHBondContact O-N 3.15Å
899	L	58.1	Low	55	Low	101 Å²	101	110.7 Å²	110.7	53%	0.529	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-64.5	116	176.3	-83.4	152.4	0	0	0	108.7	L897 S947 V949	L897-L899 VanDerWaalsContact C-N 3.32Å; L897-L899 PolarHBondContact O-N 3.16Å; L899-S947 VanDerWaalsContact CD2-CB 3.48Å; L899-V949 HydrophobicContact CD2-CG2 3.98Å
900	R	65.6	Low	57.6	Low	99 Å²	99	102.6 Å²	102.6	37%	0.374	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	118	177.6	-70.9	-170.7	176.4	-169.1	-2.2	109.8	Q898 S947 Y948 V949	Q898-R900 PolarHBondContact O-N 3.15Å; R900-S947 PolarHBondContact N-O 3.28Å; R900-Y948 HydrophobicContact CB-CD1 4.33Å; R900-Y948 WeakPolarHBondContact O-CA 3.43Å; R900-V949 PolarHBondContact O-N 2.92Å
901	V	69.6	Low	60.2	Low	71 Å²	71	101.3 Å²	101.3	43%	0.43	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	125.6	173.8	-173	0	0	0	0	108.7	D903	V901-D903 VanDerWaalsContact CG1-OD1 3.29Å; V901-D903 WeakPolarHBondContact CG1-OD1 3.49Å; V901-D903 WeakPolarHBondContact CG1-OD2 3.42Å
902	Q	73.4	Confident	63.1	Low	6 Å²	6	90.4 Å²	90.4	3%	0.028	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	100.7	178.5	-162.4	59.8	50.9	0	0	108.2	F827 L832 T906 A907 V949 R951	F827-Q902 VanDerWaalsContact CD2-CD 3.44Å; L832-Q902 HydrophobicContact CD1-CG 3.41Å; L832-Q902 VanDerWaalsContact CD1-CG 3.41Å; Q902-T906 PolarHBondContact NE2-O 2.75Å; Q902-T906 VanDerWaalsContact NE2-O 3.08Å; Q902-T906 PolarHBondContact NE2-OG1 3.44Å; Q902-A907 HydrophobicContact CG-CB 4.22Å; Q902-A907 VanDerWaalsContact NE2-N 3.15Å; Q902-V949 PolarHBondContact N-O 2.92Å; Q902-R951 PolarHBondContact O-N 3.25Å; Q902-R951 VanDerWaalsContact O-N 3.1Å
903	D	69.9	Low	65.6	Low	23 Å²	23	87.5 Å²	87.5	12%	0.123	45%	0.447	C	S	.	.			trans	-113.1	170.9	-178	-67.5	-32	0	0	0	109.8	V901 N905 T906 A907 R951	V901-D903 VanDerWaalsContact CG1-OD1 3.29Å; V901-D903 WeakPolarHBondContact CG1-OD1 3.49Å; V901-D903 WeakPolarHBondContact CG1-OD2 3.42Å; D903-N905 PolarHBondContact O-N 2.82Å; D903-T906 PolarHBondContact N-OG1 2.85Å; D903-T906 VanDerWaalsContact N-OG1 3.17Å; D903-T906 PolarHBondContact O-N 3.39Å; D903-T906 PolarHBondContact O-OG1 3.15Å; D903-A907 PolarHBondContact O-N 3.44Å; D903-R951 WeakPolarHBondContact OD1-CB 3.29Å; D903-R951 IonicContact OD1-CZ 3.22Å; D903-R951 IonicContact OD1-NE 3.25Å; D903-R951 PolarHBondContact OD1-NE 2.96Å; D903-R951 IonicContact OD1-NH2 3.97Å; D903-R951 PolarHBondContact OD1-NH2 3.19Å; D903-R951 IonicContact OD2-CZ 2.71Å; D903-R951 VanDerWaalsContact OD2-CZ 3.31Å; D903-R951 IonicContact OD2-NE 3.4Å; D903-R951 IonicContact OD2-NH2 3.1Å; D903-R951 PolarHBondContact OD2-NH2 3.02Å
904	C	67.4	Low	68.5	Low	27 Å²	27	82.1 Å²	82.1	18%	0.182	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-7.5	170.6	-75.5	0	0	0	0	115	E822 W823 C909	E822-C904 HydrophobicContact CB-CB 4.35Å; W823-C904 VanDerWaalsContact C-SG 3.6Å; C904-C909 HydrophobicContact CB-CB 3.45Å; C904-C909 VanDerWaalsContact CB-CB 3.45Å; C904-C909 WeakPolarHBondContact CB-SG 3.43Å; C904-C909 WeakPolarHBondContact SG-CB 3.29Å; C904-C909 CovalentContact SG-SG 2.03Å; C904-C909 PolarHBondContact SG-SG 3.44Å
905	N	73.4	Confident	71.1	Confident	152 Å²	152	80.4 Å²	80.4	81%	0.813	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-24.7	169.7	-68.1	-20.3	0	0	0	113	D903	D903-N905 PolarHBondContact O-N 2.82Å
906	T	71.7	Confident	73.9	Confident	79 Å²	79	74.1 Å²	74.1	49%	0.485	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-14.5	-173.6	50.8	0	0	0	0	113.2	F827 Q902 D903	F827-T906 WeakPolarHBondContact CD2-O 3.09Å; Q902-T906 PolarHBondContact NE2-O 2.75Å; Q902-T906 VanDerWaalsContact NE2-O 3.08Å; Q902-T906 PolarHBondContact NE2-OG1 3.44Å; D903-T906 PolarHBondContact N-OG1 2.85Å; D903-T906 VanDerWaalsContact N-OG1 3.17Å; D903-T906 PolarHBondContact O-N 3.39Å; D903-T906 PolarHBondContact O-OG1 3.15Å
907	A	73.3	Confident	76.2	Confident	12 Å²	12	67.3 Å²	67.3	10%	0.099	34%	0.342	C	S	.	.	S	Bend	trans	-118.5	157.2	174.1	0	0	0	0	0	110.7	P824 H826 F827 L832 Q902 D903 C909	P824-A907 HydrophobicContact CB-CB 4.15Å; H826-A907 WeakPolarHBondContact O-CA 3.33Å; H826-A907 VanDerWaalsContact O-CB 3.26Å; H826-A907 WeakPolarHBondContact O-CB 3.21Å; F827-A907 HydrophobicContact CB-CB 4.42Å; L832-A907 HydrophobicContact CD1-CB 4.1Å; Q902-A907 HydrophobicContact CG-CB 4.22Å; Q902-A907 VanDerWaalsContact NE2-N 3.15Å; D903-A907 PolarHBondContact O-N 3.44Å; A907-C909 PolarHBondContact O-N 2.88Å
908	E	79.1	Confident	78	Confident	137 Å²	137	67.8 Å²	67.8	64%	0.64	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.5	127.9	166.7	-72.2	179.1	176.6	0	0	109.3	Y825 H826	Y825-E908 PolarHBondContact N-O 2.7Å; H826-E908 HydrophobicContact CB-CB 4.04Å; H826-E908 IonicContact CD2-OE2 3.44Å; H826-E908 PolarHBondContact N-O 2.97Å; H826-E908 PolarHBondContact O-N 3.19Å
909	C	82.1	Confident	79.9	Confident	47 Å²	47	60.6 Å²	60.6	32%	0.318	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	132.8	-168.9	-165.2	0	0	0	0	111.3	E822 W823 C904 A907	E822-C909 VanDerWaalsContact CB-SG 3.52Å; W823-C909 PolarHBondContact N-SG 2.83Å; W823-C909 VanDerWaalsContact N-SG 3.38Å; W823-C909 CarbonylContact O-C 3.49Å; W823-C909 WeakPolarHBondContact O-CA 3.5Å; C904-C909 HydrophobicContact CB-CB 3.45Å; C904-C909 VanDerWaalsContact CB-CB 3.45Å; C904-C909 WeakPolarHBondContact CB-SG 3.43Å; C904-C909 WeakPolarHBondContact SG-CB 3.29Å; C904-C909 CovalentContact SG-SG 2.03Å; C904-C909 PolarHBondContact SG-SG 3.44Å; A907-C909 PolarHBondContact O-N 2.88Å
910	L	85.6	Confident	81.1	Confident	6 Å²	6	60 Å²	60	3%	0.031	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	128.4	168	-179.4	156.1	0	0	0	108.2	W823 I835 T848 V850 L912	W823-L910 HydrophobicContact CB-CB 4.29Å; W823-L910 HydrophobicContact CB-CD2 4.43Å; W823-L910 WeakPolarHBondContact CB-O 3.31Å; W823-L910 PolarHBondContact N-O 2.96Å; W823-L910 PolarHBondContact O-N 2.89Å; I835-L910 HydrophobicContact CD1-CD1 4.2Å; I835-L910 HydrophobicContact CD1-CD2 4.06Å; T848-L910 HydrophobicContact CG2-CD2 4.3Å; V850-L910 HydrophobicContact CB-CD1 4.01Å; V850-L910 HydrophobicContact CB-CG 4.47Å; L910-L912 HydrophobicContact CD2-CB 4.33Å
911	K	88.4	Confident	82	Confident	70 Å²	70	60.2 Å²	60.2	30%	0.304	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	128.5	175.3	-70.2	176.3	168.2	-108.2	0	109.9	E820 E822 D849	E820-K911 WeakPolarHBondContact OE1-CD 3.24Å; E820-K911 IonicContact OE1-NZ 2.75Å; E820-K911 PolarHBondContact OE1-NZ 3.35Å; E822-K911 IonicContact OE1-NZ 3.74Å; D849-K911 PolarHBondContact N-O 3.41Å; D849-K911 WeakPolarHBondContact OD2-CB 3.35Å
912	L	89.6	Confident	82.7	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.01	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	114.3	174.5	-176.8	158.7	0	0	0	107.4	E820 V821 F838 C846 T848 L910 C914 L927 I929	E820-L912 WeakPolarHBondContact CA-O 3.47Å; V821-L912 HydrophobicContact CB-CB 4.29Å; V821-L912 HydrophobicContact CG2-CD2 4.39Å; V821-L912 PolarHBondContact N-O 2.72Å; V821-L912 PolarHBondContact O-N 2.86Å; F838-L912 HydrophobicContact CD1-CD1 4.47Å; F838-L912 HydrophobicContact CG-CD1 4.48Å; C846-L912 HydrophobicContact CB-CD2 3.9Å; T848-L912 HydrophobicContact CG2-CB 4.06Å; T848-L912 HydrophobicContact CG2-CD1 3.79Å; T848-L912 HydrophobicContact CG2-CG 3.77Å; L910-L912 HydrophobicContact CD2-CB 4.33Å; L912-C914 WeakPolarHBondContact CD2-SG 3.49Å; L912-L927 HydrophobicContact CD2-CD2 3.63Å; L912-I929 HydrophobicContact CD1-CD1 4.25Å
913	R	91.6	Very high	83.3	Confident	125 Å²	125	67.2 Å²	67.2	47%	0.472	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	126.3	-177.8	-67	-179.7	178	173.8	3.3	109.6	E820 C846 T847	E820-R913 HydrophobicContact CG-CG 4.47Å; C846-R913 CarbonylContact C-O 3.39Å; C846-R913 WeakPolarHBondContact CA-O 3.29Å; T847-R913 PolarHBondContact N-O 3.21Å; T847-R913 PolarHBondContact O-N 2.83Å; T847-R913 PolarHBondContact OG1-O 3.38Å
914	C	91.8	Very high	84.3	Confident	1 Å²	1	69 Å²	69	1%	0.007	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	132.9	178.3	-61	0	0	0	0	110.9	S818 L819 I844 N845 C846 L912	S818-C914 WeakPolarHBondContact CA-O 3.36Å; L819-C914 HydrophobicContact CB-CB 4.08Å; L819-C914 HydrophobicContact CD2-CB 4.03Å; L819-C914 PolarHBondContact N-O 2.94Å; L819-C914 WeakPolarHBondContact O-CB 3.25Å; L819-C914 PolarHBondContact O-N 2.91Å; I844-C914 HydrophobicContact CD1-CB 3.68Å; I844-C914 HydrophobicContact CG1-CB 3.7Å; N845-C914 CarbonylContact O-C 3.54Å; N845-C914 VanDerWaalsContact O-CA 3.3Å; N845-C914 WeakPolarHBondContact O-CA 3.3Å; C846-C914 HydrophobicContact CB-CB 4.09Å; C846-C914 WeakPolarHBondContact CB-SG 3.37Å; C846-C914 WeakPolarHBondContact SG-CB 3.41Å; C846-C914 CovalentContact SG-SG 2.04Å; C846-C914 PolarHBondContact SG-SG 3.4Å; L912-C914 WeakPolarHBondContact CD2-SG 3.49Å
