A0A087XG21_POEFO Loading...

MAM domain containing glycosylphosphatidylinositol anchor 2

AlphaFold DB , UniProt , Accession A0A087XG21, Species POEFO (Poecilia formosa, Amazon molly), Gene MDGA2, Length 955 aa.

						>A0A087XG21_POEFO|A0A087XG21|MDGA2
MPLIYTFPLNLVALTWFVAFLSTAPPTVRIIHSGHACNVEEERHTERVYTIREGETLELTCLVTGHPRPQIRWTKTAGSVSDRFQDSSVFNDTLHIAKIQRTQGGRYYCKAENGLGSPAIKSIRVDVYYLDNPVITVHQSIGEAKEQFYYERTVFLRCVANSNPPVRYSWHRGREVLTQGSDKGVEIYEPFFTQGETKILKLKNLRPQDYANYSCIASVRNVCGIPDRSVIFGLTNKTASPSIKLLVEDPIVVNPGQTVSLVCITTGGEPPPILTWVSSNDSLPQRSVVKGGTLTLPAITSDEAGVYSCVASNNVGNPAKKSTTIVVRALKKGRFWITPDPYHNDDNIQIGREVKISCQVVEATPPEELTFSWLKNGRALRSSERMVITQTDPDISPGTTNLDIIDLKFTDFGTYTCVAALKGGGIPEISIDVNISSTTVPPSLTVPRGKSPLVAREGDTVELECLVSGKPKPIILWSRADKEAPMPDGSMQMESYDGVLRIVNVSREMTGSYRCQTSQYNGFNVKPREAVVELIVQYPPTVEPVHTEVRQGLGRPVVLTCRVLRAHPSRVLRFEWLLSNRLLHAGAFDQHKDETEYTIRSLNREGWGEYTCNVINEAGAGKCTFQVTGKAYPPEFYYDTYSPLWQYRPRVYGFKLQWTQMNPGAVDRIVAYRLGIRQVGLQRWWEQEIPVGDTIGKGELMTHNLTELIKPESYEVRLTPITRFGEGDSTVRIITYSAPINPHLREFHCSFEEEPICMFTQDKNDDFDWTRHSAATRDTKYTPNTGPSADHTGSKQGFYMYIETSRPRKEGDQARLVSPFFNIAPKNPYGITNPPAYCFGFFYHMYGKHIGKLNAFLKQKGQMTLEAPVWSLSGNQGDRWKQAKVSIHPTSSFQVVLEGIRGPGIEGDIAIDDITLEEGECRDPPPNISANALSTSSHIWLLCTTLVLTLLEGQR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.1	Very low	29.3	Very low	242 Å²	242	159.6 Å²	159.6	100%	1.192	83%	0.825	S	S	*	*				0	150.6	0	-70	-179	174.6	0	0	108
2	P	36.3	Very low	29.1	Very low	125 Å²	125	156.5 Å²	156.5	81%	0.812	82%	0.817	S	S	*	*			cis	-97.7	-154	2.6	38.6	-32.5	0	0	0	113
3	L	27.1	Very low	29.1	Very low	146 Å²	146	151.2 Å²	151.2	76%	0.764	81%	0.811	S	S	*	*			trans	-81.8	156.2	-158.3	-72.9	72.2	0	0	0	115.3	Y5	L3-Y5 HydrophobicContact CD2-CE2 4.14Å
4	I	31	Very low	28.9	Very low	146 Å²	146	150.2 Å²	150.2	75%	0.749	80%	0.804	S	S	*	*			trans	-86.4	139.8	159	-63.4	162.5	0	0	0	108.5	T6	I4-T6 HydrophobicContact CG2-CG2 4.23Å
5	Y	26	Very low	29	Very low	204 Å²	204	149.2 Å²	149.2	80%	0.8	81%	0.805	S	S	*	*			trans	-137.1	127.5	152.6	-100.6	-80.4	0	0	0	109.8	L3	L3-Y5 HydrophobicContact CD2-CE2 4.14Å
6	T	27.2	Very low	28.7	Very low	115 Å²	115	152.4 Å²	152.4	71%	0.706	80%	0.803	S	S	*	*			trans	-101.3	145.8	177.9	41.6	0	0	0	0	110.7	I4	I4-T6 HydrophobicContact CG2-CG2 4.23Å
7	F	24.3	Very low	28.5	Very low	196 Å²	196	155.7 Å²	155.7	86%	0.86	81%	0.809	S	S	*	*			trans	-127.7	120	162.7	-94.6	-83.8	0	0	0	108.7
8	P	28.4	Very low	28.5	Very low	99 Å²	99	153.7 Å²	153.7	64%	0.643	81%	0.805	S	S	*	*			trans	-81.3	148.9	177.3	32.8	-33.6	0	0	0	111.3	N10	P8-N10 PolarHBondContact O-N 3.12Å
9	L	28.2	Very low	28.6	Very low	170 Å²	170	149.9 Å²	149.9	89%	0.89	80%	0.798	S	S	*	*			trans	-65.8	130.6	157.9	-82.9	74.8	0	0	0	108.1
10	N	25.4	Very low	29.3	Very low	144 Å²	144	152.4 Å²	152.4	77%	0.77	80%	0.801	S	S	*	*			trans	-125.9	124.9	170	-118.8	-16.3	0	0	0	109.1	P8 V12	P8-N10 PolarHBondContact O-N 3.12Å; N10-V12 PolarHBondContact O-N 3.19Å
11	L	32.4	Very low	30.3	Very low	169 Å²	169	151.1 Å²	151.1	89%	0.885	80%	0.795	S	S	*	*			trans	-69.5	122.9	169.5	-90.7	66	0	0	0	108.7
12	V	26.6	Very low	31.6	Very low	122 Å²	122	140.2 Å²	140.2	74%	0.739	74%	0.743	S	S	*	*			trans	-127.7	121	157.2	-179.5	0	0	0	0	106.9	N10 L14	N10-V12 PolarHBondContact O-N 3.19Å; V12-L14 PolarHBondContact O-N 3.2Å
13	A	29.2	Very low	33.3	Very low	88 Å²	88	136.4 Å²	136.4	73%	0.727	72%	0.717	S	S	*	*			trans	-70.7	120	-176.9	0	0	0	0	0	110.7	T15	A13-T15 PolarHBondContact O-N 3.19Å
14	L	25.7	Very low	35.6	Very low	137 Å²	137	131 Å²	131	72%	0.717	69%	0.693	S	S	*	*			trans	-81.4	89.6	169.2	-105.1	70.2	0	0	0	109.5	V12 W16	V12-L14 PolarHBondContact O-N 3.2Å; L14-W16 PolarHBondContact O-N 3.15Å
15	T	30.7	Very low	37.9	Very low	135 Å²	135	127.7 Å²	127.7	83%	0.828	68%	0.681	S	S	*	*			trans	-72.1	71.6	167.4	38.3	0	0	0	0	111	A13	A13-T15 PolarHBondContact O-N 3.19Å
16	W	24.8	Very low	40.5	Very low	201 Å²	201	118.5 Å²	118.5	76%	0.761	65%	0.647	S	S	*	*			trans	-90.3	116	172.2	-80.6	65.2	0	0	0	110.6	L14 V18	L14-W16 PolarHBondContact O-N 3.15Å; W16-V18 PolarHBondContact O-N 2.89Å
17	F	25.8	Very low	42.7	Very low	208 Å²	208	116.7 Å²	116.7	91%	0.912	64%	0.636	S	S	*	*			trans	-59.7	108.4	159.6	-96.6	-104.8	0	0	0	108.1	A19	F17-A19 VanDerWaalsContact C-N 3.29Å; F17-A19 PolarHBondContact O-N 3.3Å
18	V	27.7	Very low	45.1	Very low	120 Å²	120	108.1 Å²	108.1	73%	0.727	60%	0.599	S	S	*	*			trans	-72.9	90.6	169.8	-178.5	0	0	0	0	107.8	W16 F20	W16-V18 PolarHBondContact O-N 2.89Å; V18-F20 PolarHBondContact O-N 3.43Å
19	A	31.3	Very low	47.3	Very low	82 Å²	82	109.8 Å²	109.8	68%	0.678	59%	0.593	S	S	*	*			trans	-58.7	120.7	159.1	0	0	0	0	0	107.5	F17 L21	F17-A19 VanDerWaalsContact C-N 3.29Å; F17-A19 PolarHBondContact O-N 3.3Å; A19-L21 PolarHBondContact O-N 3.36Å
20	F	41.4	Very low	49.2	Very low	198 Å²	198	102.4 Å²	102.4	87%	0.868	55%	0.554	S	S	*	*			trans	-63.4	100.9	174.9	-84.8	-98.2	0	0	0	108.8	V18 S22	V18-F20 PolarHBondContact O-N 3.43Å; F20-S22 PolarHBondContact O-N 2.99Å; F20-S22 VanDerWaalsContact O-N 3.12Å
21	L	50	Low	51.4	Low	127 Å²	127	98.2 Å²	98.2	67%	0.665	53%	0.531	S	S	*	.			trans	-57.7	115.9	168.4	-73.2	167.9	0	0	0	107.8	A19 T23	A19-L21 PolarHBondContact O-N 3.36Å; L21-T23 PolarHBondContact O-N 3Å
22	S	63.6	Low	53.1	Low	13 Å²	13	93.7 Å²	93.7	9%	0.091	51%	0.505	C	S	.	.			trans	-74.6	-3.1	-176.4	65.3	0	0	0	0	113.7	F20 H66 Y637 T659 G698	F20-S22 PolarHBondContact O-N 2.99Å; F20-S22 VanDerWaalsContact O-N 3.12Å; S22-H66 WeakPolarHBondContact O-CB 3.36Å; S22-H66 PolarHBondContact O-CD2 2.7Å; S22-Y637 WeakPolarHBondContact O-CE2 3.35Å; S22-T659 WeakPolarHBondContact OG-CG2 3.42Å; S22-G698 PolarHBondContact N-O 2.94Å; S22-G698 PolarHBondContact OG-O 2.93Å
23	T	72.3	Confident	54.6	Low	45 Å²	45	91.4 Å²	91.4	28%	0.276	50%	0.495	S	S	.	.			trans	-77.2	127.4	172	51	0	0	0	0	111.3	L21 H66 L115	L21-T23 PolarHBondContact O-N 3Å; T23-H66 CarbonylContact C-O 3.55Å; T23-H66 VanDerWaalsContact CA-O 3.26Å; T23-H66 WeakPolarHBondContact CA-O 3.41Å; T23-L115 HydrophobicContact CG2-CD1 4.24Å
24	A	75.4	Confident	56	Low	32 Å²	32	88.1 Å²	88.1	26%	0.264	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	139.9	179.6	0	0	0	0	0	111.3	H66 N113	A24-H66 PolarHBondContact N-O 3.31Å; A24-H66 PolarHBondContact O-N 2.79Å; A24-H66 VanDerWaalsContact O-O 3.14Å; A24-N113 PolarHBondContact O-ND2 2.89Å
25	P	78.5	Confident	57.8	Low	77 Å²	77	87.6 Å²	87.6	50%	0.5	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	159.2	173.9	29.6	-35.7	0	0	0	111
26	P	80.6	Confident	59.6	Low	11 Å²	11	83.2 Å²	83.2	7%	0.071	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	147.3	-178	30.1	-36	0	0	0	111.2	T64 P69 A111 N113 L115 A119	P26-T64 WeakPolarHBondContact CA-O 3.33Å; P26-P69 HydrophobicContact CB-CB 4.01Å; P26-P69 HydrophobicContact CB-CG 3.61Å; P26-A111 HydrophobicContact CB-CB 4.29Å; P26-A111 WeakPolarHBondContact CG-O 3.21Å; P26-N113 WeakPolarHBondContact CD-OD1 3.4Å; P26-L115 WeakPolarHBondContact CD-O 3.24Å; P26-A119 HydrophobicContact CB-CB 3.94Å; P26-A119 HydrophobicContact CG-CB 3.91Å; P26-A119 WeakPolarHBondContact O-CB 3.45Å
27	T	73.7	Confident	61.6	Low	77 Å²	77	76 Å²	76	47%	0.472	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	156.3	160.7	94.1	0	0	0	0	110.5	V63 T64	T27-V63 VanDerWaalsContact O-CA 3.28Å; T27-V63 WeakPolarHBondContact O-CA 3.46Å; T27-T64 PolarHBondContact N-O 2.82Å; T27-T64 PolarHBondContact O-N 2.94Å; T27-T64 PolarHBondContact OG1-OG1 2.79Å
28	V	75.6	Confident	63.4	Low	15 Å²	15	69.7 Å²	69.7	9%	0.091	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	131.8	-172.8	169.8	0	0	0	0	111.1	C61 L62 V63 C109 A111 A119 K121	V28-C61 VanDerWaalsContact CG1-SG 3.58Å; V28-L62 WeakPolarHBondContact CA-O 3.23Å; V28-V63 HydrophobicContact CG2-CG1 4.15Å; V28-C109 HydrophobicContact CG1-CB 4.26Å; V28-A111 HydrophobicContact CG2-CB 3.4Å; V28-A119 HydrophobicContact CB-CB 4.29Å; V28-A119 HydrophobicContact CG2-CB 3.65Å; V28-K121 HydrophobicContact CB-CG 4.04Å; V28-K121 HydrophobicContact CG1-CB 3.76Å; V28-K121 HydrophobicContact CG1-CG 3.67Å