915	Q	92.3	Very high	85.4	Confident	153 Å²	153	67.7 Å²	67.7	72%	0.715	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	119.2	168.3	-64.7	-178.6	-4.1	0	0	108.4	I844 N845	I844-Q915 WeakPolarHBondContact CA-O 3.41Å; N845-Q915 PolarHBondContact N-O 3.37Å; N845-Q915 PolarHBondContact O-N 2.85Å
916	V	91.3	Very high	86.3	Confident	4 Å²	4	61.5 Å²	61.5	2%	0.024	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	128.7	176	-173.6	0	0	0	0	108.4	L806 K816 A817 L819 P843 I844 L919 A925	L806-V916 HydrophobicContact CD2-CB 4.44Å; L806-V916 HydrophobicContact CD2-CG1 4.28Å; L806-V916 HydrophobicContact CD2-CG2 3.97Å; K816-V916 WeakPolarHBondContact CA-O 3.46Å; A817-V916 HydrophobicContact CB-CB 4.2Å; A817-V916 PolarHBondContact N-O 3.41Å; A817-V916 PolarHBondContact O-N 2.76Å; L819-V916 HydrophobicContact CB-CG2 4.3Å; P843-V916 CarbonylContact O-C 3.5Å; P843-V916 WeakPolarHBondContact O-CA 3.49Å; I844-V916 HydrophobicContact CB-CG2 4.35Å; I844-V916 HydrophobicContact CD1-CG2 3.89Å; I844-V916 HydrophobicContact CG1-CG2 3.86Å; V916-L919 HydrophobicContact CG1-CD1 3.46Å; V916-L919 VanDerWaalsContact CG1-CD1 3.46Å; V916-L919 HydrophobicContact CG1-CG 3.89Å; V916-A925 HydrophobicContact CG1-CB 3.97Å
917	G	87.9	Confident	87.3	Confident	25 Å²	25	57.8 Å²	57.8	26%	0.258	27%	0.272	S	S	.	.			trans	-78.4	-153.4	176.3	0	0	0	0	0	112.9	S815 P843 L919	S815-G917 CarbonylContact O-C 3.55Å; P843-G917 PolarHBondContact O-N 2.82Å; G917-L919 PolarHBondContact O-N 2.79Å
918	R	88.4	Confident	88.2	Confident	130 Å²	130	59.3 Å²	59.3	49%	0.491	28%	0.276	S	S	.	.			trans	-65.2	120.3	-176.9	-167.4	-177.8	-168	-153.9	11.4	110.6	E730 T813 F814 S815 E920	E730-R918 IonicContact OE1-CZ 3.79Å; E730-R918 IonicContact OE1-NH2 2.76Å; E730-R918 PolarHBondContact OE1-NH2 2.93Å; T813-R918 HydrophobicContact CG2-CG 3.67Å; F814-R918 WeakPolarHBondContact O-CA 3.23Å; S815-R918 PolarHBondContact O-N 3.34Å; R918-E920 IonicContact NH1-OE1 2.76Å
919	L	86.7	Confident	88.7	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.01	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-118.2	107.1	174.7	-81.9	177.7	0	0	0	110.8	L806 N808 F814 P843 V916 G917 K923 A925	L806-L919 HydrophobicContact CD2-CD1 4.12Å; L806-L919 HydrophobicContact CG-CD1 4.33Å; N808-L919 PolarHBondContact ND2-O 3.4Å; N808-L919 VanDerWaalsContact ND2-O 3.08Å; F814-L919 HydrophobicContact CD2-CB 4.27Å; F814-L919 HydrophobicContact CE1-CB 4Å; F814-L919 HydrophobicContact CE2-CB 3.65Å; F814-L919 HydrophobicContact CE2-CD1 3.75Å; F814-L919 HydrophobicContact CE2-CG 4.1Å; F814-L919 HydrophobicContact CZ-CB 3.51Å; F814-L919 HydrophobicContact CZ-CD1 3.46Å; F814-L919 VanDerWaalsContact CZ-CD1 3.46Å; F814-L919 HydrophobicContact CZ-CG 4.06Å; F814-L919 PolarHBondContact N-O 3.36Å; F814-L919 PolarHBondContact O-N 3.01Å; P843-L919 HydrophobicContact CG-CD2 4.02Å; P843-L919 HydrophobicContact CG-CG 4.41Å; V916-L919 HydrophobicContact CG1-CD1 3.46Å; V916-L919 VanDerWaalsContact CG1-CD1 3.46Å; V916-L919 HydrophobicContact CG1-CG 3.89Å; G917-L919 PolarHBondContact O-N 2.79Å; L919-K923 HydrophobicContact CD2-CB 3.89Å; L919-A925 HydrophobicContact CD1-CB 4.18Å
920	E	85.2	Confident	89.1	Confident	89 Å²	89	52.8 Å²	52.8	42%	0.416	24%	0.239	S	C	.	.			trans	-73.5	172.5	175.4	-61.7	175.8	177	0	0	111.7	T813 R918 N922 K923	T813-E920 HydrophobicContact CG2-CG 4.14Å; R918-E920 IonicContact NH1-OE1 2.76Å; E920-N922 PolarHBondContact O-N 2.78Å; E920-K923 HydrophobicContact CB-CG 3.99Å; E920-K923 WeakPolarHBondContact O-CB 3.27Å; E920-K923 PolarHBondContact O-N 2.88Å; E920-K923 VanDerWaalsContact O-N 3.1Å
921	R	83.8	Confident	89.2	Confident	104 Å²	104	52.5 Å²	52.5	39%	0.392	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	131.8	176.6	-179.4	-175.1	-179	-178.3	12.9	111.1	D646 K923	D646-R921 IonicContact OD1-CZ 3.5Å; D646-R921 VanDerWaalsContact OD1-CZ 3.22Å; D646-R921 IonicContact OD1-NH1 2.7Å; D646-R921 PolarHBondContact OD1-NH1 3.37Å; D646-R921 IonicContact OD1-NH2 3.37Å; D646-R921 PolarHBondContact OD1-NH2 2.98Å; D646-R921 VanDerWaalsContact OD1-NH2 3.08Å; D646-R921 IonicContact OD2-CZ 3.24Å; D646-R921 IonicContact OD2-NH1 3.71Å; D646-R921 IonicContact OD2-NH2 2.97Å; D646-R921 PolarHBondContact OD2-NH2 3.41Å; R921-K923 PolarHBondContact O-N 3.02Å; R921-K923 VanDerWaalsContact O-N 3.13Å
922	N	83.1	Confident	89.2	Confident	104 Å²	104	49.5 Å²	49.5	56%	0.556	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	59	15.7	179.9	-57.8	-27.7	0	0	0	115	N808 E920	N808-N922 WeakPolarHBondContact O-CA 3.29Å; N808-N922 PolarHBondContact O-N 3.49Å; E920-N922 PolarHBondContact O-N 2.78Å
923	K	87.3	Confident	89	Confident	120 Å²	120	49.4 Å²	49.4	52%	0.522	22%	0.224	S	C	.	.			trans	-91.7	149.1	169.5	-63.4	-63.8	-174	174.1	0	110.3	N808 L919 E920 R921	N808-K923 PolarHBondContact N-O 3.11Å; N808-K923 VanDerWaalsContact N-O 3.17Å; L919-K923 HydrophobicContact CD2-CB 3.89Å; E920-K923 HydrophobicContact CB-CG 3.99Å; E920-K923 WeakPolarHBondContact O-CB 3.27Å; E920-K923 PolarHBondContact O-N 2.88Å; E920-K923 VanDerWaalsContact O-N 3.1Å; R921-K923 PolarHBondContact O-N 3.02Å; R921-K923 VanDerWaalsContact O-N 3.13Å
924	N	90.6	Very high	88.6	Confident	59 Å²	59	44.8 Å²	44.8	32%	0.316	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	160	-179.8	59.7	-2.6	0	0	0	112.2	E805 L806 L807	E805-N924 HydrophobicContact CG-CB 4.1Å; E805-N924 PolarHBondContact OE1-ND2 2.89Å; L806-N924 CarbonylContact O-C 3.57Å; L806-N924 WeakPolarHBondContact O-CA 3.18Å; L806-N924 WeakPolarHBondContact O-CB 3.17Å; L807-N924 HydrophobicContact CB-CB 4.44Å; L807-N924 HydrophobicContact CD1-CB 4.05Å
925	A	91.1	Very high	88	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.008	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	130.9	167	0	0	0	0	0	108	L806 I844 V916 L919	L806-A925 PolarHBondContact N-O 2.71Å; L806-A925 PolarHBondContact O-N 2.98Å; I844-A925 HydrophobicContact CB-CB 4.15Å; I844-A925 HydrophobicContact CG2-CB 4.31Å; V916-A925 HydrophobicContact CG1-CB 3.97Å; L919-A925 HydrophobicContact CD1-CB 4.18Å
926	I	92.4	Very high	87.3	Confident	22 Å²	22	40.4 Å²	40.4	11%	0.113	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	136.2	-172.8	-49.5	172	0	0	0	109.9	V803 Y804 E805 E841 F928	V803-I926 HydrophobicContact CG1-CG2 3.62Å; Y804-I926 CarbonylContact O-C 3.56Å; Y804-I926 VanDerWaalsContact O-CA 3.29Å; Y804-I926 WeakPolarHBondContact O-CA 3.48Å; E805-I926 HydrophobicContact CB-CG1 4.4Å; E805-I926 HydrophobicContact CG-CG1 4.19Å; E841-I926 HydrophobicContact CB-CB 4.29Å; E841-I926 PolarHBondContact N-O 3.41Å; E841-I926 PolarHBondContact O-N 3.26Å; I926-F928 HydrophobicContact CB-CE2 4.09Å; I926-F928 HydrophobicContact CB-CZ 4.34Å; I926-F928 HydrophobicContact CG2-CD2 4.16Å; I926-F928 HydrophobicContact CG2-CE1 4.06Å; I926-F928 HydrophobicContact CG2-CE2 3.58Å; I926-F928 HydrophobicContact CG2-CZ 3.53Å
927	L	92.6	Very high	86.5	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	121.3	174.4	174.4	67.5	0	0	0	109.6	V803 Y804 L819 V821 F838 T840 L912 I929	V803-L927 WeakPolarHBondContact CA-O 3.38Å; Y804-L927 PolarHBondContact N-O 3.13Å; Y804-L927 PolarHBondContact O-N 2.91Å; L819-L927 HydrophobicContact CD2-CD2 4.24Å; V821-L927 HydrophobicContact CG2-CD2 3.82Å; F838-L927 HydrophobicContact CB-CD1 4.31Å; F838-L927 HydrophobicContact CD2-CD1 4.01Å; T840-L927 HydrophobicContact CG2-CD1 3.88Å; L912-L927 HydrophobicContact CD2-CD2 3.63Å; L927-I929 HydrophobicContact CD1-CG1 4.47Å; L927-I929 HydrophobicContact CD2-CD1 4.01Å; L927-I929 HydrophobicContact CD2-CG1 4.16Å; L927-I929 HydrophobicContact CG-CD1 4.4Å; L927-I929 HydrophobicContact CG-CG1 4Å
928	F	91.4	Very high	85.9	Confident	44 Å²	44	39.3 Å²	39.3	19%	0.193	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	120.3	175.2	-59.1	-87.3	0	0	0	109.2	L801 V803 F838 E839 E841 I926 Y930	L801-F928 HydrophobicContact CD1-CB 4.14Å; L801-F928 HydrophobicContact CD1-CD1 4.35Å; V803-F928 HydrophobicContact CB-CD1 4.4Å; V803-F928 HydrophobicContact CG1-CD1 3.93Å; V803-F928 HydrophobicContact CG1-CE1 3.75Å; V803-F928 HydrophobicContact CG1-CZ 4.47Å; V803-F928 HydrophobicContact CG2-CD1 3.75Å; V803-F928 HydrophobicContact CG2-CE1 4.05Å; F838-F928 CarbonylContact C-O 3.58Å; F838-F928 WeakPolarHBondContact CA-O 3.2Å; F838-F928 VanDerWaalsContact CB-O 3.28Å; F838-F928 WeakPolarHBondContact CB-O 3.37Å; E839-F928 HydrophobicContact CB-CB 4.21Å; E839-F928 HydrophobicContact CB-CD2 4.4Å; E839-F928 PolarHBondContact N-O 3.05Å; E839-F928 PolarHBondContact O-N 3.37Å; E841-F928 HydrophobicContact CB-CE2 4.07Å; I926-F928 HydrophobicContact CB-CE2 4.09Å; I926-F928 HydrophobicContact CB-CZ 4.34Å; I926-F928 HydrophobicContact CG2-CD2 4.16Å; I926-F928 HydrophobicContact CG2-CE1 4.06Å; I926-F928 HydrophobicContact CG2-CE2 3.58Å; I926-F928 HydrophobicContact CG2-CZ 3.53Å; F928-Y930 HydrophobicContact CB-CE2 4.08Å