29	R	73.7	Confident	64.6	Low	135 Å²	135	66.4 Å²	66.4	51%	0.509	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	121	165	-172.1	176.7	84.1	163.4	4.4	109.8	L62	R29-L62 HydrophobicContact CB-CB 4.45Å; R29-L62 PolarHBondContact N-O 3.14Å; R29-L62 WeakPolarHBondContact O-CB 3.42Å; R29-L62 PolarHBondContact O-N 3.08Å
30	I	69.8	Low	65.5	Low	14 Å²	14	68 Å²	68	7%	0.072	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	133	171.2	-62.9	170.7	0	0	0	108.9	W73 C109 K121 I123	I30-W73 HydrophobicContact CD1-CH2 3.8Å; I30-W73 HydrophobicContact CD1-CZ3 4Å; I30-W73 HydrophobicContact CG1-CH2 3.9Å; I30-W73 HydrophobicContact CG2-CH2 3.93Å; I30-C109 HydrophobicContact CD1-CB 4.12Å; I30-C109 HydrophobicContact CG1-CB 4.14Å; I30-K121 HydrophobicContact CD1-CB 3.92Å; I30-K121 HydrophobicContact CG1-CB 4.23Å; I30-I123 HydrophobicContact CD1-CB 4.29Å; I30-I123 HydrophobicContact CD1-CG2 4.15Å; I30-I123 HydrophobicContact CG2-CD1 4.04Å; I30-I123 HydrophobicContact CG2-CG2 4.32Å
31	I	70.8	Confident	65.6	Low	57 Å²	57	64.7 Å²	64.7	29%	0.292	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	173.5	168.7	66.8	165.2	0	0	0	109.4	T60 L62	I31-T60 HydrophobicContact CG1-CG2 4.44Å; I31-T60 WeakPolarHBondContact CG1-O 3.43Å; I31-T60 PolarHBondContact N-O 2.89Å; I31-T60 PolarHBondContact O-N 3.42Å; I31-L62 HydrophobicContact CD1-CD1 4.1Å; I31-L62 HydrophobicContact CD1-CD2 4.15Å; I31-L62 HydrophobicContact CD1-CG 4.19Å; I31-L62 HydrophobicContact CG1-CD1 4.37Å; I31-L62 HydrophobicContact CG1-CG 4.22Å; I31-L62 HydrophobicContact CG2-CD1 3.83Å; I31-L62 HydrophobicContact CG2-CG 4.35Å
32	H	68.2	Low	65.1	Low	74 Å²	74	63.1 Å²	63.1	34%	0.343	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	153	177.3	58.7	78.4	0	0	0	111	Y49 E58 L59	H32-Y49 HydrophobicContact CB-CD2 3.89Å; H32-Y49 HydrophobicContact CB-CE2 3.46Å; H32-Y49 VanDerWaalsContact CB-CE2 3.46Å; H32-Y49 AromaticContact CG-CD2 3.88Å; H32-Y49 AromaticContact CG-CE2 3.57Å; H32-Y49 AromaticContact ND1-CE2 3.9Å; H32-E58 WeakPolarHBondContact CA-O 3.46Å; H32-L59 HydrophobicContact CB-CD2 3.85Å
33	S	57.9	Low	63.9	Low	74 Å²	74	72.7 Å²	72.7	52%	0.517	38%	0.38	S	S	.	.			trans	-137.1	-12.2	178.2	42.2	0	0	0	0	113.7	E58	S33-E58 WeakPolarHBondContact CB-OE2 3.41Å; S33-E58 PolarHBondContact N-O 2.94Å; S33-E58 PolarHBondContact OG-OE2 2.84Å
34	G	58.3	Low	62.5	Low	19 Å²	19	78.1 Å²	78.1	20%	0.196	40%	0.402	C	S	.	.	S	Bend	trans	-73.1	179.8	174.8	0	0	0	0	0	114	A36 Y49	G34-A36 PolarHBondContact O-N 2.91Å; G34-Y49 PolarHBondContact O-OH 2.89Å
35	H	64.2	Low	61.1	Low	125 Å²	125	83.8 Å²	83.8	58%	0.579	43%	0.434	S	S	*	.			trans	-66.5	115.5	178.4	-66.2	-27.5	0	0	0	111	Y49 I51	H35-Y49 PolarHBondContact O-OH 2.87Å; H35-I51 WeakPolarHBondContact O-CD1 3.48Å; H35-I51 WeakPolarHBondContact O-CG1 3.37Å
36	A	68.6	Low	59.9	Low	44 Å²	44	81.5 Å²	81.5	36%	0.364	42%	0.416	S	S	.	.			trans	-120.4	130.3	177.9	0	0	0	0	0	109.6	G34 V39 Y49	G34-A36 PolarHBondContact O-N 2.91Å; A36-V39 HydrophobicContact CB-CG2 3.95Å; A36-Y49 HydrophobicContact CB-CD2 4.28Å; A36-Y49 HydrophobicContact CB-CE2 3.58Å
37	C	66.5	Low	59.2	Low	50 Å²	50	86 Å²	86	34%	0.338	43%	0.431	S	S	.	.	S	Bend	trans	-92	-27.9	-179.7	-69.7	0	0	0	0	113.2	T50 C223	C37-T50 HydrophobicContact CB-CG2 4.12Å; C37-T50 PolarHBondContact N-O 3.06Å; C37-C223 HydrophobicContact CB-CB 3.4Å; C37-C223 VanDerWaalsContact CB-CB 3.4Å; C37-C223 WeakPolarHBondContact CB-SG 3.5Å; C37-C223 WeakPolarHBondContact SG-CA 3.49Å; C37-C223 WeakPolarHBondContact SG-CB 3.2Å; C37-C223 CovalentContact SG-SG 2.03Å; C37-C223 PolarHBondContact SG-SG 2.9Å
38	N	62.7	Low	59.4	Low	75 Å²	75	82.7 Å²	82.7	40%	0.401	41%	0.412	S	S	.	.	B	Isolated β-bridge	trans	-161.9	152.7	170.2	-162.9	3.1	0	0	0	108.3	E40 T50	N38-E40 WeakPolarHBondContact ND2-CG 3.43Å; N38-E40 PolarHBondContact ND2-OE1 3.26Å; N38-T50 WeakPolarHBondContact O-CB 3.37Å; N38-T50 PolarHBondContact O-N 2.96Å
39	V	53	Low	59.7	Low	51 Å²	51	82 Å²	82	31%	0.309	41%	0.407	S	S	.	.			trans	-140.2	88.2	175.1	-177.4	0	0	0	0	108	A36 V48 Y49	A36-V39 HydrophobicContact CB-CG2 3.95Å; V39-V48 WeakPolarHBondContact CA-O 3.32Å; V39-Y49 HydrophobicContact CG2-CD2 4.29Å
40	E	50.1	Low	60.3	Low	116 Å²	116	75.9 Å²	75.9	54%	0.542	39%	0.385	S	S	.	.			trans	-92.3	138.1	178.2	-65.9	-175.8	-173.6	0	0	110.6	N38 E42 V48	N38-E40 WeakPolarHBondContact ND2-CG 3.43Å; N38-E40 PolarHBondContact ND2-OE1 3.26Å; E40-E42 PolarHBondContact O-N 3.33Å; E40-V48 PolarHBondContact O-N 2.82Å
41	E	44.5	Very low	61.2	Low	128 Å²	128	75.2 Å²	75.2	60%	0.598	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.2	100	163.9	-60.2	-155.1	137.6	0	0	108.4	R47	E41-R47 HydrophobicContact CG-CG 4.3Å; E41-R47 IonicContact OE1-CZ 3.43Å; E41-R47 IonicContact OE1-NE 3.82Å; E41-R47 PolarHBondContact OE1-NE 2.87Å; E41-R47 IonicContact OE1-NH2 2.71Å; E41-R47 PolarHBondContact OE1-NH2 2.86Å
42	E	38.7	Very low	62.2	Low	93 Å²	93	76.8 Å²	76.8	44%	0.435	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	144.2	172.7	-76.7	-171.9	124.8	0	0	109.6	E40 H44 E46 V48 R124	E40-E42 PolarHBondContact O-N 3.33Å; E42-H44 PolarHBondContact O-N 2.93Å; E42-E46 PolarHBondContact N-O 3.48Å; E42-V48 HydrophobicContact CG-CG2 3.98Å; E42-V48 WeakPolarHBondContact OE2-CG2 3.36Å; E42-R124 VanDerWaalsContact CD-NH2 3.27Å; E42-R124 IonicContact OE1-NH2 3.37Å; E42-R124 PolarHBondContact OE1-NH2 2.86Å; E42-R124 IonicContact OE2-CZ 3.8Å; E42-R124 IonicContact OE2-NE 3.75Å; E42-R124 IonicContact OE2-NH2 3.86Å; E42-R124 PolarHBondContact OE2-NH2 3.4Å
43	R	39.3	Very low	63.3	Low	214 Å²	214	75.8 Å²	75.8	81%	0.808	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-7	-163.1	-76.4	-178.4	161	-155.7	-12.6	116.8
44	H	43.2	Very low	64.7	Low	160 Å²	160	74.1 Å²	74.1	74%	0.741	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.3	96.2	176	-61.1	-53	0	0	0	111.9	E42 E46	E42-H44 PolarHBondContact O-N 2.93Å; H44-E46 PolarHBondContact O-N 3.26Å
45	T	45.8	Very low	66.1	Low	151 Å²	151	74.7 Å²	74.7	93%	0.926	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	5.8	161	62.8	0	0	0	0	119.4
46	E	53.1	Low	67	Low	28 Å²	28	71 Å²	71	13%	0.131	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	129.1	-170.2	-169	163.8	160.9	0	0	112.4	E42 H44 R106 R124	E42-E46 PolarHBondContact N-O 3.48Å; H44-E46 PolarHBondContact O-N 3.26Å; E46-R106 VanDerWaalsContact CD-CZ 3.47Å; E46-R106 IonicContact OE1-CZ 2.74Å; E46-R106 IonicContact OE1-NH1 3.33Å; E46-R106 PolarHBondContact OE1-NH1 2.83Å; E46-R106 IonicContact OE1-NH2 2.7Å; E46-R106 PolarHBondContact OE1-NH2 2.91Å; E46-R106 IonicContact OE2-CZ 3.94Å; E46-R106 IonicContact OE2-NH1 3.42Å; E46-R106 PolarHBondContact OE2-NH1 3.48Å; E46-R106 IonicContact OE2-NH2 2.75Å; E46-R106 PolarHBondContact OE2-NH2 2.81Å; E46-R124 HydrophobicContact CG-CB 4.5Å; E46-R124 VanDerWaalsContact OE1-CB 3.31Å; E46-R124 WeakPolarHBondContact OE1-CB 3.43Å; E46-R124 WeakPolarHBondContact OE1-CD 3.45Å; E46-R124 IonicContact OE1-NE 3.12Å; E46-R124 PolarHBondContact OE1-NE 3.17Å
47	R	66.5	Low	67.7	Low	105 Å²	105	69 Å²	69	40%	0.396	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	134	171	-74.3	-176.8	170.6	-166.6	-11.9	109.6	E41 I123 R124	E41-R47 HydrophobicContact CG-CG 4.3Å; E41-R47 IonicContact OE1-CZ 3.43Å; E41-R47 IonicContact OE1-NE 3.82Å; E41-R47 PolarHBondContact OE1-NE 2.87Å; E41-R47 IonicContact OE1-NH2 2.71Å; E41-R47 PolarHBondContact OE1-NH2 2.86Å; R47-I123 HydrophobicContact CB-CD1 4.5Å; R47-I123 HydrophobicContact CB-CG1 4.14Å; R47-I123 WeakPolarHBondContact O-CG1 3.46Å; R47-R124 PolarHBondContact O-N 3.47Å