929	I	90.4	Very high	85	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	112.6	177.4	-56	178.5	0	0	0	108.7	L801 H802 Y804 V821 W823 I835 F838 L912 L927	L801-I929 WeakPolarHBondContact CA-O 3.36Å; H802-I929 HydrophobicContact CB-CB 4.4Å; H802-I929 PolarHBondContact N-O 2.88Å; H802-I929 PolarHBondContact O-N 3.46Å; Y804-I929 HydrophobicContact CD2-CD1 4.26Å; Y804-I929 HydrophobicContact CE2-CD1 4.11Å; V821-I929 HydrophobicContact CG1-CD1 4.08Å; W823-I929 HydrophobicContact CE3-CD1 4.13Å; W823-I929 HydrophobicContact CE3-CG2 4.32Å; W823-I929 HydrophobicContact CH2-CB 4.48Å; W823-I929 HydrophobicContact CH2-CG2 3.89Å; W823-I929 HydrophobicContact CZ2-CG2 4.31Å; W823-I929 HydrophobicContact CZ3-CB 4.27Å; W823-I929 HydrophobicContact CZ3-CD1 4.06Å; W823-I929 HydrophobicContact CZ3-CG2 3.89Å; I835-I929 HydrophobicContact CD1-CG2 4.34Å; I835-I929 HydrophobicContact CG1-CG2 4.36Å; I835-I929 HydrophobicContact CG2-CG2 4.08Å; F838-I929 HydrophobicContact CB-CG1 4.48Å; L912-I929 HydrophobicContact CD1-CD1 4.25Å; L927-I929 HydrophobicContact CD1-CG1 4.47Å; L927-I929 HydrophobicContact CD2-CD1 4.01Å; L927-I929 HydrophobicContact CD2-CG1 4.16Å; L927-I929 HydrophobicContact CG-CD1 4.4Å; L927-I929 HydrophobicContact CG-CG1 4Å
930	Y	89.6	Confident	84.2	Confident	47 Å²	47	40.4 Å²	40.4	18%	0.184	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	113.2	177.1	-60.7	-84.9	0	0	0	110.1	L801 T836 S837 E839 F928	L801-Y930 HydrophobicContact CD1-CD1 3.84Å; L801-Y930 HydrophobicContact CD1-CE1 3.75Å; L801-Y930 HydrophobicContact CD1-CG 4.35Å; T836-Y930 PolarHBondContact N-O 3.01Å; T836-Y930 PolarHBondContact OG1-O 3.1Å; S837-Y930 PolarHBondContact N-O 2.8Å; S837-Y930 WeakPolarHBondContact O-CA 3.42Å; S837-Y930 WeakPolarHBondContact O-CB 3.22Å; S837-Y930 PolarHBondContact O-N 2.92Å; E839-Y930 HydrophobicContact CB-CE2 4.14Å; E839-Y930 HydrophobicContact CG-CE2 3.79Å; E839-Y930 WeakPolarHBondContact OE2-CE2 3.46Å; E839-Y930 PolarHBondContact OE2-OH 2.79Å; F928-Y930 HydrophobicContact CB-CE2 4.08Å
931	S	88.7	Confident	83	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	163.6	-179.8	68.9	0	0	0	0	112.6	Q799 I800 W823 Y834	Q799-S931 CarbonylContact C-O 3.56Å; Q799-S931 WeakPolarHBondContact CA-O 3.44Å; I800-S931 PolarHBondContact N-O 3.17Å; I800-S931 PolarHBondContact O-N 2.81Å; I800-S931 PolarHBondContact O-OG 2.84Å; W823-S931 WeakPolarHBondContact CZ2-OG 3.5Å; Y834-S931 CarbonylContact O-C 3.57Å; Y834-S931 WeakPolarHBondContact O-CA 3.5Å
932	R	86.9	Confident	82	Confident	7 Å²	7	42.9 Å²	42.9	3%	0.026	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	132.7	175.5	-63.8	-72.3	178.2	162.1	3.1	108.9	G793 D794 I796 G797 P798 Y834 T836 N859 D934	G793-R932 WeakPolarHBondContact O-CD 3.27Å; D794-R932 IonicContact OD1-CZ 3.94Å; D794-R932 IonicContact OD1-NH1 2.66Å; D794-R932 PolarHBondContact OD1-NH1 3.31Å; D794-R932 IonicContact OD1-NH2 2.71Å; D794-R932 PolarHBondContact OD1-NH2 3.35Å; I796-R932 HydrophobicContact CB-CB 4.36Å; I796-R932 HydrophobicContact CG2-CB 4.03Å; G797-R932 WeakPolarHBondContact O-CD 3.43Å; G797-R932 PolarHBondContact O-NH1 3.24Å; P798-R932 WeakPolarHBondContact O-CA 3.47Å; Y834-R932 PolarHBondContact N-O 3.36Å; Y834-R932 PolarHBondContact O-N 2.66Å; T836-R932 HydrophobicContact CG2-CG 3.61Å; N859-R932 PolarHBondContact OD1-NH2 2.96Å; N859-R932 VanDerWaalsContact OD1-NH2 3.08Å; R932-D934 PolarHBondContact O-N 2.94Å
933	L	86.1	Confident	80.9	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	122.7	172.6	-169.7	72	0	0	0	109.2	V777 I796 G797 P798 I800 L833 V935 F938 V981	V777-L933 HydrophobicContact CB-CD2 4.2Å; V777-L933 HydrophobicContact CG1-CD2 3.83Å; V777-L933 HydrophobicContact CG2-CD2 4.42Å; I796-L933 CarbonylContact C-O 3.55Å; G797-L933 WeakPolarHBondContact CA-O 3.49Å; P798-L933 HydrophobicContact CG-CB 4.03Å; P798-L933 HydrophobicContact CG-CD2 4.38Å; P798-L933 PolarHBondContact O-N 2.94Å; P798-L933 VanDerWaalsContact O-N 3.07Å; I800-L933 HydrophobicContact CD1-CB 3.79Å; I800-L933 HydrophobicContact CD1-CD1 4.08Å; I800-L933 HydrophobicContact CD1-CG 4.41Å; L833-L933 HydrophobicContact CD2-CD1 3.77Å; L933-V935 PolarHBondContact O-N 3.02Å; L933-F938 HydrophobicContact CD1-CD2 4.36Å; L933-F938 HydrophobicContact CD1-CE2 3.49Å; L933-F938 VanDerWaalsContact CD1-CE2 3.49Å; L933-F938 HydrophobicContact CD1-CZ 3.99Å; L933-F938 HydrophobicContact CD2-CE2 4.36Å; L933-F938 HydrophobicContact CG-CD2 4.24Å; L933-F938 HydrophobicContact CG-CE2 3.82Å; L933-V981 HydrophobicContact CD1-CG2 4.04Å; L933-V981 HydrophobicContact CD2-CG1 4.25Å; L933-V981 HydrophobicContact CD2-CG2 3.99Å
934	D	82.7	Confident	79.8	Confident	28 Å²	28	36.7 Å²	36.7	15%	0.15	18%	0.18	C	C	.	.			trans	-77.7	92.5	175.4	179.3	2.9	0	0	0	110.4	I796 S831 L832 R932 N936 N937 F938	I796-D934 HydrophobicContact CG2-CB 4.17Å; S831-D934 WeakPolarHBondContact CB-OD2 3.09Å; S831-D934 PolarHBondContact N-OD2 3.12Å; S831-D934 WeakPolarHBondContact O-CB 3.48Å; L832-D934 PolarHBondContact O-N 2.93Å; R932-D934 PolarHBondContact O-N 2.94Å; D934-N936 PolarHBondContact O-N 2.84Å; D934-N936 VanDerWaalsContact OD1-CB 3.27Å; D934-N936 WeakPolarHBondContact OD1-CB 3.46Å; D934-N936 PolarHBondContact OD1-N 3.18Å; D934-N936 VanDerWaalsContact OD1-N 3.13Å; D934-N937 PolarHBondContact O-N 3.27Å; D934-F938 WeakPolarHBondContact O-CD2 3.25Å
935	V	80.4	Confident	78.6	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-64.8	-27.7	-175.9	-177.3	0	0	0	0	111.4	L779 I781 W784 I796 L933 N937 F938 L939	L779-V935 HydrophobicContact CD2-CG1 4.1Å; I781-V935 HydrophobicContact CD1-CG1 4.41Å; I781-V935 HydrophobicContact CD1-CG2 3.58Å; W784-V935 HydrophobicContact CD2-CB 4.2Å; W784-V935 HydrophobicContact CD2-CG1 4.05Å; W784-V935 HydrophobicContact CE3-CB 4.31Å; W784-V935 HydrophobicContact CE3-CG1 3.83Å; W784-V935 HydrophobicContact CH2-CB 3.9Å; W784-V935 HydrophobicContact CH2-CG1 4.15Å; W784-V935 HydrophobicContact CZ2-CB 3.78Å; W784-V935 HydrophobicContact CZ2-CG1 4.35Å; W784-V935 HydrophobicContact CZ3-CB 4.18Å; W784-V935 HydrophobicContact CZ3-CG1 3.91Å; I796-V935 PolarHBondContact O-N 2.81Å; L933-V935 PolarHBondContact O-N 3.02Å; V935-N937 VanDerWaalsContact C-N 3.29Å; V935-N937 PolarHBondContact O-N 2.03Å; V935-F938 PolarHBondContact O-N 2.9Å; V935-L939 HydrophobicContact CG1-CD1 3.71Å; V935-L939 HydrophobicContact CG1-CG 4.1Å; V935-L939 WeakPolarHBondContact O-CG 3.47Å; V935-L939 PolarHBondContact O-N 2.93Å
936	N	75.9	Confident	77.7	Confident	61 Å²	61	44.6 Å²	44.6	33%	0.326	21%	0.214	S	C	.	.	H	α-helix	trans	-63.2	-36.4	-179.7	-165.6	21.4	0	0	0	111.6	W784 D934 L939	W784-N936 HydrophobicContact CH2-CB 4.1Å; D934-N936 PolarHBondContact O-N 2.84Å; D934-N936 VanDerWaalsContact OD1-CB 3.27Å; D934-N936 WeakPolarHBondContact OD1-CB 3.46Å; D934-N936 PolarHBondContact OD1-N 3.18Å; D934-N936 VanDerWaalsContact OD1-N 3.13Å; N936-L939 PolarHBondContact O-N 3.44Å
937	N	75.8	Confident	76.9	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.011	22%	0.215	C	C	.	.	H	α-helix	trans	-68.6	-38.1	178.4	-166.6	19.2	0	0	0	112.6	S831 D934 V935 N943	S831-N937 WeakPolarHBondContact O-CB 3.4Å; S831-N937 PolarHBondContact O-ND2 2.04Å; D934-N937 PolarHBondContact O-N 3.27Å; V935-N937 VanDerWaalsContact C-N 3.29Å; V935-N937 PolarHBondContact O-N 2.03Å; N937-N943 PolarHBondContact O-ND2 3.38Å
938	F	74.4	Confident	76.3	Confident	3 Å²	3	44.6 Å²	44.6	1%	0.013	22%	0.216	C	C	.	.	H	α-helix	trans	-73.6	-29.4	177.3	-64.8	-78.8	0	0	0	112.2	L779 L832 L933 D934 V935 R940 N943 Y948 V981 W983	L779-F938 HydrophobicContact CD1-CB 3.54Å; L779-F938 HydrophobicContact CD1-CG 4.08Å; L832-F938 HydrophobicContact CD2-CE1 4.2Å; L832-F938 HydrophobicContact CD2-CE2 4.33Å; L832-F938 HydrophobicContact CD2-CZ 3.63Å; L933-F938 HydrophobicContact CD1-CD2 4.36Å; L933-F938 HydrophobicContact CD1-CE2 3.49Å; L933-F938 VanDerWaalsContact CD1-CE2 3.49Å; L933-F938 HydrophobicContact CD1-CZ 3.99Å; L933-F938 HydrophobicContact CD2-CE2 4.36Å; L933-F938 HydrophobicContact CG-CD2 4.24Å; L933-F938 HydrophobicContact CG-CE2 3.82Å; D934-F938 WeakPolarHBondContact O-CD2 3.25Å; V935-F938 PolarHBondContact O-N 2.9Å; F938-R940 VanDerWaalsContact C-N 3.3Å; F938-R940 PolarHBondContact O-N 3.38Å; F938-N943 CarbonylContact O-C 3.49Å; F938-Y948 AromaticContact CD1-CD2 3.79Å; F938-Y948 HydrophobicContact CD1-CD2 3.79Å; F938-Y948 HydrophobicContact CD1-CE2 4.13Å; F938-Y948 HydrophobicContact CD1-CG 4.38Å; F938-Y948 AromaticContact CE1-CD2 3.82Å; F938-Y948 HydrophobicContact CE1-CD2 3.82Å; F938-Y948 HydrophobicContact CE1-CE2 4.44Å; F938-Y948 AromaticContact CE1-CG 3.93Å; F938-Y948 HydrophobicContact CE1-CG 3.93Å; F938-V981 HydrophobicContact CD1-CG1 4.33Å; F938-V981 HydrophobicContact CE1-CG1 4.45Å; F938-W983 VanDerWaalsContact O-CZ2 3.31Å; F938-W983 WeakPolarHBondContact O-CZ2 3.48Å