48	V	76.4	Confident	68.4	Low	9 Å²	9	69.6 Å²	69.6	6%	0.055	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	134.3	174.2	-168.3	0	0	0	0	108.9	V39 E40 E42 R124 D126	V39-V48 WeakPolarHBondContact CA-O 3.32Å; E40-V48 PolarHBondContact O-N 2.82Å; E42-V48 HydrophobicContact CG-CG2 3.98Å; E42-V48 WeakPolarHBondContact OE2-CG2 3.36Å; V48-R124 CarbonylContact C-O 3.56Å; V48-R124 WeakPolarHBondContact CA-O 3.24Å; V48-D126 HydrophobicContact CG1-CB 4.27Å
49	Y	82.8	Confident	69.2	Low	0 Å²	0	66 Å²	66	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	108.3	176.2	-176.4	-86.7	0	0	0	108.8	H32 G34 H35 A36 V39 I51 L57 L59 R124 V125 D126	H32-Y49 HydrophobicContact CB-CD2 3.89Å; H32-Y49 HydrophobicContact CB-CE2 3.46Å; H32-Y49 VanDerWaalsContact CB-CE2 3.46Å; H32-Y49 AromaticContact CG-CD2 3.88Å; H32-Y49 AromaticContact CG-CE2 3.57Å; H32-Y49 AromaticContact ND1-CE2 3.9Å; G34-Y49 PolarHBondContact O-OH 2.89Å; H35-Y49 PolarHBondContact O-OH 2.87Å; A36-Y49 HydrophobicContact CB-CD2 4.28Å; A36-Y49 HydrophobicContact CB-CE2 3.58Å; V39-Y49 HydrophobicContact CG2-CD2 4.29Å; Y49-I51 HydrophobicContact CD1-CB 4.33Å; Y49-I51 HydrophobicContact CD1-CG2 4.39Å; Y49-I51 HydrophobicContact CE1-CB 3.87Å; Y49-I51 HydrophobicContact CE1-CD1 4.17Å; Y49-I51 HydrophobicContact CE1-CG2 4.27Å; Y49-L57 HydrophobicContact CD1-CD1 3.44Å; Y49-L57 VanDerWaalsContact CD1-CD1 3.44Å; Y49-L57 HydrophobicContact CE1-CD1 3.26Å; Y49-L57 HydrophobicContact CG-CD1 4.35Å; Y49-L59 HydrophobicContact CD2-CD2 4.04Å; Y49-L59 HydrophobicContact CE2-CD2 4.28Å; Y49-L59 HydrophobicContact CG-CD2 4.21Å; Y49-R124 PolarHBondContact N-O 3.15Å; Y49-V125 HydrophobicContact CD1-CG1 4.5Å; Y49-V125 WeakPolarHBondContact O-CA 3.25Å; Y49-D126 PolarHBondContact O-N 3.3Å
50	T	86.6	Confident	70.3	Confident	7 Å²	7	64.6 Å²	64.6	4%	0.043	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	126.2	-175.9	-58.4	0	0	0	0	110.9	C37 N38 D126 Y128	C37-T50 HydrophobicContact CB-CG2 4.12Å; C37-T50 PolarHBondContact N-O 3.06Å; N38-T50 WeakPolarHBondContact O-CB 3.37Å; N38-T50 PolarHBondContact O-N 2.96Å; T50-D126 WeakPolarHBondContact CA-O 3.3Å; T50-Y128 HydrophobicContact CG2-CD1 3.96Å; T50-Y128 HydrophobicContact CG2-CD2 3.27Å; T50-Y128 HydrophobicContact CG2-CE1 3.91Å; T50-Y128 HydrophobicContact CG2-CE2 3.19Å; T50-Y128 HydrophobicContact CG2-CG 3.68Å
51	I	88.3	Confident	71.4	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	151.2	-176.8	-174.8	165.7	0	0	0	111.4	H35 Y49 E55 T56 L57 I99 V125 D126 V127 Y128	H35-I51 WeakPolarHBondContact O-CD1 3.48Å; H35-I51 WeakPolarHBondContact O-CG1 3.37Å; Y49-I51 HydrophobicContact CD1-CB 4.33Å; Y49-I51 HydrophobicContact CD1-CG2 4.39Å; Y49-I51 HydrophobicContact CE1-CB 3.87Å; Y49-I51 HydrophobicContact CE1-CD1 4.17Å; Y49-I51 HydrophobicContact CE1-CG2 4.27Å; I51-E55 HydrophobicContact CD1-CB 3.97Å; I51-E55 HydrophobicContact CG1-CB 3.88Å; I51-T56 VanDerWaalsContact CD1-C 3.45Å; I51-T56 WeakPolarHBondContact CD1-O 3.09Å; I51-L57 HydrophobicContact CD1-CB 4.18Å; I51-I99 HydrophobicContact CD1-CG2 4.15Å; I51-I99 HydrophobicContact CG1-CG2 4.27Å; I51-I99 HydrophobicContact CG2-CD1 4.35Å; I51-I99 HydrophobicContact CG2-CG2 4.06Å; I51-V125 HydrophobicContact CG2-CG1 3.98Å; I51-D126 PolarHBondContact N-O 3.18Å; I51-V127 HydrophobicContact CG2-CG2 4.29Å; I51-V127 CarbonylContact O-C 3.58Å; I51-V127 WeakPolarHBondContact O-CA 3.4Å; I51-Y128 PolarHBondContact O-N 2.95Å
52	R	90.8	Very high	72.5	Confident	90 Å²	90	56.3 Å²	56.3	34%	0.34	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	143.8	177.4	-166.4	164	53.7	163.6	2.5	111.6	G54 E55 C223 G224 I225	R52-G54 PolarHBondContact O-N 2.93Å; R52-E55 HydrophobicContact CB-CG 4.13Å; R52-E55 IonicContact CZ-OE1 2.71Å; R52-E55 IonicContact NE-OE1 3.75Å; R52-E55 PolarHBondContact NE-OE1 2.85Å; R52-E55 IonicContact NH2-OE1 3.79Å; R52-E55 PolarHBondContact NH2-OE1 3.45Å; R52-E55 WeakPolarHBondContact O-CB 3.5Å; R52-E55 PolarHBondContact O-N 2.93Å; R52-E55 VanDerWaalsContact O-N 3.16Å; R52-C223 PolarHBondContact N-SG 3.25Å; R52-C223 VanDerWaalsContact N-SG 3.38Å; R52-G224 PolarHBondContact NH1-O 2.66Å; R52-I225 HydrophobicContact CG-CD1 4.29Å; R52-I225 HydrophobicContact CG-CG1 4Å
53	E	92.3	Very high	74.1	Confident	52 Å²	52	53.2 Å²	53.2	24%	0.243	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	129.6	169.9	-173	168.4	-119.7	0	0	110.8	R101 V127 Y128	E53-R101 WeakPolarHBondContact OE1-CB 3.23Å; E53-R101 VanDerWaalsContact OE1-CG 3.24Å; E53-R101 WeakPolarHBondContact OE1-CG 3.34Å; E53-R101 IonicContact OE1-CZ 3.97Å; E53-R101 PolarHBondContact OE1-N 3.14Å; E53-R101 IonicContact OE1-NE 2.97Å; E53-R101 PolarHBondContact OE1-NE 2.89Å; E53-R101 IonicContact OE1-NH2 2.83Å; E53-R101 IonicContact OE2-CZ 3.14Å; E53-R101 IonicContact OE2-NE 2.91Å; E53-R101 PolarHBondContact OE2-NE 2.82Å; E53-R101 IonicContact OE2-NH2 2.65Å; E53-R101 PolarHBondContact OE2-NH2 2.9Å; E53-V127 HydrophobicContact CB-CG1 3.82Å; E53-V127 HydrophobicContact CG-CG1 4.4Å; E53-Y128 PolarHBondContact N-O 2.81Å
54	G	87.4	Confident	75.6	Confident	39 Å²	39	46 Å²	46	40%	0.402	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.9	-3.6	-175.9	0	0	0	0	0	116	R52 K98 I99	R52-G54 PolarHBondContact O-N 2.93Å; G54-K98 WeakPolarHBondContact O-CA 3.28Å; G54-I99 PolarHBondContact N-O 2.9Å
55	E	88.1	Confident	76.8	Confident	31 Å²	31	38.6 Å²	38.6	15%	0.145	21%	0.209	C	C	.	.	S	Bend	trans	-92.2	179.9	175.2	-70.3	178.1	179.8	0	0	113.2	I51 R52 K98 I99	I51-E55 HydrophobicContact CD1-CB 3.97Å; I51-E55 HydrophobicContact CG1-CB 3.88Å; R52-E55 HydrophobicContact CB-CG 4.13Å; R52-E55 IonicContact CZ-OE1 2.71Å; R52-E55 IonicContact NE-OE1 3.75Å; R52-E55 PolarHBondContact NE-OE1 2.85Å; R52-E55 IonicContact NH2-OE1 3.79Å; R52-E55 PolarHBondContact NH2-OE1 3.45Å; R52-E55 WeakPolarHBondContact O-CB 3.5Å; R52-E55 PolarHBondContact O-N 2.93Å; R52-E55 VanDerWaalsContact O-N 3.16Å; E55-K98 CarbonylContact O-C 3.53Å; E55-K98 VanDerWaalsContact O-CA 3.27Å; E55-K98 WeakPolarHBondContact O-CA 3.4Å; E55-K98 PolarHBondContact O-N 2.91Å; E55-I99 PolarHBondContact O-N 2.79Å
56	T	83.2	Confident	78.3	Confident	49 Å²	49	31.5 Å²	31.5	30%	0.301	17%	0.165	S	C	.	.			trans	-105	118.3	-177.8	-61.2	0	0	0	0	111.3	I51 H95 I96 A97	I51-T56 VanDerWaalsContact CD1-C 3.45Å; I51-T56 WeakPolarHBondContact CD1-O 3.09Å; T56-H95 WeakPolarHBondContact CG2-NE2 3.27Å; T56-I96 WeakPolarHBondContact CA-O 3.48Å; T56-A97 HydrophobicContact CG2-CB 4.45Å
57	L	83.4	Confident	79.7	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	131.4	170.2	175.3	71.1	0	0	0	109.5	Y49 I51 L59 H95 I96 I99 V125	Y49-L57 HydrophobicContact CD1-CD1 3.44Å; Y49-L57 VanDerWaalsContact CD1-CD1 3.44Å; Y49-L57 HydrophobicContact CE1-CD1 3.26Å; Y49-L57 HydrophobicContact CG-CD1 4.35Å; I51-L57 HydrophobicContact CD1-CB 4.18Å; L57-L59 HydrophobicContact CD1-CD1 3.91Å; L57-L59 HydrophobicContact CD1-CD2 4.06Å; L57-L59 HydrophobicContact CD1-CG 3.74Å; L57-L59 HydrophobicContact CD2-CD1 4.14Å; L57-L59 HydrophobicContact CG-CD1 4.22Å; L57-L59 HydrophobicContact CG-CG 4.08Å; L57-H95 WeakPolarHBondContact O-CA 3.39Å; L57-I96 HydrophobicContact CB-CB 4.25Å; L57-I96 HydrophobicContact CD2-CB 4.49Å; L57-I96 HydrophobicContact CD2-CD1 4.08Å; L57-I96 HydrophobicContact CD2-CG1 4.35Å; L57-I96 PolarHBondContact N-O 3.47Å; L57-I96 PolarHBondContact O-N 3.23Å; L57-I99 HydrophobicContact CB-CD1 4.08Å; L57-I99 HydrophobicContact CD2-CD1 4Å; L57-V125 HydrophobicContact CD1-CG1 4.14Å; L57-V125 HydrophobicContact CD1-CG2 3.98Å; L57-V125 HydrophobicContact CD2-CG1 4.23Å; L57-V125 HydrophobicContact CD2-CG2 4.01Å
58	E	80.2	Confident	80.2	Confident	63 Å²	63	32.2 Å²	32.2	29%	0.294	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	115.1	172.1	-171.5	179.2	-129.7	0	0	110.4	H32 S33 T93 L94	H32-E58 WeakPolarHBondContact CA-O 3.46Å; S33-E58 WeakPolarHBondContact CB-OE2 3.41Å; S33-E58 PolarHBondContact N-O 2.94Å; S33-E58 PolarHBondContact OG-OE2 2.84Å; E58-T93 HydrophobicContact CG-CG2 3.62Å; E58-L94 WeakPolarHBondContact CA-O 3.35Å