939	L	71	Confident	75.9	Confident	53 Å²	53	43.9 Å²	43.9	28%	0.277	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-4.7	176.9	-71.8	168.2	0	0	0	114.6	W784 V935 N936 Q944 W983	W784-L939 HydrophobicContact CE3-CD1 3.81Å; W784-L939 HydrophobicContact CH2-CD1 4.2Å; W784-L939 HydrophobicContact CZ3-CD1 3.28Å; V935-L939 HydrophobicContact CG1-CD1 3.71Å; V935-L939 HydrophobicContact CG1-CG 4.1Å; V935-L939 WeakPolarHBondContact O-CG 3.47Å; V935-L939 PolarHBondContact O-N 2.93Å; N936-L939 PolarHBondContact O-N 3.44Å; L939-Q944 WeakPolarHBondContact O-CG 3.37Å; L939-Q944 PolarHBondContact O-NE2 3.28Å; L939-W983 HydrophobicContact CD2-CH2 3.57Å; L939-W983 HydrophobicContact CD2-CZ2 4.49Å; L939-W983 HydrophobicContact CD2-CZ3 4.27Å; L939-W983 HydrophobicContact CG-CH2 4.46Å
940	R	70	Confident	75.7	Confident	102 Å²	102	43.9 Å²	43.9	39%	0.385	22%	0.215	S	C	.	.	S	Bend	trans	-65.1	143.1	175.4	-68.6	-177	177.1	176.6	3.2	110.7	N829 F938 E942 N943 Q944	N829-R940 PolarHBondContact O-NH1 3.34Å; N829-R940 PolarHBondContact O-NH2 3.25Å; F938-R940 VanDerWaalsContact C-N 3.3Å; F938-R940 PolarHBondContact O-N 3.38Å; R940-E942 PolarHBondContact O-N 3.44Å; R940-N943 PolarHBondContact O-N 2.89Å; R940-Q944 WeakPolarHBondContact O-CG 3.39Å; R940-Q944 PolarHBondContact O-N 3.03Å
941	T	59.4	Low	75.5	Confident	121 Å²	121	45.5 Å²	45.5	74%	0.742	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-26.6	-178.1	36.1	0	0	0	0	114.3
942	E	62.3	Low	75.6	Confident	124 Å²	124	45.5 Å²	45.5	58%	0.579	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-21.7	177	-60.9	-179.7	-171.1	0	0	114.5	R940 R946	R940-E942 PolarHBondContact O-N 3.44Å; E942-R946 PolarHBondContact O-NH1 3.13Å
943	N	60.7	Low	75.7	Confident	6 Å²	6	46.5 Å²	46.5	3%	0.032	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.5	-8.2	-172.2	-65.3	-28.5	0	0	0	113.5	N937 F938 R940 Y948	N937-N943 PolarHBondContact O-ND2 3.38Å; F938-N943 CarbonylContact O-C 3.49Å; R940-N943 PolarHBondContact O-N 2.89Å; N943-Y948 HydrophobicContact CB-CE2 4.35Å; N943-Y948 WeakPolarHBondContact CB-OH 3.48Å; N943-Y948 PolarHBondContact OD1-OH 3.41Å
944	Q	63.8	Low	76	Confident	88 Å²	88	46.5 Å²	46.5	41%	0.411	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	145.4	175	-77.3	173.2	-2.4	0	0	111.8	L939 R940 R946 W983	L939-Q944 WeakPolarHBondContact O-CG 3.37Å; L939-Q944 PolarHBondContact O-NE2 3.28Å; R940-Q944 WeakPolarHBondContact O-CG 3.39Å; R940-Q944 PolarHBondContact O-N 3.03Å; Q944-R946 VanDerWaalsContact C-N 3.31Å; Q944-R946 PolarHBondContact O-N 3.26Å; Q944-W983 HydrophobicContact CG-CH2 4.25Å
945	N	64.9	Low	76.5	Confident	123 Å²	123	47.3 Å²	47.3	66%	0.658	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.6	24.8	-179.7	-67.1	-9.5	0	0	0	116
946	R	71.4	Confident	77.1	Confident	103 Å²	103	47.5 Å²	47.5	39%	0.389	24%	0.236	S	C	.	.			trans	-125.3	135.1	177.9	-68.9	-178.1	176.8	156.9	4.1	112.8	E942 Q944 Y948 W983	E942-R946 PolarHBondContact O-NH1 3.13Å; Q944-R946 VanDerWaalsContact C-N 3.31Å; Q944-R946 PolarHBondContact O-N 3.26Å; R946-Y948 HydrophobicContact CB-CE2 3.76Å; R946-Y948 VanDerWaalsContact O-CD2 3.24Å; R946-Y948 WeakPolarHBondContact O-CD2 3.24Å; R946-Y948 WeakPolarHBondContact O-CE2 3.34Å; R946-W983 PolarHBondContact O-NE1 2.86Å
947	S	77.4	Confident	77.9	Confident	18 Å²	18	50.1 Å²	50.1	13%	0.126	25%	0.247	C	C	.	.			trans	-86.7	131.8	176.2	-58.6	0	0	0	0	111.5	L899 R900 V981	L899-S947 VanDerWaalsContact CD2-CB 3.48Å; R900-S947 PolarHBondContact N-O 3.28Å; S947-V981 CarbonylContact C-O 3.54Å; S947-V981 VanDerWaalsContact CA-O 3.31Å; S947-V981 WeakPolarHBondContact CA-O 3.44Å
948	Y	79.9	Confident	78.5	Confident	5 Å²	5	50 Å²	50	2%	0.02	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	147	-179.8	-65.4	-92.8	0	0	0	110.7	R900 F938 N943 R946 V981	R900-Y948 HydrophobicContact CB-CD1 4.33Å; R900-Y948 WeakPolarHBondContact O-CA 3.43Å; F938-Y948 AromaticContact CD1-CD2 3.79Å; F938-Y948 HydrophobicContact CD1-CD2 3.79Å; F938-Y948 HydrophobicContact CD1-CE2 4.13Å; F938-Y948 HydrophobicContact CD1-CG 4.38Å; F938-Y948 AromaticContact CE1-CD2 3.82Å; F938-Y948 HydrophobicContact CE1-CD2 3.82Å; F938-Y948 HydrophobicContact CE1-CE2 4.44Å; F938-Y948 AromaticContact CE1-CG 3.93Å; F938-Y948 HydrophobicContact CE1-CG 3.93Å; N943-Y948 HydrophobicContact CB-CE2 4.35Å; N943-Y948 WeakPolarHBondContact CB-OH 3.48Å; N943-Y948 PolarHBondContact OD1-OH 3.41Å; R946-Y948 HydrophobicContact CB-CE2 3.76Å; R946-Y948 VanDerWaalsContact O-CD2 3.24Å; R946-Y948 WeakPolarHBondContact O-CD2 3.24Å; R946-Y948 WeakPolarHBondContact O-CE2 3.34Å; Y948-V981 PolarHBondContact N-O 3.41Å; Y948-V981 PolarHBondContact O-N 3.02Å
949	V	83.1	Confident	79	Confident	29 Å²	29	54.5 Å²	54.5	18%	0.176	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	111.3	168.7	-179.9	0	0	0	0	107.7	L899 R900 Q902 V979	L899-V949 HydrophobicContact CD2-CG2 3.98Å; R900-V949 PolarHBondContact O-N 2.92Å; Q902-V949 PolarHBondContact N-O 2.92Å; V949-V979 WeakPolarHBondContact CA-O 3.37Å
950	V	84.4	Confident	79.7	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.006	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	122	177.7	-173.5	0	0	0	0	108.2	P824 L833 S978 V979	P824-V950 HydrophobicContact CB-CG1 4.3Å; P824-V950 HydrophobicContact CG-CG1 3.42Å; P824-V950 VanDerWaalsContact CG-CG1 3.42Å; L833-V950 HydrophobicContact CD1-CB 4.32Å; L833-V950 HydrophobicContact CD1-CG1 3.49Å; L833-V950 VanDerWaalsContact CD1-CG1 3.49Å; L833-V950 HydrophobicContact CG-CG1 3.96Å; V950-S978 CarbonylContact O-C 3.59Å; V950-S978 VanDerWaalsContact O-CA 3.29Å; V950-S978 WeakPolarHBondContact O-CA 3.32Å; V950-V979 PolarHBondContact N-O 3.23Å; V950-V979 PolarHBondContact O-N 3.39Å
951	R	87.1	Confident	80.2	Confident	80 Å²	80	51.4 Å²	51.4	30%	0.302	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	130.9	-175.6	-171.6	177.8	69.5	159.5	0.8	111	P824 Q902 D903 V977	P824-R951 WeakPolarHBondContact CG-O 3.08Å; Q902-R951 PolarHBondContact O-N 3.25Å; Q902-R951 VanDerWaalsContact O-N 3.1Å; D903-R951 WeakPolarHBondContact OD1-CB 3.29Å; D903-R951 IonicContact OD1-CZ 3.22Å; D903-R951 IonicContact OD1-NE 3.25Å; D903-R951 PolarHBondContact OD1-NE 2.96Å; D903-R951 IonicContact OD1-NH2 3.97Å; D903-R951 PolarHBondContact OD1-NH2 3.19Å; D903-R951 IonicContact OD2-CZ 2.71Å; D903-R951 VanDerWaalsContact OD2-CZ 3.31Å; D903-R951 IonicContact OD2-NE 3.4Å; D903-R951 IonicContact OD2-NH2 3.1Å; D903-R951 PolarHBondContact OD2-NH2 3.02Å; R951-V977 CarbonylContact C-O 3.44Å; R951-V977 VanDerWaalsContact CA-O 3.27Å; R951-V977 WeakPolarHBondContact CA-O 3.31Å
952	S	89.2	Confident	81.1	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	136.3	171.4	55.9	0	0	0	0	109.9	H802 Y804 E822 T976 V977	H802-S952 PolarHBondContact CE1-OG 3.19Å; H802-S952 VanDerWaalsContact CE1-OG 3.29Å; H802-S952 PolarHBondContact ND1-OG 3.18Å; Y804-S952 VanDerWaalsContact OH-CB 3.29Å; Y804-S952 WeakPolarHBondContact OH-CB 3.41Å; Y804-S952 PolarHBondContact OH-O 3.19Å; Y804-S952 PolarHBondContact OH-OG 3.43Å; E822-S952 WeakPolarHBondContact O-CA 3.5Å; S952-T976 WeakPolarHBondContact O-CA 3.33Å; S952-V977 PolarHBondContact N-O 3.18Å; S952-V977 PolarHBondContact O-N 2.92Å
953	T	90.5	Very high	81.8	Confident	28 Å²	28	41.7 Å²	41.7	17%	0.172	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	138.8	-178.5	57	0	0	0	0	109	V821 E822 T976	V821-T953 CarbonylContact C-O 3.57Å; V821-T953 WeakPolarHBondContact CA-O 3.3Å; E822-T953 VanDerWaalsContact CB-OG1 3.27Å; E822-T953 WeakPolarHBondContact CB-OG1 3.49Å; E822-T953 WeakPolarHBondContact CG-OG1 3.47Å; E822-T953 PolarHBondContact N-O 2.93Å; E822-T953 PolarHBondContact O-N 2.94Å; E822-T953 PolarHBondContact OE2-OG1 3.02Å; T953-T976 HydrophobicContact CG2-CG2 3.67Å
954	A	92.4	Very high	81.9	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	122.1	172.2	0	0	0	0	0	109.1	I768 Y804 E820 V821 S974 T975	I768-A954 HydrophobicContact CD1-CB 3.7Å; Y804-A954 HydrophobicContact CD1-CB 3.38Å; Y804-A954 HydrophobicContact CE1-CB 3.25Å; Y804-A954 HydrophobicContact CG-CB 4.07Å; E820-A954 CarbonylContact O-C 3.6Å; E820-A954 VanDerWaalsContact O-CA 3.31Å; E820-A954 WeakPolarHBondContact O-CA 3.32Å; V821-A954 HydrophobicContact CG2-CB 3.97Å; A954-S974 CarbonylContact O-C 3.57Å; A954-S974 VanDerWaalsContact O-CA 3.24Å; A954-S974 WeakPolarHBondContact O-CA 3.39Å; A954-T975 PolarHBondContact N-O 3.04Å; A954-T975 PolarHBondContact O-N 3.36Å
955	S	92.8	Very high	82	Confident	45 Å²	45	52.1 Å²	52.1	32%	0.315	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	150.3	174.2	54.7	0	0	0	0	109.7	L819 E820 N973	L819-S955 CarbonylContact C-O 3.54Å; L819-S955 WeakPolarHBondContact CA-O 3.33Å; E820-S955 PolarHBondContact N-O 3.08Å; E820-S955 PolarHBondContact O-N 2.9Å; E820-S955 PolarHBondContact O-OG 3.4Å; S955-N973 WeakPolarHBondContact CA-O 3.21Å
956	F	93.3	Very high	82	Confident	5 Å²	5	48 Å²	48	2%	0.022	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	151.5	166.3	80.1	-88.8	0	0	0	110.7	A766 I768 L806 S818 L819 V958 A972 N973	A766-F956 HydrophobicContact CB-CD2 4.37Å; A766-F956 HydrophobicContact CB-CE2 3.37Å; A766-F956 HydrophobicContact CB-CZ 3.47Å; A766-F956 VanDerWaalsContact CB-CZ 3.47Å; A766-F956 WeakPolarHBondContact O-CZ 3.4Å; I768-F956 HydrophobicContact CB-CD1 3.6Å; I768-F956 HydrophobicContact CB-CE1 3.86Å; I768-F956 HydrophobicContact CD1-CD1 4.43Å; I768-F956 HydrophobicContact CG2-CD1 3.59Å; I768-F956 HydrophobicContact CG2-CE1 3.76Å; L806-F956 HydrophobicContact CD1-CB 4.12Å; L806-F956 HydrophobicContact CD1-CD1 3.59Å; L806-F956 HydrophobicContact CD1-CD2 3.79Å; L806-F956 HydrophobicContact CD1-CE1 3.85Å; L806-F956 HydrophobicContact CD1-CE2 4.12Å; L806-F956 HydrophobicContact CD1-CG 3.53Å; L806-F956 HydrophobicContact CD1-CZ 4.14Å; S818-F956 CarbonylContact O-C 3.5Å; S818-F956 WeakPolarHBondContact O-CA 3.01Å; L819-F956 HydrophobicContact CB-CB 4.41Å; F956-V958 HydrophobicContact CD2-CG2 4.46Å; F956-V958 HydrophobicContact CE2-CG2 4.33Å; F956-A972 VanDerWaalsContact O-CA 3.29Å; F956-A972 WeakPolarHBondContact O-CA 3.05Å; F956-N973 HydrophobicContact CD1-CB 4.33Å; F956-N973 WeakPolarHBondContact CD1-O 3.46Å; F956-N973 HydrophobicContact CE1-CB 3.52Å; F956-N973 HydrophobicContact CZ-CB 3.87Å; F956-N973 PolarHBondContact N-O 3.27Å; F956-N973 PolarHBondContact O-N 3.37Å
957	E	91.7	Very high	81.6	Confident	116 Å²	116	52.2 Å²	52.2	54%	0.542	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	126	174.7	-176.9	176.4	-169	0	0	108.6	A817 S818 A972	A817-E957 CarbonylContact C-O 3.49Å; A817-E957 VanDerWaalsContact CA-O 3.31Å; A817-E957 WeakPolarHBondContact CA-O 3.18Å; S818-E957 PolarHBondContact N-O 3.29Å; S818-E957 PolarHBondContact O-N 2.92Å; E957-A972 HydrophobicContact CB-CB 4.48Å; E957-A972 HydrophobicContact CG-CB 4.46Å
958	V	88.5	Confident	81	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	127.6	171.6	176.1	0	0	0	0	108.7	F814 A817 F956 M961 L970 P971	F814-V958 HydrophobicContact CB-CG1 3.62Å; F814-V958 HydrophobicContact CD1-CG2 4.21Å; F814-V958 HydrophobicContact CD2-CG1 4.32Å; F814-V958 HydrophobicContact CD2-CG2 4.24Å; F814-V958 HydrophobicContact CE1-CG2 4.4Å; F814-V958 HydrophobicContact CE2-CG2 4.44Å; F814-V958 HydrophobicContact CG-CG1 4.02Å; F814-V958 HydrophobicContact CG-CG2 4.11Å; F814-V958 HydrophobicContact CZ-CG2 4.5Å; A817-V958 HydrophobicContact CB-CG2 4.14Å; F956-V958 HydrophobicContact CD2-CG2 4.46Å; F956-V958 HydrophobicContact CE2-CG2 4.33Å; V958-M961 HydrophobicContact CG1-CG 4.35Å; V958-L970 HydrophobicContact CB-CD2 4.43Å; V958-L970 HydrophobicContact CG1-CD2 3.98Å; V958-L970 WeakPolarHBondContact O-CB 3.49Å; V958-L970 WeakPolarHBondContact O-CD2 3.27Å; V958-P971 HydrophobicContact CB-CG 4.08Å; V958-P971 HydrophobicContact CG2-CG 3.63Å; V958-P971 PolarHBondContact N-O 3.17Å; V958-P971 VanDerWaalsContact N-O 3.13Å
959	I	85.9	Confident	80.6	Confident	98 Å²	98	62.7 Å²	62.7	50%	0.503	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	-42.1	-175	-59.7	163.1	0	0	0	110.6	K816	K816-I959 HydrophobicContact CB-CB 4.47Å; K816-I959 PolarHBondContact O-N 2.89Å
960	E	84.5	Confident	80.5	Confident	76 Å²	76	65 Å²	65	36%	0.355	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	137.8	-169.6	-161.5	177.9	179	0	0	110.2	S815 K816	S815-E960 PolarHBondContact N-O 3.3Å; S815-E960 WeakPolarHBondContact OG-CB 3.31Å; S815-E960 WeakPolarHBondContact OG-CG 3.07Å; S815-E960 PolarHBondContact OG-O 2.79Å; K816-E960 HydrophobicContact CB-CB 4.03Å; K816-E960 WeakPolarHBondContact CD-OE2 3.38Å; K816-E960 WeakPolarHBondContact CE-OE2 3.5Å; K816-E960 HydrophobicContact CG-CB 4.43Å; K816-E960 PolarHBondContact N-O 2.88Å; K816-E960 IonicContact NZ-OE2 3.63Å; K816-E960 PolarHBondContact NZ-OE2 2.97Å; K816-E960 PolarHBondContact O-N 3.41Å
961	M	80.9	Confident	80.4	Confident	13 Å²	13	66.1 Å²	66.1	6%	0.064	33%	0.327	C	S	.	.			trans	-116.5	148.7	168.3	-56.4	-161.5	-157.3	0	0	108.5	I762 A764 F814 V958 Y963 T968 E969 L970	I762-M961 HydrophobicContact CG2-SD 3.58Å; I762-M961 VanDerWaalsContact CG2-SD 3.58Å; A764-M961 HydrophobicContact CB-CE 4Å; A764-M961 HydrophobicContact CB-SD 4.21Å; F814-M961 HydrophobicContact CB-CG 4.33Å; V958-M961 HydrophobicContact CG1-CG 4.35Å; M961-Y963 HydrophobicContact CB-CD2 4.13Å; M961-Y963 PolarHBondContact O-N 2.75Å; M961-Y963 VanDerWaalsContact O-N 3.16Å; M961-T968 HydrophobicContact CB-CG2 4.3Å; M961-T968 HydrophobicContact CE-CG2 4.19Å; M961-T968 HydrophobicContact CG-CG2 4.27Å; M961-T968 HydrophobicContact SD-CG2 3.68Å; M961-E969 VanDerWaalsContact CE-O 3.25Å; M961-E969 WeakPolarHBondContact CE-O 3.24Å; M961-L970 HydrophobicContact CE-CD2 3.8Å; M961-L970 HydrophobicContact CG-CD2 4.23Å
962	P	78.8	Confident	80.4	Confident	28 Å²	28	65.5 Å²	65.5	18%	0.182	34%	0.339	C	S	.	.	S	Bend	trans	-67	-15	-176.8	26.7	-33.2	0	0	0	113.8	T813 K964	T813-P962 WeakPolarHBondContact O-CD 3.33Å; P962-K964 PolarHBondContact O-N 3.44Å
963	Y	77	Confident	80.4	Confident	13 Å²	13	69.7 Å²	69.7	5%	0.051	36%	0.362	C	S	.	.			trans	-89.9	88.3	-172.3	-42.4	-71.2	0	0	0	112.4	I644 E730 I762 T813 M961 N965	I644-Y963 HydrophobicContact CB-CE1 4.29Å; I644-Y963 HydrophobicContact CD1-CD1 4Å; I644-Y963 HydrophobicContact CD1-CE1 4.21Å; I644-Y963 HydrophobicContact CG2-CD1 4.39Å; I644-Y963 HydrophobicContact CG2-CE1 3.56Å; E730-Y963 HydrophobicContact CB-CD1 4.21Å; E730-Y963 HydrophobicContact CB-CE1 4.35Å; E730-Y963 HydrophobicContact CG-CD1 4.33Å; E730-Y963 HydrophobicContact CG-CE1 3.98Å; I762-Y963 VanDerWaalsContact CD1-CB 3.42Å; I762-Y963 HydrophobicContact CD1-CD2 3.62Å; I762-Y963 HydrophobicContact CD1-CG 3.77Å; I762-Y963 HydrophobicContact CG1-CD2 3.9Å; I762-Y963 HydrophobicContact CG1-CG 4.21Å; I762-Y963 HydrophobicContact CG2-CD2 4.12Å; I762-Y963 HydrophobicContact CG2-CE2 4.31Å; T813-Y963 PolarHBondContact N-OH 3.04Å; T813-Y963 WeakPolarHBondContact O-CE2 3.28Å; M961-Y963 HydrophobicContact CB-CD2 4.13Å; M961-Y963 PolarHBondContact O-N 2.75Å; M961-Y963 VanDerWaalsContact O-N 3.16Å; Y963-N965 VanDerWaalsContact C-N 3.34Å; Y963-N965 PolarHBondContact O-N 3.4Å
964	K	62	Low	80.3	Confident	186 Å²	186	71.9 Å²	71.9	81%	0.809	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-21	-172.7	-69.4	-178.9	179.6	174.4	0	115.9	P962	P962-K964 PolarHBondContact O-N 3.44Å
965	N	65.4	Low	80.2	Confident	127 Å²	127	73.5 Å²	73.5	68%	0.679	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	3	-169.9	-70.2	-17.9	0	0	0	114.5	T733 Y963	T733-N965 HydrophobicContact CG2-CB 4.23Å; Y963-N965 VanDerWaalsContact C-N 3.34Å; Y963-N965 PolarHBondContact O-N 3.4Å
966	L	65.3	Low	80	Confident	38 Å²	38	75 Å²	75	20%	0.199	40%	0.395	C	S	.	.	S	Bend	trans	-122.5	143.9	-175.1	-71.7	166	0	0	0	110.2	I644 L760 I762 T968	I644-L966 HydrophobicContact CD1-CD1 3.74Å; L760-L966 HydrophobicContact CB-CD1 4.46Å; L760-L966 WeakPolarHBondContact O-CD2 3.5Å; I762-L966 HydrophobicContact CD1-CB 3.44Å; I762-L966 VanDerWaalsContact CD1-CB 3.44Å; I762-L966 HydrophobicContact CD1-CD1 3.82Å; I762-L966 HydrophobicContact CD1-CG 4.27Å; I762-L966 HydrophobicContact CG1-CB 4.27Å; I762-L966 HydrophobicContact CG1-CD1 3.92Å; L966-T968 PolarHBondContact O-N 3.2Å
967	Q	63.2	Low	79.7	Confident	190 Å²	190	75 Å²	75	89%	0.888	40%	0.396	S	S	*	.			trans	-74.1	122	176.9	-73.5	-174.2	-22	0	0	110
968	T	64.7	Low	79.5	Confident	57 Å²	57	72.4 Å²	72.4	35%	0.35	39%	0.39	S	S	.	.			trans	-110.8	129.5	-175.1	49.2	0	0	0	0	112.5	I762 M961 L966	I762-T968 HydrophobicContact CB-CG2 4.45Å; I762-T968 HydrophobicContact CD1-CG2 3.49Å; I762-T968 VanDerWaalsContact CD1-CG2 3.49Å; I762-T968 HydrophobicContact CG2-CG2 4.34Å; M961-T968 HydrophobicContact CB-CG2 4.3Å; M961-T968 HydrophobicContact CE-CG2 4.19Å; M961-T968 HydrophobicContact CG-CG2 4.27Å; M961-T968 HydrophobicContact SD-CG2 3.68Å; L966-T968 PolarHBondContact O-N 3.2Å