59	L	78.7	Confident	80.4	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	118.2	-175.7	-61.3	176.3	0	0	0	110	H32 Y49 L57 W73 T93 L94 I123 V125	H32-L59 HydrophobicContact CB-CD2 3.85Å; Y49-L59 HydrophobicContact CD2-CD2 4.04Å; Y49-L59 HydrophobicContact CE2-CD2 4.28Å; Y49-L59 HydrophobicContact CG-CD2 4.21Å; L57-L59 HydrophobicContact CD1-CD1 3.91Å; L57-L59 HydrophobicContact CD1-CD2 4.06Å; L57-L59 HydrophobicContact CD1-CG 3.74Å; L57-L59 HydrophobicContact CD2-CD1 4.14Å; L57-L59 HydrophobicContact CG-CD1 4.22Å; L57-L59 HydrophobicContact CG-CG 4.08Å; L59-W73 HydrophobicContact CB-CH2 3.84Å; L59-W73 HydrophobicContact CB-CZ2 4.06Å; L59-W73 HydrophobicContact CD1-CH2 4.46Å; L59-W73 WeakPolarHBondContact O-CZ2 3.45Å; L59-T93 CarbonylContact O-C 3.58Å; L59-T93 WeakPolarHBondContact O-CA 3.46Å; L59-L94 HydrophobicContact CB-CB 4.49Å; L59-L94 HydrophobicContact CD1-CD2 4.45Å; L59-L94 PolarHBondContact N-O 3.23Å; L59-L94 PolarHBondContact O-N 2.98Å; L59-I123 HydrophobicContact CD1-CG2 3.74Å; L59-I123 HydrophobicContact CD2-CD1 3.98Å; L59-V125 HydrophobicContact CD1-CG2 3.99Å
60	T	76.6	Confident	80.3	Confident	22 Å²	22	38.7 Å²	38.7	14%	0.135	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	131.1	-179	-57	0	0	0	0	111.1	I31 L62 T93	I31-T60 HydrophobicContact CG1-CG2 4.44Å; I31-T60 WeakPolarHBondContact CG1-O 3.43Å; I31-T60 PolarHBondContact N-O 2.89Å; I31-T60 PolarHBondContact O-N 3.42Å; T60-L62 HydrophobicContact CG2-CD2 4.21Å; T60-T93 WeakPolarHBondContact CG2-OG1 3.38Å; T60-T93 WeakPolarHBondContact OG1-CG2 3.34Å; T60-T93 PolarHBondContact OG1-OG1 2.84Å
61	C	73.6	Confident	80	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.014	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	105.9	176	-171.5	0	0	0	0	110.6	V28 I71 W73 D92 C109	V28-C61 VanDerWaalsContact CG1-SG 3.58Å; C61-I71 HydrophobicContact CB-CD1 4.44Å; C61-I71 HydrophobicContact CB-CG2 4.24Å; C61-W73 HydrophobicContact CB-CZ2 3.73Å; C61-D92 WeakPolarHBondContact CB-O 3.01Å; C61-D92 PolarHBondContact N-O 2.85Å; C61-C109 HydrophobicContact CB-CB 3.72Å; C61-C109 WeakPolarHBondContact CB-SG 3.37Å; C61-C109 WeakPolarHBondContact SG-CB 3.36Å; C61-C109 CovalentContact SG-SG 2.02Å; C61-C109 PolarHBondContact SG-SG 2.91Å
62	L	68.3	Low	79.7	Confident	68 Å²	68	42.5 Å²	42.5	36%	0.356	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	133.2	171.4	-54	179.7	0	0	0	109.3	V28 R29 I31 T60	V28-L62 WeakPolarHBondContact CA-O 3.23Å; R29-L62 HydrophobicContact CB-CB 4.45Å; R29-L62 PolarHBondContact N-O 3.14Å; R29-L62 WeakPolarHBondContact O-CB 3.42Å; R29-L62 PolarHBondContact O-N 3.08Å; I31-L62 HydrophobicContact CD1-CD1 4.1Å; I31-L62 HydrophobicContact CD1-CD2 4.15Å; I31-L62 HydrophobicContact CD1-CG 4.19Å; I31-L62 HydrophobicContact CG1-CD1 4.37Å; I31-L62 HydrophobicContact CG1-CG 4.22Å; I31-L62 HydrophobicContact CG2-CD1 3.83Å; I31-L62 HydrophobicContact CG2-CG 4.35Å; T60-L62 HydrophobicContact CG2-CD2 4.21Å
63	V	71.1	Confident	79.3	Confident	27 Å²	27	38.4 Å²	38.4	16%	0.164	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	145.9	177.6	-60.5	0	0	0	0	111.9	T27 V28 P69 I71 A111	T27-V63 VanDerWaalsContact O-CA 3.28Å; T27-V63 WeakPolarHBondContact O-CA 3.46Å; V28-V63 HydrophobicContact CG2-CG1 4.15Å; V63-P69 HydrophobicContact CB-CB 4.4Å; V63-P69 HydrophobicContact CB-CG 4.35Å; V63-P69 HydrophobicContact CG2-CB 4.41Å; V63-P69 HydrophobicContact CG2-CG 4.49Å; V63-I71 HydrophobicContact CG1-CD1 3.76Å; V63-I71 HydrophobicContact CG1-CG1 3.73Å; V63-I71 HydrophobicContact CG2-CD1 3.97Å; V63-I71 HydrophobicContact CG2-CG1 4.31Å; V63-A111 HydrophobicContact CG1-CB 3.67Å
64	T	70.8	Confident	78.7	Confident	62 Å²	62	37.9 Å²	37.9	38%	0.38	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	171.5	167.5	68.8	0	0	0	0	109.7	P26 T27 P69	P26-T64 WeakPolarHBondContact CA-O 3.33Å; T27-T64 PolarHBondContact N-O 2.82Å; T27-T64 PolarHBondContact O-N 2.94Å; T27-T64 PolarHBondContact OG1-OG1 2.79Å; T64-P69 WeakPolarHBondContact O-CG 3.49Å
65	G	69.8	Low	78.4	Confident	6 Å²	6	39.4 Å²	39.4	6%	0.062	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	111.2	160.9	-175.6	0	0	0	0	0	112.2	P67 D639	G65-P67 CarbonylContact C-O 3.51Å; G65-D639 PolarHBondContact N-OD2 2.86Å
66	H	77.1	Confident	77.6	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.009	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	121.6	-166.9	-168.9	65.8	0	0	0	111.7	S22 T23 A24 L115 E635 F636 Y637 T659	S22-H66 WeakPolarHBondContact O-CB 3.36Å; S22-H66 PolarHBondContact O-CD2 2.7Å; T23-H66 CarbonylContact C-O 3.55Å; T23-H66 VanDerWaalsContact CA-O 3.26Å; T23-H66 WeakPolarHBondContact CA-O 3.41Å; A24-H66 PolarHBondContact N-O 3.31Å; A24-H66 PolarHBondContact O-N 2.79Å; A24-H66 VanDerWaalsContact O-O 3.14Å; H66-L115 WeakPolarHBondContact O-CD1 3.02Å; H66-E635 PolarHBondContact CE1-O 2.72Å; H66-E635 VanDerWaalsContact CE1-O 3.3Å; H66-F636 PolarHBondContact CE1-O 2.83Å; H66-Y637 HydrophobicContact CB-CD2 4.1Å; H66-Y637 HydrophobicContact CB-CE2 3.92Å; H66-Y637 AromaticContact CD2-CD2 3.7Å; H66-Y637 AromaticContact CE1-CD2 3.92Å; H66-Y637 AromaticContact CG-CD2 3.49Å; H66-Y637 VanDerWaalsContact CG-CD2 3.49Å; H66-Y637 AromaticContact CG-CE2 3.8Å; H66-Y637 AromaticContact ND1-CD2 3.66Å; H66-Y637 AromaticContact NE2-CD2 3.95Å; H66-T659 VanDerWaalsContact NE2-CG2 3.35Å; H66-T659 WeakPolarHBondContact NE2-CG2 3.39Å; H66-T659 PolarHBondContact NE2-OG1 3.02Å
67	P	82.9	Confident	76.3	Confident	23 Å²	23	42.1 Å²	42.1	15%	0.149	22%	0.22	C	C	.	.	S	Bend	cis	-61.9	157.5	5.2	-22.9	35.3	0	0	0	113.5	G65 P69 N113 E635	G65-P67 CarbonylContact C-O 3.51Å; P67-P69 WeakPolarHBondContact O-CD 3.13Å; P67-N113 WeakPolarHBondContact O-CB 3.45Å; P67-N113 PolarHBondContact O-ND2 3.02Å; P67-E635 HydrophobicContact CB-CB 4.31Å; P67-E635 HydrophobicContact CB-CG 4.15Å; P67-E635 HydrophobicContact CG-CG 4.18Å; P67-E635 WeakPolarHBondContact CG-OE1 3.37Å
68	R	76.6	Confident	74.6	Confident	124 Å²	124	45 Å²	45	47%	0.468	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-56.1	121.9	-177.4	179.6	172	172.6	158.6	-2	110.4	Y638	R68-Y638 HydrophobicContact CB-CD2 4.04Å; R68-Y638 HydrophobicContact CB-CE2 4.05Å; R68-Y638 HydrophobicContact CG-CD2 4.44Å; R68-Y638 HydrophobicContact CG-CE2 4.49Å
69	P	79.6	Confident	72.4	Confident	6 Å²	6	46.8 Å²	46.8	4%	0.039	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-63.6	142.8	-176.2	-25	35.4	0	0	0	114	P26 V63 T64 P67 A111 E112 N113	P26-P69 HydrophobicContact CB-CB 4.01Å; P26-P69 HydrophobicContact CB-CG 3.61Å; V63-P69 HydrophobicContact CB-CB 4.4Å; V63-P69 HydrophobicContact CB-CG 4.35Å; V63-P69 HydrophobicContact CG2-CB 4.41Å; V63-P69 HydrophobicContact CG2-CG 4.49Å; T64-P69 WeakPolarHBondContact O-CG 3.49Å; P67-P69 WeakPolarHBondContact O-CD 3.13Å; P69-A111 HydrophobicContact CB-CB 3.89Å; P69-E112 WeakPolarHBondContact CA-O 3.33Å; P69-N113 HydrophobicContact CB-CB 4.43Å; P69-N113 HydrophobicContact CG-CB 4.32Å
70	Q	81.6	Confident	70.4	Confident	139 Å²	139	53.5 Å²	53.5	65%	0.65	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.9	136.5	166.5	-62.2	-57.2	-43.7	0	0	109.4	A111 E112	Q70-A111 VanDerWaalsContact O-CA 3.29Å; Q70-A111 WeakPolarHBondContact O-CA 3.37Å; Q70-E112 PolarHBondContact N-O 3.07Å; Q70-E112 PolarHBondContact O-N 2.79Å
71	I	80.8	Confident	68.5	Low	18 Å²	18	56.8 Å²	56.8	9%	0.092	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	136	-176.7	-63.7	169.9	0	0	0	109.7	C61 V63 F90 N91 D92 K110	C61-I71 HydrophobicContact CB-CD1 4.44Å; C61-I71 HydrophobicContact CB-CG2 4.24Å; V63-I71 HydrophobicContact CG1-CD1 3.76Å; V63-I71 HydrophobicContact CG1-CG1 3.73Å; V63-I71 HydrophobicContact CG2-CD1 3.97Å; V63-I71 HydrophobicContact CG2-CG1 4.31Å; I71-F90 WeakPolarHBondContact O-CA 3.39Å; I71-N91 VanDerWaalsContact CG2-O 3.26Å; I71-N91 WeakPolarHBondContact CG2-O 2.99Å; I71-D92 HydrophobicContact CD1-CB 3.86Å; I71-K110 WeakPolarHBondContact CA-O 3.13Å