969	E	72.3	Confident	79.4	Confident	186 Å²	186	72.4 Å²	72.4	87%	0.869	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-82.9	119.4	158.5	-70.1	-174.6	175.1	0	0	108.9	M961 P971	M961-E969 VanDerWaalsContact CE-O 3.25Å; M961-E969 WeakPolarHBondContact CE-O 3.24Å; E969-P971 WeakPolarHBondContact O-CD 3.42Å
970	L	80.4	Confident	79.3	Confident	78 Å²	78	69.2 Å²	69.2	41%	0.408	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-85	119.1	-178.7	-65.2	167.4	0	0	0	109.6	V958 M961	V958-L970 HydrophobicContact CB-CD2 4.43Å; V958-L970 HydrophobicContact CG1-CD2 3.98Å; V958-L970 WeakPolarHBondContact O-CB 3.49Å; V958-L970 WeakPolarHBondContact O-CD2 3.27Å; M961-L970 HydrophobicContact CE-CD2 3.8Å; M961-L970 HydrophobicContact CG-CD2 4.23Å
971	P	83.1	Confident	79.3	Confident	24 Å²	24	65.6 Å²	65.6	16%	0.156	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-72.7	134.7	-179.9	27.9	-33.9	0	0	0	111.1	A764 A766 V958 E969	A764-P971 HydrophobicContact CB-CG 4.2Å; A766-P971 HydrophobicContact CB-CG 4.25Å; V958-P971 HydrophobicContact CB-CG 4.08Å; V958-P971 HydrophobicContact CG2-CG 3.63Å; V958-P971 PolarHBondContact N-O 3.17Å; V958-P971 VanDerWaalsContact N-O 3.13Å; E969-P971 WeakPolarHBondContact O-CD 3.42Å
972	A	86.3	Confident	79.3	Confident	67 Å²	67	66.2 Å²	66.2	55%	0.554	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.7	138.3	171.1	0	0	0	0	0	109.7	F956 E957	F956-A972 VanDerWaalsContact O-CA 3.29Å; F956-A972 WeakPolarHBondContact O-CA 3.05Å; E957-A972 HydrophobicContact CB-CB 4.48Å; E957-A972 HydrophobicContact CG-CB 4.46Å
973	N	89.5	Confident	79.1	Confident	89 Å²	89	67 Å²	67	48%	0.476	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	167.1	176	-157	-8.4	0	0	0	110.4	S955 F956	S955-N973 WeakPolarHBondContact CA-O 3.21Å; F956-N973 HydrophobicContact CD1-CB 4.33Å; F956-N973 WeakPolarHBondContact CD1-O 3.46Å; F956-N973 HydrophobicContact CE1-CB 3.52Å; F956-N973 HydrophobicContact CZ-CB 3.87Å; F956-N973 PolarHBondContact N-O 3.27Å; F956-N973 PolarHBondContact O-N 3.37Å
974	S	89.1	Confident	78.8	Confident	73 Å²	73	70.5 Å²	70.5	51%	0.51	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	152.9	177.4	63.7	0	0	0	0	112.2	A954	A954-S974 CarbonylContact O-C 3.57Å; A954-S974 VanDerWaalsContact O-CA 3.24Å; A954-S974 WeakPolarHBondContact O-CA 3.39Å
975	T	88.9	Confident	78.7	Confident	35 Å²	35	65.1 Å²	65.1	22%	0.215	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	153.3	172.2	48.7	0	0	0	0	111.3	I768 A954	I768-T975 HydrophobicContact CG2-CG2 3.78Å; I768-T975 WeakPolarHBondContact CG2-OG1 3.41Å; I768-T975 WeakPolarHBondContact O-CG2 3.26Å; A954-T975 PolarHBondContact N-O 3.04Å; A954-T975 PolarHBondContact O-N 3.36Å
976	T	89.1	Confident	78.1	Confident	75 Å²	75	67 Å²	67	46%	0.46	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	133.3	179.5	68.2	0	0	0	0	110.6	S952 T953	S952-T976 WeakPolarHBondContact O-CA 3.33Å; T953-T976 HydrophobicContact CG2-CG2 3.67Å
977	V	87.6	Confident	77.3	Confident	7 Å²	7	71.2 Å²	71.2	4%	0.042	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	132.8	177	179.1	0	0	0	0	108.2	G770 Y804 R951 S952	G770-V977 VanDerWaalsContact C-CG2 3.42Å; G770-V977 VanDerWaalsContact CA-CG2 3.43Å; Y804-V977 HydrophobicContact CD1-CG2 4.36Å; Y804-V977 HydrophobicContact CE1-CB 4.41Å; Y804-V977 HydrophobicContact CE1-CG2 3.57Å; R951-V977 CarbonylContact C-O 3.44Å; R951-V977 VanDerWaalsContact CA-O 3.27Å; R951-V977 WeakPolarHBondContact CA-O 3.31Å; S952-V977 PolarHBondContact N-O 3.18Å; S952-V977 PolarHBondContact O-N 2.92Å
978	S	86.9	Confident	76.5	Confident	60 Å²	60	66.9 Å²	66.9	42%	0.42	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	146.1	-177.9	57.8	0	0	0	0	112.9	V950	V950-S978 CarbonylContact O-C 3.59Å; V950-S978 VanDerWaalsContact O-CA 3.29Å; V950-S978 WeakPolarHBondContact O-CA 3.32Å
979	V	86.7	Confident	75.8	Confident	1 Å²	1	73 Å²	73	1%	0.006	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	123.6	170.7	179	0	0	0	0	108.3	S772 V777 I800 H802 V949 V950	S772-V979 WeakPolarHBondContact OG-CG2 3.31Å; V777-V979 HydrophobicContact CG2-CG1 4.2Å; I800-V979 HydrophobicContact CD1-CG1 4.11Å; I800-V979 HydrophobicContact CG2-CG2 3.91Å; H802-V979 WeakPolarHBondContact NE2-CG2 3.46Å; V949-V979 WeakPolarHBondContact CA-O 3.37Å; V950-V979 PolarHBondContact N-O 3.23Å; V950-V979 PolarHBondContact O-N 3.39Å
980	S	84.4	Confident	75.3	Confident	30 Å²	30	69.7 Å²	69.7	21%	0.21	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	126.4	174.6	58.3	0	0	0	0	110.8	S775 Q776 V777	S775-S980 PolarHBondContact O-N 3.1Å; S775-S980 VanDerWaalsContact O-N 3.1Å; S775-S980 PolarHBondContact O-OG 3.42Å; Q776-S980 CarbonylContact C-O 3.55Å; Q776-S980 VanDerWaalsContact CA-O 3.25Å; Q776-S980 WeakPolarHBondContact CA-O 3.32Å; Q776-S980 VanDerWaalsContact CB-OG 3.3Å; Q776-S980 WeakPolarHBondContact CB-OG 3.35Å; Q776-S980 VanDerWaalsContact CG-OG 3.25Å; Q776-S980 WeakPolarHBondContact CG-OG 3.45Å; V777-S980 PolarHBondContact N-O 3.35Å
981	V	82.8	Confident	74.5	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	108.2	174.6	-176.3	0	0	0	0	107.4	V777 L779 L933 F938 S947 Y948	V777-V981 WeakPolarHBondContact O-CA 3.45Å; L779-V981 HydrophobicContact CD1-CG1 3.53Å; L779-V981 HydrophobicContact CG-CG1 3.9Å; L933-V981 HydrophobicContact CD1-CG2 4.04Å; L933-V981 HydrophobicContact CD2-CG1 4.25Å; L933-V981 HydrophobicContact CD2-CG2 3.99Å; F938-V981 HydrophobicContact CD1-CG1 4.33Å; F938-V981 HydrophobicContact CE1-CG1 4.45Å; S947-V981 CarbonylContact C-O 3.54Å; S947-V981 VanDerWaalsContact CA-O 3.31Å; S947-V981 WeakPolarHBondContact CA-O 3.44Å; Y948-V981 PolarHBondContact N-O 3.41Å; Y948-V981 PolarHBondContact O-N 3.02Å
982	T	81.7	Confident	73.9	Confident	26 Å²	26	73.2 Å²	73.2	16%	0.16	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	140.7	-173.4	53.9	0	0	0	0	111.8	Q776 V777 L778 L779	Q776-T982 PolarHBondContact NE2-OG1 2.74Å; V777-T982 PolarHBondContact O-N 3.25Å; L778-T982 WeakPolarHBondContact CA-O 3.15Å; L778-T982 WeakPolarHBondContact CD2-OG1 3.44Å; L779-T982 PolarHBondContact N-O 3.02Å
983	W	74.4	Confident	73	Confident	44 Å²	44	73.9 Å²	73.9	17%	0.167	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	131.3	175.6	-73.9	78.9	0	0	0	111.6	L779 F938 L939 Q944 R946	L779-W983 HydrophobicContact CB-CD2 3.99Å; L779-W983 HydrophobicContact CB-CE3 4.11Å; L779-W983 HydrophobicContact CB-CG 4.49Å; L779-W983 HydrophobicContact CB-CH2 4.44Å; L779-W983 HydrophobicContact CB-CZ2 4.28Å; L779-W983 HydrophobicContact CB-CZ3 4.35Å; L779-W983 HydrophobicContact CD1-CZ2 3.95Å; L779-W983 WeakPolarHBondContact O-CA 3.38Å; F938-W983 VanDerWaalsContact O-CZ2 3.31Å; F938-W983 WeakPolarHBondContact O-CZ2 3.48Å; L939-W983 HydrophobicContact CD2-CH2 3.57Å; L939-W983 HydrophobicContact CD2-CZ2 4.49Å; L939-W983 HydrophobicContact CD2-CZ3 4.27Å; L939-W983 HydrophobicContact CG-CH2 4.46Å; Q944-W983 HydrophobicContact CG-CH2 4.25Å; R946-W983 PolarHBondContact O-NE1 2.86Å
984	V	71.6	Confident	72.4	Confident	87 Å²	87	77.7 Å²	77.7	53%	0.527	47%	0.469	S	S	.	.			trans	-92.9	105.9	168.5	-174.8	0	0	0	0	107.1	L778 L779	L778-V984 HydrophobicContact CB-CG2 4.31Å; L778-V984 HydrophobicContact CD1-CG2 4.48Å; L778-V984 HydrophobicContact CD2-CG2 4.4Å; L779-V984 PolarHBondContact O-N 2.98Å
985	A	58.7	Low	71.8	Confident	74 Å²	74	77 Å²	77	61%	0.612	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-71.7	130	174	0	0	0	0	0	109.8	T987	A985-T987 PolarHBondContact O-N 2.99Å
986	D	53.8	Low	71.2	Confident	166 Å²	166	79.5 Å²	79.5	89%	0.888	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-61.9	124.3	169.3	-91.5	-25.4	0	0	0	109.1	A988	D986-A988 PolarHBondContact O-N 3.05Å
987	T	47	Very low	70.7	Confident	126 Å²	126	78.4 Å²	78.4	77%	0.773	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-64.5	130.3	174.2	45.1	0	0	0	0	109.2	A985 Q989	A985-T987 PolarHBondContact O-N 2.99Å; T987-Q989 PolarHBondContact O-N 3.06Å
988	A	47.3	Very low	70.5	Confident	100 Å²	100	82.8 Å²	82.8	83%	0.826	50%	0.497	S	S	*	.			trans	-55.5	114.1	177.7	0	0	0	0	0	109.9	D986	D986-A988 PolarHBondContact O-N 3.05Å
989	Q	51.2	Low	70.2	Confident	184 Å²	184	83 Å²	83	86%	0.86	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-64	126.8	179.3	-70.4	-169	-13	0	0	109.8	T987	T987-Q989 PolarHBondContact O-N 3.06Å
990	P	60.6	Low	70.1	Confident	118 Å²	118	87 Å²	87	77%	0.766	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-66.6	142.9	176	26.2	-31.7	0	0	0	110.6
991	V	64.2	Low	70.1	Confident	108 Å²	108	91 Å²	91	66%	0.655	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-53.6	130.6	-177.3	-178	0	0	0	0	110.4	A993 V995	V991-A993 PolarHBondContact O-N 3.26Å; V991-V995 HydrophobicContact CG1-CB 4.06Å; V991-V995 HydrophobicContact CG1-CG1 4.26Å; V991-V995 HydrophobicContact CG1-CG2 4.32Å