72	R	80.6	Confident	66.8	Low	70 Å²	70	61.1 Å²	61.1	26%	0.264	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	123.9	165.8	177.5	175.9	168.4	159.7	3	109.6	T74 D86 S88 F90 K110	R72-T74 HydrophobicContact CG-CG2 4.11Å; R72-D86 IonicContact CZ-OD1 2.74Å; R72-D86 IonicContact NH2-OD1 3.25Å; R72-D86 PolarHBondContact NH2-OD1 2.71Å; R72-D86 IonicContact NH2-OD2 3.7Å; R72-D86 PolarHBondContact NH2-OD2 3.26Å; R72-S88 VanDerWaalsContact CZ-CB 3.42Å; R72-F90 HydrophobicContact CB-CD1 4.44Å; R72-F90 HydrophobicContact CB-CE1 4.35Å; R72-F90 HydrophobicContact CG-CE1 4.43Å; R72-K110 PolarHBondContact N-O 2.95Å; R72-K110 PolarHBondContact O-N 3.32Å
73	W	82.1	Confident	65.5	Low	3 Å²	3	68.4 Å²	68.4	1%	0.011	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	141.9	165.7	-76.6	98	0	0	0	111.1	I30 L59 C61 S88 V89 N91 D92 L94 Y108 C109 I123	I30-W73 HydrophobicContact CD1-CH2 3.8Å; I30-W73 HydrophobicContact CD1-CZ3 4Å; I30-W73 HydrophobicContact CG1-CH2 3.9Å; I30-W73 HydrophobicContact CG2-CH2 3.93Å; L59-W73 HydrophobicContact CB-CH2 3.84Å; L59-W73 HydrophobicContact CB-CZ2 4.06Å; L59-W73 HydrophobicContact CD1-CH2 4.46Å; L59-W73 WeakPolarHBondContact O-CZ2 3.45Å; C61-W73 HydrophobicContact CB-CZ2 3.73Å; W73-S88 WeakPolarHBondContact O-CA 3.37Å; W73-V89 HydrophobicContact CB-CB 4.44Å; W73-V89 PolarHBondContact N-O 2.86Å; W73-N91 VanDerWaalsContact CD1-O 3.31Å; W73-D92 PolarHBondContact NE1-O 3.1Å; W73-L94 HydrophobicContact CD2-CB 3.85Å; W73-L94 HydrophobicContact CD2-CD2 4.16Å; W73-L94 HydrophobicContact CE3-CB 4.44Å; W73-L94 HydrophobicContact CE3-CD2 3.98Å; W73-L94 HydrophobicContact CG-CB 3.93Å; W73-L94 HydrophobicContact CG-CD2 4.47Å; W73-L94 HydrophobicContact CZ2-CB 4.38Å; W73-L94 HydrophobicContact CZ3-CD2 4.47Å; W73-Y108 WeakPolarHBondContact CA-O 3.23Å; W73-Y108 VanDerWaalsContact CE3-O 3.29Å; W73-C109 HydrophobicContact CD2-CB 4.22Å; W73-C109 HydrophobicContact CE3-CB 4.17Å; W73-C109 HydrophobicContact CH2-CB 4.11Å; W73-C109 HydrophobicContact CZ2-CB 4.15Å; W73-C109 HydrophobicContact CZ3-CB 4.11Å; W73-I123 HydrophobicContact CZ3-CG2 4.41Å
74	T	81.3	Confident	63.9	Low	41 Å²	41	76.3 Å²	76.3	25%	0.252	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	161.2	170.3	60.6	0	0	0	0	111.6	R72 Y107 Y108	R72-T74 HydrophobicContact CG-CG2 4.11Å; T74-Y107 CarbonylContact O-C 3.55Å; T74-Y107 WeakPolarHBondContact O-CA 3.37Å; T74-Y108 PolarHBondContact N-O 3.3Å; T74-Y108 PolarHBondContact O-N 3.08Å
75	K	81	Confident	62.5	Low	71 Å²	71	81 Å²	81	31%	0.309	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	139.8	171.5	-177	-173.5	175.2	176.2	0	109.4	T102 Q103 G104 R106 Y107	K75-T102 PolarHBondContact NZ-O 2.94Å; K75-Q103 PolarHBondContact NZ-O 3.31Å; K75-G104 VanDerWaalsContact CE-O 3.23Å; K75-G104 WeakPolarHBondContact CE-O 3.38Å; K75-G104 PolarHBondContact NZ-O 3.4Å; K75-R106 WeakPolarHBondContact CA-O 3.43Å; K75-Y107 HydrophobicContact CB-CD1 3.97Å; K75-Y107 HydrophobicContact CB-CE1 3.87Å; K75-Y107 HydrophobicContact CD-CE1 4.17Å; K75-Y107 HydrophobicContact CD-CE2 4.23Å; K75-Y107 HydrophobicContact CG-CD1 4.39Å; K75-Y107 HydrophobicContact CG-CE1 4.16Å; K75-Y107 HydrophobicContact CG-CE2 4.4Å
76	T	70.1	Confident	61	Low	79 Å²	79	86.3 Å²	86.3	49%	0.485	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	126.4	167.3	-61.2	0	0	0	0	109.9	R106 Y108	T76-R106 PolarHBondContact N-O 2.76Å; T76-R106 VanDerWaalsContact N-O 3.1Å; T76-Y108 VanDerWaalsContact OG1-CE2 3.28Å; T76-Y108 WeakPolarHBondContact OG1-CE2 3.5Å
77	A	56.9	Low	59.5	Low	59 Å²	59	89.8 Å²	89.8	49%	0.488	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-70.6	138.8	174.9	0	0	0	0	0	111.5	D82	A77-D82 HydrophobicContact CB-CB 4.47Å
78	G	46.3	Very low	57.8	Low	60 Å²	60	90.4 Å²	90.4	62%	0.619	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-98.2	141.2	163.4	0	0	0	0	0	109.4
79	S	35.6	Very low	56.9	Low	101 Å²	101	87.1 Å²	87.1	71%	0.706	48%	0.479	S	S	*	.	S	Bend	trans	69.4	151.8	-172.4	-67.3	0	0	0	0	116.4	S81	S79-S81 VanDerWaalsContact C-N 3.32Å; S79-S81 PolarHBondContact O-N 3.47Å
80	V	36.9	Very low	55.9	Low	140 Å²	140	93.9 Å²	93.9	85%	0.848	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-11.1	-168.9	-179.6	0	0	0	0	113
81	S	36	Very low	55	Low	91 Å²	91	91 Å²	91	64%	0.636	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-33.7	-179.9	50.9	0	0	0	0	114.1	S79 R83	S79-S81 VanDerWaalsContact C-N 3.32Å; S79-S81 PolarHBondContact O-N 3.47Å; S81-R83 VanDerWaalsContact C-N 3.26Å; S81-R83 PolarHBondContact O-N 2.95Å
82	D	38.3	Very low	54.4	Low	94 Å²	94	93.1 Å²	93.1	50%	0.503	51%	0.509	S	S	.	.			trans	-87.3	61.8	-164.1	-75.1	26.7	0	0	0	112.1	A77 F84	A77-D82 HydrophobicContact CB-CB 4.47Å; D82-F84 PolarHBondContact O-N 2.94Å
83	R	40.7	Very low	54.1	Low	221 Å²	221	90.9 Å²	90.9	83%	0.834	50%	0.503	S	S	*	.			trans	-77.8	52.4	169.7	-71.3	-169.2	174.3	-165.8	0.2	112.3	S81	S81-R83 VanDerWaalsContact C-N 3.26Å; S81-R83 PolarHBondContact O-N 2.95Å
84	F	36.4	Very low	54.1	Low	192 Å²	192	91.4 Å²	91.4	84%	0.842	51%	0.506	S	S	*	.			trans	-136.9	134.6	176	-100.3	-82.7	0	0	0	114.7	D82	D82-F84 PolarHBondContact O-N 2.94Å
85	Q	41.1	Very low	54.2	Low	161 Å²	161	94.8 Å²	94.8	75%	0.752	52%	0.519	S	S	*	.			trans	56.5	94.9	171.4	-65.6	-175.3	-12.9	0	0	117.6	S87	Q85-S87 PolarHBondContact O-N 2.85Å; Q85-S87 PolarHBondContact O-OG 2.87Å
86	D	39.3	Very low	54.4	Low	118 Å²	118	92.8 Å²	92.8	63%	0.631	51%	0.511	S	S	*	.			trans	-65.9	71.6	150.6	-178.6	12.8	0	0	0	109.3	R72 S88	R72-D86 IonicContact CZ-OD1 2.74Å; R72-D86 IonicContact NH2-OD1 3.25Å; R72-D86 PolarHBondContact NH2-OD1 2.71Å; R72-D86 IonicContact NH2-OD2 3.7Å; R72-D86 PolarHBondContact NH2-OD2 3.26Å; D86-S88 PolarHBondContact O-N 2.8Å
87	S	44.4	Very low	55.1	Low	75 Å²	75	91.9 Å²	91.9	52%	0.524	51%	0.512	S	S	.	.			trans	-75.3	60.5	-176.2	45.5	0	0	0	0	111.5	Q85 V89	Q85-S87 PolarHBondContact O-N 2.85Å; Q85-S87 PolarHBondContact O-OG 2.87Å; S87-V89 PolarHBondContact O-N 2.91Å; S87-V89 VanDerWaalsContact O-N 3.14Å
88	S	49	Very low	56.6	Low	35 Å²	35	96.4 Å²	96.4	25%	0.245	52%	0.52	C	S	.	.			trans	-70	104.6	179.4	48.9	0	0	0	0	112.1	R72 W73 D86	R72-S88 VanDerWaalsContact CZ-CB 3.42Å; W73-S88 WeakPolarHBondContact O-CA 3.37Å; D86-S88 PolarHBondContact O-N 2.8Å
89	V	57.4	Low	58.6	Low	55 Å²	55	93.5 Å²	93.5	33%	0.333	49%	0.491	S	S	.	.	B	Isolated β-bridge	trans	-91.4	117.9	176.7	-175.5	0	0	0	0	109.2	W73 S87 N91 L94	W73-V89 HydrophobicContact CB-CB 4.44Å; W73-V89 PolarHBondContact N-O 2.86Å; S87-V89 PolarHBondContact O-N 2.91Å; S87-V89 VanDerWaalsContact O-N 3.14Å; V89-N91 VanDerWaalsContact C-N 3.25Å; V89-N91 HydrophobicContact CG1-CB 3.75Å; V89-N91 PolarHBondContact O-N 2.89Å; V89-L94 HydrophobicContact CG2-CD1 4.32Å
90	F	57.4	Low	61.3	Low	148 Å²	148	93 Å²	93	65%	0.649	48%	0.477	S	S	*	.			trans	-89.1	52.5	176.4	-65.1	-87.8	0	0	0	111.5	I71 R72	I71-F90 WeakPolarHBondContact O-CA 3.39Å; R72-F90 HydrophobicContact CB-CD1 4.44Å; R72-F90 HydrophobicContact CB-CE1 4.35Å; R72-F90 HydrophobicContact CG-CE1 4.43Å
91	N	63.2	Low	63.8	Low	79 Å²	79	90.4 Å²	90.4	42%	0.422	45%	0.452	S	S	.	.	S	Bend	trans	-132	157.5	179.4	-167.4	47.6	0	0	0	110.1	I71 W73 V89 T93	I71-N91 VanDerWaalsContact CG2-O 3.26Å; I71-N91 WeakPolarHBondContact CG2-O 2.99Å; W73-N91 VanDerWaalsContact CD1-O 3.31Å; V89-N91 VanDerWaalsContact C-N 3.25Å; V89-N91 HydrophobicContact CG1-CB 3.75Å; V89-N91 PolarHBondContact O-N 2.89Å; N91-T93 VanDerWaalsContact C-N 3.3Å; N91-T93 PolarHBondContact ND2-N 3.16Å; N91-T93 PolarHBondContact ND2-O 2.03Å
92	D	68.9	Low	66.3	Low	62 Å²	62	91 Å²	91	33%	0.332	45%	0.452	S	S	.	.	S	Bend	trans	-62.8	-40.1	172.2	54.3	25.4	0	0	0	111.8	C61 I71 W73	C61-D92 WeakPolarHBondContact CB-O 3.01Å; C61-D92 PolarHBondContact N-O 2.85Å; I71-D92 HydrophobicContact CD1-CB 3.86Å; W73-D92 PolarHBondContact NE1-O 3.1Å
93	T	74.8	Confident	68.6	Low	24 Å²	24	89.8 Å²	89.8	15%	0.147	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.2	-173.7	-53.2	0	0	0	0	111.4	E58 L59 T60 N91	E58-T93 HydrophobicContact CG-CG2 3.62Å; L59-T93 CarbonylContact O-C 3.58Å; L59-T93 WeakPolarHBondContact O-CA 3.46Å; T60-T93 WeakPolarHBondContact CG2-OG1 3.38Å; T60-T93 WeakPolarHBondContact OG1-CG2 3.34Å; T60-T93 PolarHBondContact OG1-OG1 2.84Å; N91-T93 VanDerWaalsContact C-N 3.3Å; N91-T93 PolarHBondContact ND2-N 3.16Å; N91-T93 PolarHBondContact ND2-O 2.03Å
94	L	81.8	Confident	70.8	Confident	13 Å²	13	80.1 Å²	80.1	7%	0.068	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	120.6	168.4	172	64.9	0	0	0	108.9	E58 L59 W73 V89 I96 Y107	E58-L94 WeakPolarHBondContact CA-O 3.35Å; L59-L94 HydrophobicContact CB-CB 4.49Å; L59-L94 HydrophobicContact CD1-CD2 4.45Å; L59-L94 PolarHBondContact N-O 3.23Å; L59-L94 PolarHBondContact O-N 2.98Å; W73-L94 HydrophobicContact CD2-CB 3.85Å; W73-L94 HydrophobicContact CD2-CD2 4.16Å; W73-L94 HydrophobicContact CE3-CB 4.44Å; W73-L94 HydrophobicContact CE3-CD2 3.98Å; W73-L94 HydrophobicContact CG-CB 3.93Å; W73-L94 HydrophobicContact CG-CD2 4.47Å; W73-L94 HydrophobicContact CZ2-CB 4.38Å; W73-L94 HydrophobicContact CZ3-CD2 4.47Å; V89-L94 HydrophobicContact CG2-CD1 4.32Å; L94-I96 HydrophobicContact CD1-CD1 4.4Å; L94-I96 HydrophobicContact CD1-CG1 4.23Å; L94-Y107 HydrophobicContact CD2-CD1 3.41Å; L94-Y107 VanDerWaalsContact CD2-CD1 3.41Å; L94-Y107 HydrophobicContact CD2-CE1 3.67Å; L94-Y107 HydrophobicContact CD2-CG 4.15Å
95	H	82.9	Confident	73.2	Confident	112 Å²	112	72.2 Å²	72.2	52%	0.519	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	119.8	-177.4	169.9	-79.6	0	0	0	110.6	T56 L57	T56-H95 WeakPolarHBondContact CG2-NE2 3.27Å; L57-H95 WeakPolarHBondContact O-CA 3.39Å
96	I	85.3	Confident	75.3	Confident	30 Å²	30	68.4 Å²	68.4	15%	0.154	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	106.5	178	-52.5	-178.1	0	0	0	109.1	T56 L57 L94 I99 Y107	T56-I96 WeakPolarHBondContact CA-O 3.48Å; L57-I96 HydrophobicContact CB-CB 4.25Å; L57-I96 HydrophobicContact CD2-CB 4.49Å; L57-I96 HydrophobicContact CD2-CD1 4.08Å; L57-I96 HydrophobicContact CD2-CG1 4.35Å; L57-I96 PolarHBondContact N-O 3.47Å; L57-I96 PolarHBondContact O-N 3.23Å; L94-I96 HydrophobicContact CD1-CD1 4.4Å; L94-I96 HydrophobicContact CD1-CG1 4.23Å; I96-I99 HydrophobicContact CG2-CG1 4.47Å; I96-Y107 HydrophobicContact CD1-CE1 4.25Å; I96-Y107 WeakPolarHBondContact CD1-OH 3.27Å
97	A	85.3	Confident	77.6	Confident	60 Å²	60	63.5 Å²	63.5	50%	0.496	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	141.6	176.1	0	0	0	0	0	111.9	T56	T56-A97 HydrophobicContact CG2-CB 4.45Å
98	K	86.9	Confident	79.5	Confident	153 Å²	153	63 Å²	63	67%	0.665	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	52.7	-179.7	-60	-174.7	178.1	-178.8	0	113.6	G54 E55 Q100	G54-K98 WeakPolarHBondContact O-CA 3.28Å; E55-K98 CarbonylContact O-C 3.53Å; E55-K98 VanDerWaalsContact O-CA 3.27Å; E55-K98 WeakPolarHBondContact O-CA 3.4Å; E55-K98 PolarHBondContact O-N 2.91Å; K98-Q100 PolarHBondContact O-N 2.86Å; K98-Q100 PolarHBondContact O-NE2 2.78Å
99	I	88.8	Confident	81.2	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.312	C	S	.	.			trans	-56	134.1	-175.1	-164.1	168.3	0	0	0	112.5	I51 G54 E55 L57 I96 Q103 V125 V127	I51-I99 HydrophobicContact CD1-CG2 4.15Å; I51-I99 HydrophobicContact CG1-CG2 4.27Å; I51-I99 HydrophobicContact CG2-CD1 4.35Å; I51-I99 HydrophobicContact CG2-CG2 4.06Å; G54-I99 PolarHBondContact N-O 2.9Å; E55-I99 PolarHBondContact O-N 2.79Å; L57-I99 HydrophobicContact CB-CD1 4.08Å; L57-I99 HydrophobicContact CD2-CD1 4Å; I96-I99 HydrophobicContact CG2-CG1 4.47Å; I99-Q103 HydrophobicContact CD1-CB 4.36Å; I99-Q103 HydrophobicContact CG1-CB 3.74Å; I99-V125 HydrophobicContact CD1-CG1 3.85Å; I99-V127 HydrophobicContact CD1-CG2 3.78Å; I99-V127 HydrophobicContact CG1-CG2 3.93Å; I99-V127 HydrophobicContact CG2-CG1 4.47Å; I99-V127 HydrophobicContact CG2-CG2 4.36Å
100	Q	92.3	Very high	82.5	Confident	91 Å²	91	61.7 Å²	61.7	43%	0.425	31%	0.309	S	S	.	.			trans	-98.6	155.1	179.3	-57.2	-60.6	-70.4	0	0	111.2	K98 T102 Q103	K98-Q100 PolarHBondContact O-N 2.86Å; K98-Q100 PolarHBondContact O-NE2 2.78Å; Q100-T102 PolarHBondContact O-N 3.01Å; Q100-T102 VanDerWaalsContact O-N 3.12Å; Q100-Q103 HydrophobicContact CB-CG 4.3Å; Q100-Q103 WeakPolarHBondContact O-CA 3.18Å; Q100-Q103 WeakPolarHBondContact O-CB 3.38Å; Q100-Q103 PolarHBondContact O-N 3.22Å
101	R	89.1	Confident	83.7	Confident	85 Å²	85	54.6 Å²	54.6	32%	0.321	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-54.3	-32.2	178	62.2	-170.8	72.5	179.8	-0.7	114.8	E53 Q103 G104 Y129 D131	E53-R101 WeakPolarHBondContact OE1-CB 3.23Å; E53-R101 VanDerWaalsContact OE1-CG 3.24Å; E53-R101 WeakPolarHBondContact OE1-CG 3.34Å; E53-R101 IonicContact OE1-CZ 3.97Å; E53-R101 PolarHBondContact OE1-N 3.14Å; E53-R101 IonicContact OE1-NE 2.97Å; E53-R101 PolarHBondContact OE1-NE 2.89Å; E53-R101 IonicContact OE1-NH2 2.83Å; E53-R101 IonicContact OE2-CZ 3.14Å; E53-R101 IonicContact OE2-NE 2.91Å; E53-R101 PolarHBondContact OE2-NE 2.82Å; E53-R101 IonicContact OE2-NH2 2.65Å; E53-R101 PolarHBondContact OE2-NH2 2.9Å; R101-Q103 VanDerWaalsContact C-N 3.32Å; R101-Q103 PolarHBondContact O-N 3.14Å; R101-G104 PolarHBondContact O-N 2.94Å; R101-Y129 HydrophobicContact CB-CD1 3.94Å; R101-Y129 HydrophobicContact CB-CE1 3.84Å; R101-Y129 VanDerWaalsContact CZ-CD2 3.42Å; R101-Y129 VanDerWaalsContact NH1-CE2 3.33Å; R101-D131 IonicContact CZ-OD1 2.82Å; R101-D131 IonicContact CZ-OD2 2.67Å; R101-D131 IonicContact NH1-OD1 3.11Å; R101-D131 PolarHBondContact NH1-OD1 2.69Å; R101-D131 IonicContact NH1-OD2 2.79Å; R101-D131 PolarHBondContact NH1-OD2 2.88Å; R101-D131 IonicContact NH2-OD1 3.72Å; R101-D131 PolarHBondContact NH2-OD1 3.45Å; R101-D131 IonicContact NH2-OD2 3.47Å
102	T	88.4	Confident	84.7	Confident	103 Å²	103	54.4 Å²	54.4	63%	0.632	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-73.3	-19.8	174.3	53.4	0	0	0	0	113.9	K75 Q100 G104	K75-T102 PolarHBondContact NZ-O 2.94Å; Q100-T102 PolarHBondContact O-N 3.01Å; Q100-T102 VanDerWaalsContact O-N 3.12Å; T102-G104 VanDerWaalsContact C-N 3.35Å
103	Q	86.9	Confident	85.4	Confident	69 Å²	69	52.8 Å²	52.8	32%	0.322	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-80.4	-16.6	177.6	-68.4	173.4	-34.2	0	0	112.3	K75 I99 Q100 R101 Y107	K75-Q103 PolarHBondContact NZ-O 3.31Å; I99-Q103 HydrophobicContact CD1-CB 4.36Å; I99-Q103 HydrophobicContact CG1-CB 3.74Å; Q100-Q103 HydrophobicContact CB-CG 4.3Å; Q100-Q103 WeakPolarHBondContact O-CA 3.18Å; Q100-Q103 WeakPolarHBondContact O-CB 3.38Å; Q100-Q103 PolarHBondContact O-N 3.22Å; R101-Q103 VanDerWaalsContact C-N 3.32Å; R101-Q103 PolarHBondContact O-N 3.14Å; Q103-Y107 PolarHBondContact O-OH 2.98Å
104	G	86.3	Confident	85.6	Confident	18 Å²	18	55.4 Å²	55.4	19%	0.186	30%	0.298	C	S	.	.			trans	-57	159.4	167.4	0	0	0	0	0	113.8	K75 R101 T102 V125	K75-G104 VanDerWaalsContact CE-O 3.23Å; K75-G104 WeakPolarHBondContact CE-O 3.38Å; K75-G104 PolarHBondContact NZ-O 3.4Å; R101-G104 PolarHBondContact O-N 2.94Å; T102-G104 VanDerWaalsContact C-N 3.35Å; G104-V125 CarbonylContact C-O 3.58Å; G104-V125 VanDerWaalsContact CA-O 3.26Å; G104-V125 WeakPolarHBondContact CA-O 3.48Å
105	G	87.1	Confident	85.2	Confident	25 Å²	25	57.3 Å²	57.3	26%	0.258	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	133.5	-166.8	-177.4	0	0	0	0	0	113.6	V125	G105-V125 PolarHBondContact N-O 3.11Å; G105-V125 PolarHBondContact O-N 2.89Å