992	P	70.6	Confident	70.2	Confident	67 Å²	67	94 Å²	94	44%	0.435	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-58.9	135.9	-176	-26.5	34.6	0	0	0	113.5	W994 V995	P992-W994 HydrophobicContact CB-CG 4.29Å; P992-W994 PolarHBondContact O-N 2.95Å; P992-V995 HydrophobicContact CB-CG2 4.44Å; P992-V995 WeakPolarHBondContact O-CB 3.41Å; P992-V995 PolarHBondContact O-N 3.02Å
993	A	67.4	Low	70.5	Confident	81 Å²	81	94.8 Å²	94.8	67%	0.669	58%	0.583	S	S	*	*	H	α-helix	trans	-56.9	-24.1	-176.9	0	0	0	0	0	114.7	V991 V995 V996 A997	V991-A993 PolarHBondContact O-N 3.26Å; A993-V995 VanDerWaalsContact C-N 3.29Å; A993-V995 PolarHBondContact O-N 3.43Å; A993-V996 PolarHBondContact O-N 3.47Å; A993-A997 PolarHBondContact O-N 3.47Å
994	W	75.5	Confident	71.1	Confident	170 Å²	170	97.7 Å²	97.7	64%	0.644	60%	0.601	S	S	*	*	H	α-helix	trans	-66.5	-30	176.1	71.1	-94.8	0	0	0	112.8	P992 A997 L998	P992-W994 HydrophobicContact CB-CG 4.29Å; P992-W994 PolarHBondContact O-N 2.95Å; W994-A997 PolarHBondContact O-N 3.01Å; W994-L998 HydrophobicContact CE3-CD1 3.54Å; W994-L998 HydrophobicContact CZ3-CD1 3.5Å; W994-L998 PolarHBondContact O-N 2.94Å
995	V	78.4	Confident	71.8	Confident	58 Å²	58	99.4 Å²	99.4	35%	0.352	61%	0.607	S	S	.	*	H	α-helix	trans	-69.5	-39.2	175.4	-176.5	0	0	0	0	110.1	V991 P992 A993 L998 A999	V991-V995 HydrophobicContact CG1-CB 4.06Å; V991-V995 HydrophobicContact CG1-CG1 4.26Å; V991-V995 HydrophobicContact CG1-CG2 4.32Å; P992-V995 HydrophobicContact CB-CG2 4.44Å; P992-V995 WeakPolarHBondContact O-CB 3.41Å; P992-V995 PolarHBondContact O-N 3.02Å; A993-V995 VanDerWaalsContact C-N 3.29Å; A993-V995 PolarHBondContact O-N 3.43Å; V995-L998 PolarHBondContact O-N 3.04Å; V995-A999 PolarHBondContact O-N 3.05Å
996	V	76.1	Confident	73.2	Confident	87 Å²	87	101.3 Å²	101.3	53%	0.527	61%	0.606	S	S	.	*	H	α-helix	trans	-65.8	-43.3	173.9	-176.5	0	0	0	0	110.5	A993 L998 A999 V1000	A993-V996 PolarHBondContact O-N 3.47Å; V996-L998 PolarHBondContact O-N 3.26Å; V996-A999 PolarHBondContact O-N 3.47Å; V996-V1000 WeakPolarHBondContact O-CG2 3.45Å; V996-V1000 PolarHBondContact O-N 2.95Å
997	A	77.7	Confident	74.7	Confident	52 Å²	52	98 Å²	98	43%	0.43	59%	0.588	S	S	.	*	H	α-helix	trans	-62.4	-40.8	177	0	0	0	0	0	112.6	A993 W994 V1000 L1001	A993-A997 PolarHBondContact O-N 3.47Å; W994-A997 PolarHBondContact O-N 3.01Å; A997-V1000 PolarHBondContact O-N 3.41Å; A997-L1001 PolarHBondContact O-N 3.42Å
998	L	82.9	Confident	76.4	Confident	99 Å²	99	94.8 Å²	94.8	52%	0.518	57%	0.574	S	S	.	*	H	α-helix	trans	-64	-40.6	174.5	-90.5	170.7	0	0	0	112.4	W994 V995 V996 L1001 A1002	W994-L998 HydrophobicContact CE3-CD1 3.54Å; W994-L998 HydrophobicContact CZ3-CD1 3.5Å; W994-L998 PolarHBondContact O-N 2.94Å; V995-L998 PolarHBondContact O-N 3.04Å; V996-L998 PolarHBondContact O-N 3.26Å; L998-L1001 PolarHBondContact O-N 2.94Å; L998-A1002 WeakPolarHBondContact O-CB 3.38Å; L998-A1002 PolarHBondContact O-N 2.95Å
999	A	82.1	Confident	78.1	Confident	65 Å²	65	94.9 Å²	94.9	54%	0.537	56%	0.561	S	S	.	*	H	α-helix	trans	-63.9	-40.1	177.2	0	0	0	0	0	112	V995 V996 G1003	V995-A999 PolarHBondContact O-N 3.05Å; V996-A999 PolarHBondContact O-N 3.47Å; A999-G1003 PolarHBondContact O-N 3.41Å
1000	V	84.6	Confident	79.6	Confident	86 Å²	86	90.3 Å²	90.3	52%	0.521	54%	0.542	S	S	.	.	H	α-helix	trans	-66.8	-43.2	176.2	174.6	0	0	0	0	111.4	V996 A997 G1003 L1004	V996-V1000 WeakPolarHBondContact O-CG2 3.45Å; V996-V1000 PolarHBondContact O-N 2.95Å; A997-V1000 PolarHBondContact O-N 3.41Å; V1000-G1003 PolarHBondContact O-N 2.93Å; V1000-L1004 HydrophobicContact CG1-CD1 4.19Å; V1000-L1004 PolarHBondContact O-N 3.29Å
1001	L	84.4	Confident	80.5	Confident	114 Å²	114	89.2 Å²	89.2	60%	0.597	53%	0.528	S	S	*	.	H	α-helix	trans	-61.4	-44.8	176	-94.6	158.7	0	0	0	111.9	A997 L998 G1003 L1004 L1005	A997-L1001 PolarHBondContact O-N 3.42Å; L998-L1001 PolarHBondContact O-N 2.94Å; L1001-G1003 VanDerWaalsContact C-N 3.35Å; L1001-L1004 PolarHBondContact O-N 3.39Å; L1001-L1005 WeakPolarHBondContact O-CB 3.4Å; L1001-L1005 PolarHBondContact O-N 3.06Å
1002	A	85	Confident	81.3	Confident	63 Å²	63	90.4 Å²	90.4	52%	0.521	53%	0.525	S	S	.	.	H	α-helix	trans	-63.4	-40.6	176	0	0	0	0	0	112	L998 L1005 L1006	L998-A1002 WeakPolarHBondContact O-CB 3.38Å; L998-A1002 PolarHBondContact O-N 2.95Å; A1002-L1005 PolarHBondContact O-N 3.38Å; A1002-L1006 WeakPolarHBondContact O-CB 3.45Å; A1002-L1006 PolarHBondContact O-N 3.35Å
1003	G	86.6	Confident	81.7	Confident	41 Å²	41	90.9 Å²	90.9	42%	0.423	52%	0.523	S	S	.	.	H	α-helix	trans	-63.1	-43.1	176	0	0	0	0	0	113.3	A999 V1000 L1001 L1006 L1007	A999-G1003 PolarHBondContact O-N 3.41Å; V1000-G1003 PolarHBondContact O-N 2.93Å; L1001-G1003 VanDerWaalsContact C-N 3.35Å; G1003-L1006 PolarHBondContact O-N 2.99Å; G1003-L1007 WeakPolarHBondContact O-CB 3.47Å; G1003-L1007 PolarHBondContact O-N 3.05Å
1004	L	87.3	Confident	82.1	Confident	105 Å²	105	90.4 Å²	90.4	55%	0.55	51%	0.508	S	S	.	.	H	α-helix	trans	-66.3	-37.5	176.1	-77.4	171	0	0	0	112.5	V1000 L1001 L1007 A1008	V1000-L1004 HydrophobicContact CG1-CD1 4.19Å; V1000-L1004 PolarHBondContact O-N 3.29Å; L1001-L1004 PolarHBondContact O-N 3.39Å; L1004-L1007 PolarHBondContact O-N 3.43Å; L1004-A1008 WeakPolarHBondContact O-CB 3.49Å; L1004-A1008 PolarHBondContact O-N 2.92Å
1005	L	86.3	Confident	81.9	Confident	123 Å²	123	90.5 Å²	90.5	64%	0.644	51%	0.509	S	S	*	.	H	α-helix	trans	-67	-39.6	178.4	-141.9	157.6	0	0	0	111	L1001 A1002 A1008 L1009	L1001-L1005 WeakPolarHBondContact O-CB 3.4Å; L1001-L1005 PolarHBondContact O-N 3.06Å; A1002-L1005 PolarHBondContact O-N 3.38Å; L1005-A1008 PolarHBondContact O-N 3.47Å; L1005-L1009 WeakPolarHBondContact O-CB 3.34Å; L1005-L1009 PolarHBondContact O-N 3.41Å; L1005-L1009 VanDerWaalsContact O-N 3.07Å
1006	L	87.5	Confident	81.6	Confident	114 Å²	114	95.6 Å²	95.6	60%	0.597	53%	0.527	S	S	*	.	H	α-helix	trans	-66.9	-39.8	174.4	-166.1	146.8	0	0	0	111.9	A1002 G1003 L1009 L1010	A1002-L1006 WeakPolarHBondContact O-CB 3.45Å; A1002-L1006 PolarHBondContact O-N 3.35Å; G1003-L1006 PolarHBondContact O-N 2.99Å; L1006-L1009 PolarHBondContact O-N 3.07Å; L1006-L1010 HydrophobicContact CD2-CD1 3.89Å; L1006-L1010 PolarHBondContact O-N 2.98Å
1007	L	85.3	Confident	81.4	Confident	98 Å²	98	98 Å²	98	51%	0.513	54%	0.536	S	S	.	.	H	α-helix	trans	-64.1	-44	175	-169.4	112.2	0	0	0	111.9	G1003 L1004 L1009 L1010 I1011	G1003-L1007 WeakPolarHBondContact O-CB 3.47Å; G1003-L1007 PolarHBondContact O-N 3.05Å; L1004-L1007 PolarHBondContact O-N 3.43Å; L1007-L1009 VanDerWaalsContact C-N 3.29Å; L1007-L1009 PolarHBondContact O-N 2.97Å; L1007-L1010 PolarHBondContact O-N 3.43Å; L1007-I1011 HydrophobicContact CD2-CD1 3.72Å; L1007-I1011 HydrophobicContact CG-CD1 4.17Å; L1007-I1011 WeakPolarHBondContact O-CG1 3.31Å; L1007-I1011 PolarHBondContact O-N 3.42Å
1008	A	82.8	Confident	80.5	Confident	58 Å²	58	97.6 Å²	97.6	48%	0.479	54%	0.536	S	S	.	.	H	α-helix	trans	-61.4	-39.2	176.2	0	0	0	0	0	111.9	L1004 L1005 I1011 F1012	L1004-A1008 WeakPolarHBondContact O-CB 3.49Å; L1004-A1008 PolarHBondContact O-N 2.92Å; L1005-A1008 PolarHBondContact O-N 3.47Å; A1008-I1011 PolarHBondContact O-N 2.91Å; A1008-F1012 WeakPolarHBondContact O-CB 3.42Å; A1008-F1012 PolarHBondContact O-N 3.24Å
1009	L	84.3	Confident	79.4	Confident	102 Å²	102	99.7 Å²	99.7	53%	0.534	54%	0.542	S	S	.	.	H	α-helix	trans	-66.6	-40.1	176.2	-167.6	142.4	0	0	0	111.8	L1005 L1006 L1007 F1012 I1013	L1005-L1009 WeakPolarHBondContact O-CB 3.34Å; L1005-L1009 PolarHBondContact O-N 3.41Å; L1005-L1009 VanDerWaalsContact O-N 3.07Å; L1006-L1009 PolarHBondContact O-N 3.07Å; L1007-L1009 VanDerWaalsContact C-N 3.29Å; L1007-L1009 PolarHBondContact O-N 2.97Å; L1009-F1012 PolarHBondContact O-N 3.36Å; L1009-I1013 HydrophobicContact CD2-CD1 3.58Å; L1009-I1013 HydrophobicContact CD2-CG1 4.45Å; L1009-I1013 VanDerWaalsContact O-CG1 3.31Å; L1009-I1013 WeakPolarHBondContact O-CG1 3.45Å; L1009-I1013 PolarHBondContact O-N 3.41Å
1010	L	81.8	Confident	78.4	Confident	88 Å²	88	103.7 Å²	103.7	46%	0.461	55%	0.547	S	S	.	.	H	α-helix	trans	-63.1	-45.1	172.8	-96.6	166.4	0	0	0	112.6	L1006 L1007 F1012 I1013 M1014	L1006-L1010 HydrophobicContact CD2-CD1 3.89Å; L1006-L1010 PolarHBondContact O-N 2.98Å; L1007-L1010 PolarHBondContact O-N 3.43Å; L1010-F1012 VanDerWaalsContact C-N 3.3Å; L1010-F1012 PolarHBondContact O-N 2.87Å; L1010-I1013 PolarHBondContact O-N 2.99Å; L1010-M1014 WeakPolarHBondContact O-CG 3.36Å; L1010-M1014 PolarHBondContact O-N 3.24Å
1011	I	80.9	Confident	76.5	Confident	94 Å²	94	108 Å²	108	48%	0.482	56%	0.559	S	S	.	*	H	α-helix	trans	-61.5	-41.2	176.7	-68.3	167.1	0	0	0	110.4	L1007 A1008 M1014 Y1015	L1007-I1011 HydrophobicContact CD2-CD1 3.72Å; L1007-I1011 HydrophobicContact CG-CD1 4.17Å; L1007-I1011 WeakPolarHBondContact O-CG1 3.31Å; L1007-I1011 PolarHBondContact O-N 3.42Å; A1008-I1011 PolarHBondContact O-N 2.91Å; I1011-M1014 PolarHBondContact O-N 3.39Å; I1011-Y1015 WeakPolarHBondContact O-CB 3.49Å; I1011-Y1015 PolarHBondContact O-N 2.89Å
1012	F	79.6	Confident	74.8	Confident	134 Å²	134	113.7 Å²	113.7	59%	0.588	57%	0.572	S	S	*	*	H	α-helix	trans	-63.2	-42.3	176.3	-174.9	-99.2	0	0	0	112.2	A1008 L1009 L1010 Y1015 K1016	A1008-F1012 WeakPolarHBondContact O-CB 3.42Å; A1008-F1012 PolarHBondContact O-N 3.24Å; L1009-F1012 PolarHBondContact O-N 3.36Å; L1010-F1012 VanDerWaalsContact C-N 3.3Å; L1010-F1012 PolarHBondContact O-N 2.87Å; F1012-Y1015 PolarHBondContact O-N 3.43Å; F1012-K1016 WeakPolarHBondContact O-CB 3.43Å; F1012-K1016 PolarHBondContact O-N 3.44Å
1013	I	79.8	Confident	72.7	Confident	76 Å²	76	116.7 Å²	116.7	39%	0.39	58%	0.584	S	S	.	*	H	α-helix	trans	-62.1	-46.7	174.1	-69.8	169.4	0	0	0	110.8	L1009 L1010 Y1015 K1016 L1017	L1009-I1013 HydrophobicContact CD2-CD1 3.58Å; L1009-I1013 HydrophobicContact CD2-CG1 4.45Å; L1009-I1013 VanDerWaalsContact O-CG1 3.31Å; L1009-I1013 WeakPolarHBondContact O-CG1 3.45Å; L1009-I1013 PolarHBondContact O-N 3.41Å; L1010-I1013 PolarHBondContact O-N 2.99Å; I1013-Y1015 VanDerWaalsContact C-N 3.33Å; I1013-Y1015 PolarHBondContact O-N 3.46Å; I1013-K1016 PolarHBondContact O-N 3.12Å; I1013-L1017 HydrophobicContact CG2-CD1 3.75Å; I1013-L1017 HydrophobicContact CG2-CG 4.5Å; I1013-L1017 WeakPolarHBondContact O-CB 3.37Å; I1013-L1017 WeakPolarHBondContact O-CG 3.5Å; I1013-L1017 PolarHBondContact O-N 2.98Å
1014	M	74.6	Confident	70.6	Confident	72 Å²	72	126.2 Å²	126.2	36%	0.355	61%	0.607	S	S	.	*	H	α-helix	trans	-65.3	-33.7	178.9	-71.1	-174.5	71.8	0	0	112.9	L1010 I1011 F1019	L1010-M1014 WeakPolarHBondContact O-CG 3.36Å; L1010-M1014 PolarHBondContact O-N 3.24Å; I1011-M1014 PolarHBondContact O-N 3.39Å; M1014-F1019 HydrophobicContact CE-CD1 3.71Å; M1014-F1019 HydrophobicContact CE-CE1 3.85Å; M1014-F1019 HydrophobicContact CE-CG 4.06Å; M1014-F1019 HydrophobicContact CE-CZ 4.32Å; M1014-F1019 WeakPolarHBondContact O-CB 3.39Å; M1014-F1019 PolarHBondContact O-N 3.34Å
1015	Y	71.7	Confident	68.4	Low	171 Å²	171	126.8 Å²	126.8	67%	0.671	62%	0.617	S	S	*	*	H	α-helix	trans	-67	-44.6	172.7	177	-100.9	0	0	0	111.9	I1011 F1012 I1013 L1017 G1018	I1011-Y1015 WeakPolarHBondContact O-CB 3.49Å; I1011-Y1015 PolarHBondContact O-N 2.89Å; F1012-Y1015 PolarHBondContact O-N 3.43Å; I1013-Y1015 VanDerWaalsContact C-N 3.33Å; I1013-Y1015 PolarHBondContact O-N 3.46Å; Y1015-L1017 VanDerWaalsContact C-N 3.29Å; Y1015-L1017 PolarHBondContact O-N 3.26Å; Y1015-G1018 PolarHBondContact O-N 3Å; Y1015-G1018 VanDerWaalsContact O-N 3.12Å
1016	K	73.4	Confident	66.3	Low	166 Å²	166	126.7 Å²	126.7	72%	0.722	62%	0.624	S	S	*	*	H	α-helix	trans	-65.7	-29.4	177.3	-111	-88.5	-175.1	171.4	0	113.1	F1012 I1013 G1018	F1012-K1016 WeakPolarHBondContact O-CB 3.43Å; F1012-K1016 PolarHBondContact O-N 3.44Å; I1013-K1016 PolarHBondContact O-N 3.12Å; K1016-G1018 PolarHBondContact O-N 3.41Å
1017	L	70.4	Confident	64.3	Low	137 Å²	137	129.3 Å²	129.3	72%	0.717	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	4.8	174.6	-70.5	168.7	0	0	0	113.7	I1013 Y1015 F1019	I1013-L1017 HydrophobicContact CG2-CD1 3.75Å; I1013-L1017 HydrophobicContact CG2-CG 4.5Å; I1013-L1017 WeakPolarHBondContact O-CB 3.37Å; I1013-L1017 WeakPolarHBondContact O-CG 3.5Å; I1013-L1017 PolarHBondContact O-N 2.98Å; Y1015-L1017 VanDerWaalsContact C-N 3.29Å; Y1015-L1017 PolarHBondContact O-N 3.26Å; L1017-F1019 VanDerWaalsContact C-N 3.34Å; L1017-F1019 PolarHBondContact O-N 3.36Å
1018	G	59.7	Low	62.1	Low	43 Å²	43	131.5 Å²	131.5	44%	0.443	65%	0.65	S	S	.	*	T	Hydrogen-bonded Turn	trans	76.1	15.7	169.6	0	0	0	0	0	115.4	Y1015 K1016 F1020 K1021	Y1015-G1018 PolarHBondContact O-N 3Å; Y1015-G1018 VanDerWaalsContact O-N 3.12Å; K1016-G1018 PolarHBondContact O-N 3.41Å; G1018-F1020 VanDerWaalsContact C-N 3.27Å; G1018-F1020 PolarHBondContact O-N 3.2Å; G1018-K1021 PolarHBondContact O-N 3.4Å
1019	F	60.1	Low	60.2	Low	144 Å²	144	134.9 Å²	134.9	63%	0.632	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	-23	-172.7	-169.8	-100.2	0	0	0	114.7	M1014 L1017	M1014-F1019 HydrophobicContact CE-CD1 3.71Å; M1014-F1019 HydrophobicContact CE-CE1 3.85Å; M1014-F1019 HydrophobicContact CE-CG 4.06Å; M1014-F1019 HydrophobicContact CE-CZ 4.32Å; M1014-F1019 WeakPolarHBondContact O-CB 3.39Å; M1014-F1019 PolarHBondContact O-N 3.34Å; L1017-F1019 VanDerWaalsContact C-N 3.34Å; L1017-F1019 PolarHBondContact O-N 3.36Å
1020	F	60.7	Low	57.8	Low	149 Å²	149	136 Å²	136	65%	0.654	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	18.1	-175.9	-69.5	-76.7	0	0	0	115.1	G1018	G1018-F1020 VanDerWaalsContact C-N 3.27Å; G1018-F1020 PolarHBondContact O-N 3.2Å
1021	K	44.5	Very low	55.8	Low	176 Å²	176	137.9 Å²	137.9	77%	0.765	69%	0.691	S	S	*	*			trans	-107.1	114.3	175.7	-81.7	-173.7	179.4	177.4	0	112.7	G1018	G1018-K1021 PolarHBondContact O-N 3.4Å
1022	R	48.6	Very low	53.7	Low	234 Å²	234	140.1 Å²	140.1	88%	0.883	70%	0.699	S	S	*	*			trans	85.7	155.5	156.2	-56.2	-179.7	179.9	179.2	0.1	117.4
1023	V	41	Very low	51.6	Low	126 Å²	126	141.2 Å²	141.2	76%	0.764	70%	0.704	S	S	*	*			cis	-167.3	131.3	-23.4	146.2	0	0	0	0	102.9
1024	R	41.5	Very low	49.4	Very low	240 Å²	240	146.5 Å²	146.5	91%	0.906	73%	0.726	S	S	*	*			trans	-72.9	148.3	171.3	-68.3	178.7	-178	174.3	-0.4	111
1025	P	42.1	Very low	47.7	Very low	117 Å²	117	151.2 Å²	151.2	76%	0.76	75%	0.748	S	S	*	*				-156.5	-179.6	104.6	38	-18.9	0	0	0	114.5
1026	P	42.5	Very low	45.8	Very low	121 Å²	121	151.2 Å²	151.2	79%	0.786	76%	0.758	S	S	*	*			cis	-120.8	171.4	-15.6	34.6	-16.7	0	0	0	114.1
1027	Q	45.3	Very low	44.1	Very low	170 Å²	170	151.9 Å²	151.9	79%	0.794	76%	0.764	S	S	*	*			trans	-65.3	147.2	169.2	-77.1	170.3	-76.3	0	0	112.5
1028	V	38.2	Very low	42.8	Very low	144 Å²	144	150.5 Å²	150.5	87%	0.873	76%	0.763	S	S	*	*			trans	-140.3	120.6	144.9	-171.3	0	0	0	0	108.1
1029	D	42.9	Very low	41.6	Very low	128 Å²	128	156.7 Å²	156.7	68%	0.684	78%	0.781	S	S	*	*			trans	-65.9	151.7	173.1	-65.5	-48.2	0	0	0	111.9
1030	C	34.9	Very low	40.3	Very low	127 Å²	127	157.9 Å²	157.9	86%	0.858	79%	0.788	S	S	*	*			trans	-168.6	113.3	137.8	-92.9	0	0	0	0	110.7
1031	T	38.7	Very low	39.2	Very low	127 Å²	127	158.6 Å²	158.6	78%	0.779	80%	0.799	S	S	*	*			trans	-42.9	161.3	146.5	40.7	0	0	0	0	112.5
1032	E	37.6	Very low	38.9	Very low	140 Å²	140	153.7 Å²	153.7	65%	0.654	80%	0.798	S	S	*	*			cis	-176.8	161.7	27.6	-133.1	-173.5	170.7	0	0	109.4
1033	K	35.4	Very low	38.5	Very low	158 Å²	158	150 Å²	150	69%	0.687	80%	0.796	S	S	*	*			trans	66.5	144.2	149.8	-72.9	165.5	-177	150.3	0	118.7
1034	E	34.5	Very low	38.4	Very low	186 Å²	186	150.2 Å²	150.2	87%	0.869	80%	0.798	S	S	*	*				-165.4	159.8	50.8	-150.4	163.5	-157.8	0	0	112.8
1035	Q	37.3	Very low	38.9	Very low	171 Å²	171	146.6 Å²	146.6	80%	0.799	80%	0.796	S	S	*	*			trans	-82.1	157.1	176.6	-66.3	168.8	-46.7	0	0	112.4
1036	L	33.3	Very low	39	Very low	171 Å²	171	149.4 Å²	149.4	90%	0.895	83%	0.829	S	S	*	*				164.9	139.7	117.2	-86.6	156.6	0	0	0	112.7
1037	Q	36.1	Very low	38.9	Very low	180 Å²	180	150.9 Å²	150.9	84%	0.841	83%	0.832	S	S	*	*			trans	-76.3	172.6	169.5	-67.5	174.2	-27	0	0	111.5
1038	P	44	Very low	38.5	Very low	108 Å²	108	149.8 Å²	149.8	70%	0.701	83%	0.834	S	S	*	*				-152.6	163.5	81.9	36.6	-15.3	0	0	0	117.8
1039	E	33.3	Very low	38.5	Very low	173 Å²	173	150.2 Å²	150.2	81%	0.808	83%	0.831	S	S	*	*			trans	55.2	157.2	140.1	-75.6	176.8	175.9	0	0	121
1040	E	33.5	Very low	38.3	Very low	169 Å²	169	151.5 Å²	151.5	79%	0.79	84%	0.84	S	S	*	*			cis	-162.5	173.7	-7.6	-134.2	-177.3	161.2	0	0	107.7
1041	N	39	Very low	38.5	Very low	165 Å²	165	153 Å²	153	88%	0.882	84%	0.839	S	S	*	*			trans	-67.9	163.1	-176.9	-69.2	-43.1	0	0	0	116.4
1042	G	36.5	Very low	38.5	Very low	72 Å²	72	154.7 Å²	154.7	74%	0.742	84%	0.843	S	S	*	*			trans	148.2	112.7	136.3	0	0	0	0	0	118.1
1043	N	40.3	Very low	38.6	Very low	158 Å²	158	155.8 Å²	155.8	85%	0.845	86%	0.856	S	S	*	*			trans	19.1	146.8	138.2	-76.6	0.3	0	0	0	120.2
1044	T	40.4	Very low	38.8	Very low	130 Å²	130	155.6 Å²	155.6	80%	0.798	87%	0.869	S	S	*	*				-167.5	151.8	62.1	34.9	0	0	0	0	111.8
1045	D	51.1	Low	39.1	Very low	164 Å²	164	153.1 Å²	153.1	88%	0.877	87%	0.869	S	S	*	*			trans	-57.7	154.1	162.6	-63.6	-48.7	0	0	0	114
1046	A	44.9	Very low	39.3	Very low	176 Å²	176	151.5 Å²	151.5	100%	1.455	88%	0.876	S	S	*	*			trans	-147.8	0	136.5	0	0	0	0	0	108.8

Retrieved 1,046 of 1,046 residues in 1497.3 ms (Link to these results)

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