106	R	86.4	Confident	85	Confident	82 Å²	82	55.5 Å²	55.5	31%	0.309	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	119.6	-173.3	-169.9	-175.6	-67	-99.8	-5.7	111.8	E46 K75 T76 Y108	E46-R106 VanDerWaalsContact CD-CZ 3.47Å; E46-R106 IonicContact OE1-CZ 2.74Å; E46-R106 IonicContact OE1-NH1 3.33Å; E46-R106 PolarHBondContact OE1-NH1 2.83Å; E46-R106 IonicContact OE1-NH2 2.7Å; E46-R106 PolarHBondContact OE1-NH2 2.91Å; E46-R106 IonicContact OE2-CZ 3.94Å; E46-R106 IonicContact OE2-NH1 3.42Å; E46-R106 PolarHBondContact OE2-NH1 3.48Å; E46-R106 IonicContact OE2-NH2 2.75Å; E46-R106 PolarHBondContact OE2-NH2 2.81Å; K75-R106 WeakPolarHBondContact CA-O 3.43Å; T76-R106 PolarHBondContact N-O 2.76Å; T76-R106 VanDerWaalsContact N-O 3.1Å; R106-Y108 HydrophobicContact CB-CE2 4.34Å; R106-Y108 VanDerWaalsContact CD-CZ 3.41Å; R106-Y108 WeakPolarHBondContact CD-OH 3.35Å; R106-Y108 HydrophobicContact CG-CD2 4.35Å; R106-Y108 HydrophobicContact CG-CE2 3.69Å
107	Y	86.6	Confident	84.7	Confident	15 Å²	15	58.8 Å²	58.8	6%	0.059	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	148.7	174.3	-72.1	-93.2	0	0	0	110.6	T74 K75 L94 I96 Q103 S122 I123 V125	T74-Y107 CarbonylContact O-C 3.55Å; T74-Y107 WeakPolarHBondContact O-CA 3.37Å; K75-Y107 HydrophobicContact CB-CD1 3.97Å; K75-Y107 HydrophobicContact CB-CE1 3.87Å; K75-Y107 HydrophobicContact CD-CE1 4.17Å; K75-Y107 HydrophobicContact CD-CE2 4.23Å; K75-Y107 HydrophobicContact CG-CD1 4.39Å; K75-Y107 HydrophobicContact CG-CE1 4.16Å; K75-Y107 HydrophobicContact CG-CE2 4.4Å; L94-Y107 HydrophobicContact CD2-CD1 3.41Å; L94-Y107 VanDerWaalsContact CD2-CD1 3.41Å; L94-Y107 HydrophobicContact CD2-CE1 3.67Å; L94-Y107 HydrophobicContact CD2-CG 4.15Å; I96-Y107 HydrophobicContact CD1-CE1 4.25Å; I96-Y107 WeakPolarHBondContact CD1-OH 3.27Å; Q103-Y107 PolarHBondContact O-OH 2.98Å; Y107-S122 CarbonylContact O-C 3.42Å; Y107-S122 WeakPolarHBondContact O-CA 3.3Å; Y107-S122 WeakPolarHBondContact O-CB 3.42Å; Y107-I123 PolarHBondContact N-O 2.13Å; Y107-I123 PolarHBondContact O-N 2.86Å; Y107-V125 HydrophobicContact CD2-CB 4.06Å; Y107-V125 HydrophobicContact CD2-CG2 3.6Å; Y107-V125 HydrophobicContact CE2-CB 4.02Å; Y107-V125 HydrophobicContact CE2-CG2 3.91Å
108	Y	85.1	Confident	84.7	Confident	65 Å²	65	58.4 Å²	58.4	26%	0.255	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	132.9	179.3	-62.7	-105.9	0	0	0	109.8	W73 T74 T76 R106 I120 K121	W73-Y108 WeakPolarHBondContact CA-O 3.23Å; W73-Y108 VanDerWaalsContact CE3-O 3.29Å; T74-Y108 PolarHBondContact N-O 3.3Å; T74-Y108 PolarHBondContact O-N 3.08Å; T76-Y108 VanDerWaalsContact OG1-CE2 3.28Å; T76-Y108 WeakPolarHBondContact OG1-CE2 3.5Å; R106-Y108 HydrophobicContact CB-CE2 4.34Å; R106-Y108 VanDerWaalsContact CD-CZ 3.41Å; R106-Y108 WeakPolarHBondContact CD-OH 3.35Å; R106-Y108 HydrophobicContact CG-CD2 4.35Å; R106-Y108 HydrophobicContact CG-CE2 3.69Å; Y108-I120 HydrophobicContact CD1-CG2 3.81Å; Y108-K121 WeakPolarHBondContact CA-O 3.47Å
109	C	83.8	Confident	84.4	Confident	0 Å²	0	52 Å²	52	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	123.8	156.8	178.1	0	0	0	0	108.6	V28 I30 C61 W73 I120 K121	V28-C109 HydrophobicContact CG1-CB 4.26Å; I30-C109 HydrophobicContact CD1-CB 4.12Å; I30-C109 HydrophobicContact CG1-CB 4.14Å; C61-C109 HydrophobicContact CB-CB 3.72Å; C61-C109 WeakPolarHBondContact CB-SG 3.37Å; C61-C109 WeakPolarHBondContact SG-CB 3.36Å; C61-C109 CovalentContact SG-SG 2.02Å; C61-C109 PolarHBondContact SG-SG 2.91Å; W73-C109 HydrophobicContact CD2-CB 4.22Å; W73-C109 HydrophobicContact CE3-CB 4.17Å; W73-C109 HydrophobicContact CH2-CB 4.11Å; W73-C109 HydrophobicContact CZ2-CB 4.15Å; W73-C109 HydrophobicContact CZ3-CB 4.11Å; C109-I120 WeakPolarHBondContact O-CA 3.29Å; C109-K121 PolarHBondContact N-O 2.83Å; C109-K121 PolarHBondContact O-N 2.96Å
110	K	85.4	Confident	84.2	Confident	61 Å²	61	56.4 Å²	56.4	27%	0.265	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	133.9	167.2	-178.5	-168.6	178.1	-150.1	0	108.7	I71 R72 E112 P118 A119 I120	I71-K110 WeakPolarHBondContact CA-O 3.13Å; R72-K110 PolarHBondContact N-O 2.95Å; R72-K110 PolarHBondContact O-N 3.32Å; K110-E112 WeakPolarHBondContact CE-OE1 3.37Å; K110-E112 VanDerWaalsContact CE-OE2 3.23Å; K110-E112 WeakPolarHBondContact CE-OE2 3.45Å; K110-E112 IonicContact NZ-OE1 3.22Å; K110-E112 PolarHBondContact NZ-OE1 3.1Å; K110-E112 IonicContact NZ-OE2 3.81Å; K110-E112 PolarHBondContact NZ-OE2 3.26Å; K110-P118 HydrophobicContact CD-CB 4.41Å; K110-P118 VanDerWaalsContact CE-CB 3.48Å; K110-P118 HydrophobicContact CG-CB 4.03Å; K110-A119 CarbonylContact C-O 3.58Å; K110-A119 WeakPolarHBondContact CA-O 3.49Å; K110-I120 HydrophobicContact CB-CG1 4.32Å; K110-I120 HydrophobicContact CG-CG1 4.08Å
111	A	82.6	Confident	83.7	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	133.6	173.1	0	0	0	0	0	111.6	P26 V28 V63 P69 Q70 P118 A119	P26-A111 HydrophobicContact CB-CB 4.29Å; P26-A111 WeakPolarHBondContact CG-O 3.21Å; V28-A111 HydrophobicContact CG2-CB 3.4Å; V63-A111 HydrophobicContact CG1-CB 3.67Å; P69-A111 HydrophobicContact CB-CB 3.89Å; Q70-A111 VanDerWaalsContact O-CA 3.29Å; Q70-A111 WeakPolarHBondContact O-CA 3.37Å; A111-P118 CarbonylContact O-C 3.54Å; A111-P118 WeakPolarHBondContact O-CA 3.49Å; A111-A119 PolarHBondContact N-O 3.22Å; A111-A119 PolarHBondContact O-N 2.89Å
112	E	85.1	Confident	83.5	Confident	75 Å²	75	55.3 Å²	55.3	35%	0.35	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	141.8	179.8	64.5	-159.4	141.8	0	0	113.6	P69 Q70 K110 P118	P69-E112 WeakPolarHBondContact CA-O 3.33Å; Q70-E112 PolarHBondContact N-O 3.07Å; Q70-E112 PolarHBondContact O-N 2.79Å; K110-E112 WeakPolarHBondContact CE-OE1 3.37Å; K110-E112 VanDerWaalsContact CE-OE2 3.23Å; K110-E112 WeakPolarHBondContact CE-OE2 3.45Å; K110-E112 IonicContact NZ-OE1 3.22Å; K110-E112 PolarHBondContact NZ-OE1 3.1Å; K110-E112 IonicContact NZ-OE2 3.81Å; K110-E112 PolarHBondContact NZ-OE2 3.26Å; E112-P118 HydrophobicContact CB-CB 4.1Å; E112-P118 HydrophobicContact CB-CG 4.13Å
113	N	82.2	Confident	83.2	Confident	28 Å²	28	50.6 Å²	50.6	15%	0.15	31%	0.307	C	S	.	.			trans	-132.3	14.9	176.4	67.3	-0.5	0	0	0	113.2	A24 P26 P67 P69 L115	A24-N113 PolarHBondContact O-ND2 2.89Å; P26-N113 WeakPolarHBondContact CD-OD1 3.4Å; P67-N113 WeakPolarHBondContact O-CB 3.45Å; P67-N113 PolarHBondContact O-ND2 3.02Å; P69-N113 HydrophobicContact CB-CB 4.43Å; P69-N113 HydrophobicContact CG-CB 4.32Å; N113-L115 VanDerWaalsContact C-N 3.3Å; N113-L115 PolarHBondContact O-N 3.15Å; N113-L115 WeakPolarHBondContact OD1-CB 3.49Å; N113-L115 PolarHBondContact OD1-N 2.75Å
114	G	78.6	Confident	83.2	Confident	79 Å²	79	50.1 Å²	50.1	81%	0.814	30%	0.302	S	S	*	.	S	Bend	trans	78	4.7	-176.5	0	0	0	0	0	115.4
115	L	74.8	Confident	83.2	Confident	52 Å²	52	49.3 Å²	49.3	27%	0.272	29%	0.293	S	S	.	.	S	Bend	trans	-114.7	123	177.7	-57.2	171.4	0	0	0	111.2	T23 P26 H66 N113	T23-L115 HydrophobicContact CG2-CD1 4.24Å; P26-L115 WeakPolarHBondContact CD-O 3.24Å; H66-L115 WeakPolarHBondContact O-CD1 3.02Å; N113-L115 VanDerWaalsContact C-N 3.3Å; N113-L115 PolarHBondContact O-N 3.15Å; N113-L115 WeakPolarHBondContact OD1-CB 3.49Å; N113-L115 PolarHBondContact OD1-N 2.75Å
116	G	78.9	Confident	83.3	Confident	75 Å²	75	49.5 Å²	49.5	77%	0.773	29%	0.288	S	S	*	.	S	Bend	trans	68.1	-157.6	-177.7	0	0	0	0	0	113.1
117	S	78.5	Confident	83.5	Confident	99 Å²	99	45.9 Å²	45.9	69%	0.692	28%	0.275	S	S	*	.	S	Bend	trans	-81.4	146.1	170.5	43.7	0	0	0	0	111.1	A119	S117-A119 PolarHBondContact O-N 2.86Å
118	P	84.6	Confident	83.8	Confident	52 Å²	52	47 Å²	47	34%	0.338	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-55.2	135.4	171.2	-27.2	36.2	0	0	0	112	K110 A111 E112	K110-P118 HydrophobicContact CD-CB 4.41Å; K110-P118 VanDerWaalsContact CE-CB 3.48Å; K110-P118 HydrophobicContact CG-CB 4.03Å; A111-P118 CarbonylContact O-C 3.54Å; A111-P118 WeakPolarHBondContact O-CA 3.49Å; E112-P118 HydrophobicContact CB-CB 4.1Å; E112-P118 HydrophobicContact CB-CG 4.13Å
119	A	80.6	Confident	84.2	Confident	17 Å²	17	46.3 Å²	46.3	14%	0.14	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	132.1	173.7	0	0	0	0	0	109.4	P26 V28 K110 A111 S117	P26-A119 HydrophobicContact CB-CB 3.94Å; P26-A119 HydrophobicContact CG-CB 3.91Å; P26-A119 WeakPolarHBondContact O-CB 3.45Å; V28-A119 HydrophobicContact CB-CB 4.29Å; V28-A119 HydrophobicContact CG2-CB 3.65Å; K110-A119 CarbonylContact C-O 3.58Å; K110-A119 WeakPolarHBondContact CA-O 3.49Å; A111-A119 PolarHBondContact N-O 3.22Å; A111-A119 PolarHBondContact O-N 2.89Å; S117-A119 PolarHBondContact O-N 2.86Å
120	I	84.3	Confident	84.7	Confident	94 Å²	94	46.9 Å²	46.9	48%	0.482	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	133.1	-177.6	-59.2	175.7	0	0	0	109.1	Y108 C109 K110	Y108-I120 HydrophobicContact CD1-CG2 3.81Å; C109-I120 WeakPolarHBondContact O-CA 3.29Å; K110-I120 HydrophobicContact CB-CG1 4.32Å; K110-I120 HydrophobicContact CG-CG1 4.08Å
121	K	82.1	Confident	85.1	Confident	120 Å²	120	46.4 Å²	46.4	52%	0.522	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	145.5	164.8	-69.3	-65.5	-175.8	177	0	109.7	V28 I30 Y108 C109	V28-K121 HydrophobicContact CB-CG 4.04Å; V28-K121 HydrophobicContact CG1-CB 3.76Å; V28-K121 HydrophobicContact CG1-CG 3.67Å; I30-K121 HydrophobicContact CD1-CB 3.92Å; I30-K121 HydrophobicContact CG1-CB 4.23Å; Y108-K121 WeakPolarHBondContact CA-O 3.47Å; C109-K121 PolarHBondContact N-O 2.83Å; C109-K121 PolarHBondContact O-N 2.96Å
122	S	85.9	Confident	85.6	Confident	32 Å²	32	51.7 Å²	51.7	22%	0.224	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	151.2	175.1	60.8	0	0	0	0	112.1	Y107	Y107-S122 CarbonylContact O-C 3.42Å; Y107-S122 WeakPolarHBondContact O-CA 3.3Å; Y107-S122 WeakPolarHBondContact O-CB 3.42Å
123	I	81.8	Confident	86	Confident	5 Å²	5	48.5 Å²	48.5	3%	0.026	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	140.6	170.3	-166.9	171.3	0	0	0	108.7	I30 R47 L59 W73 Y107	I30-I123 HydrophobicContact CD1-CB 4.29Å; I30-I123 HydrophobicContact CD1-CG2 4.15Å; I30-I123 HydrophobicContact CG2-CD1 4.04Å; I30-I123 HydrophobicContact CG2-CG2 4.32Å; R47-I123 HydrophobicContact CB-CD1 4.5Å; R47-I123 HydrophobicContact CB-CG1 4.14Å; R47-I123 WeakPolarHBondContact O-CG1 3.46Å; L59-I123 HydrophobicContact CD1-CG2 3.74Å; L59-I123 HydrophobicContact CD2-CD1 3.98Å; W73-I123 HydrophobicContact CZ3-CG2 4.41Å; Y107-I123 PolarHBondContact N-O 2.13Å; Y107-I123 PolarHBondContact O-N 2.86Å
124	R	85.8	Confident	86.6	Confident	58 Å²	58	50.6 Å²	50.6	22%	0.219	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	117.3	-179	178.1	164	68.9	86.9	-10.6	109.7	E42 E46 R47 V48 Y49 D126	E42-R124 VanDerWaalsContact CD-NH2 3.27Å; E42-R124 IonicContact OE1-NH2 3.37Å; E42-R124 PolarHBondContact OE1-NH2 2.86Å; E42-R124 IonicContact OE2-CZ 3.8Å; E42-R124 IonicContact OE2-NE 3.75Å; E42-R124 IonicContact OE2-NH2 3.86Å; E42-R124 PolarHBondContact OE2-NH2 3.4Å; E46-R124 HydrophobicContact CG-CB 4.5Å; E46-R124 VanDerWaalsContact OE1-CB 3.31Å; E46-R124 WeakPolarHBondContact OE1-CB 3.43Å; E46-R124 WeakPolarHBondContact OE1-CD 3.45Å; E46-R124 IonicContact OE1-NE 3.12Å; E46-R124 PolarHBondContact OE1-NE 3.17Å; R47-R124 PolarHBondContact O-N 3.47Å; V48-R124 CarbonylContact C-O 3.56Å; V48-R124 WeakPolarHBondContact CA-O 3.24Å; Y49-R124 PolarHBondContact N-O 3.15Å; R124-D126 WeakPolarHBondContact CG-OD1 3.35Å; R124-D126 IonicContact CZ-OD1 3.05Å; R124-D126 IonicContact CZ-OD2 3.82Å; R124-D126 IonicContact NH1-OD1 2.81Å; R124-D126 PolarHBondContact NH1-OD1 2.66Å; R124-D126 IonicContact NH1-OD2 2.75Å; R124-D126 PolarHBondContact NH1-OD2 2.97Å
125	V	88	Confident	87.3	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.006	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	109.8	179.1	178	0	0	0	0	109.1	Y49 I51 L57 L59 I99 G104 G105 Y107 V127	Y49-V125 HydrophobicContact CD1-CG1 4.5Å; Y49-V125 WeakPolarHBondContact O-CA 3.25Å; I51-V125 HydrophobicContact CG2-CG1 3.98Å; L57-V125 HydrophobicContact CD1-CG1 4.14Å; L57-V125 HydrophobicContact CD1-CG2 3.98Å; L57-V125 HydrophobicContact CD2-CG1 4.23Å; L57-V125 HydrophobicContact CD2-CG2 4.01Å; L59-V125 HydrophobicContact CD1-CG2 3.99Å; I99-V125 HydrophobicContact CD1-CG1 3.85Å; G104-V125 CarbonylContact C-O 3.58Å; G104-V125 VanDerWaalsContact CA-O 3.26Å; G104-V125 WeakPolarHBondContact CA-O 3.48Å; G105-V125 PolarHBondContact N-O 3.11Å; G105-V125 PolarHBondContact O-N 2.89Å; Y107-V125 HydrophobicContact CD2-CB 4.06Å; Y107-V125 HydrophobicContact CD2-CG2 3.6Å; Y107-V125 HydrophobicContact CE2-CB 4.02Å; Y107-V125 HydrophobicContact CE2-CG2 3.91Å; V125-V127 HydrophobicContact CG1-CG2 4.36Å
126	D	88.3	Confident	88.2	Confident	30 Å²	30	46.3 Å²	46.3	16%	0.16	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	113.3	176.7	-81.2	12	0	0	0	109.3	V48 Y49 T50 I51 R124 Y128	V48-D126 HydrophobicContact CG1-CB 4.27Å; Y49-D126 PolarHBondContact O-N 3.3Å; T50-D126 WeakPolarHBondContact CA-O 3.3Å; I51-D126 PolarHBondContact N-O 3.18Å; R124-D126 WeakPolarHBondContact CG-OD1 3.35Å; R124-D126 IonicContact CZ-OD1 3.05Å; R124-D126 IonicContact CZ-OD2 3.82Å; R124-D126 IonicContact NH1-OD1 2.81Å; R124-D126 PolarHBondContact NH1-OD1 2.66Å; R124-D126 IonicContact NH1-OD2 2.75Å; R124-D126 PolarHBondContact NH1-OD2 2.97Å; D126-Y128 HydrophobicContact CB-CD1 4.42Å; D126-Y128 HydrophobicContact CB-CE1 4.09Å
127	V	91.6	Very high	89	Confident	5 Å²	5	42.8 Å²	42.8	3%	0.03	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	118.2	177.1	-177.5	0	0	0	0	109.1	I51 E53 I99 V125 N163	I51-V127 HydrophobicContact CG2-CG2 4.29Å; I51-V127 CarbonylContact O-C 3.58Å; I51-V127 WeakPolarHBondContact O-CA 3.4Å; E53-V127 HydrophobicContact CB-CG1 3.82Å; E53-V127 HydrophobicContact CG-CG1 4.4Å; I99-V127 HydrophobicContact CD1-CG2 3.78Å; I99-V127 HydrophobicContact CG1-CG2 3.93Å; I99-V127 HydrophobicContact CG2-CG1 4.47Å; I99-V127 HydrophobicContact CG2-CG2 4.36Å; V125-V127 HydrophobicContact CG1-CG2 4.36Å; V127-N163 PolarHBondContact O-ND2 2.91Å
128	Y	92.4	Very high	89.6	Confident	38 Å²	38	41.4 Å²	41.4	15%	0.149	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	138	-178.3	-79.1	6.7	0	0	0	112	T50 I51 E53 D126 N163 P164 V222 C223	T50-Y128 HydrophobicContact CG2-CD1 3.96Å; T50-Y128 HydrophobicContact CG2-CD2 3.27Å; T50-Y128 HydrophobicContact CG2-CE1 3.91Å; T50-Y128 HydrophobicContact CG2-CE2 3.19Å; T50-Y128 HydrophobicContact CG2-CG 3.68Å; I51-Y128 PolarHBondContact O-N 2.95Å; E53-Y128 PolarHBondContact N-O 2.81Å; D126-Y128 HydrophobicContact CB-CD1 4.42Å; D126-Y128 HydrophobicContact CB-CE1 4.09Å; Y128-N163 CarbonylContact C-O 3.58Å; Y128-N163 WeakPolarHBondContact CA-O 3.34Å; Y128-N163 VanDerWaalsContact CB-O 3.23Å; Y128-N163 WeakPolarHBondContact CB-O 3.06Å; Y128-N163 HydrophobicContact CD1-CB 4.17Å; Y128-N163 WeakPolarHBondContact CD1-ND2 3.44Å; Y128-P164 HydrophobicContact CD2-CG 4.42Å; Y128-P164 HydrophobicContact CE1-CB 4.43Å; Y128-P164 HydrophobicContact CE2-CB 4.38Å; Y128-P164 HydrophobicContact CE2-CG 4.07Å; Y128-V222 HydrophobicContact CD2-CG1 3.86Å; Y128-V222 HydrophobicContact CE2-CG1 3.59Å; Y128-C223 HydrophobicContact CD2-CB 3.99Å
129	Y	93.3	Very high	89.8	Confident	51 Å²	51	42.6 Å²	42.6	20%	0.2	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	160.7	-176	63.1	-86.4	0	0	0	110.9	R101 N161 S162 N163	R101-Y129 HydrophobicContact CB-CD1 3.94Å; R101-Y129 HydrophobicContact CB-CE1 3.84Å; R101-Y129 VanDerWaalsContact CZ-CD2 3.42Å; R101-Y129 VanDerWaalsContact NH1-CE2 3.33Å; Y129-N161 HydrophobicContact CE2-CB 4.28Å; Y129-S162 WeakPolarHBondContact O-CA 3.26Å; Y129-S162 VanDerWaalsContact O-CB 3.26Å; Y129-S162 WeakPolarHBondContact O-CB 3.43Å; Y129-N163 HydrophobicContact CD1-CB 3.93Å; Y129-N163 HydrophobicContact CE1-CB 3.6Å; Y129-N163 PolarHBondContact N-O 2.88Å; Y129-N163 PolarHBondContact O-N 2.95Å; Y129-N163 VanDerWaalsContact O-O 3.13Å
130	L	93.6	Very high	89.9	Confident	13 Å²	13	44.1 Å²	44.1	7%	0.068	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	111.7	170.9	173.7	60.3	0	0	0	108.8	A160 V166 A217 V219 I225 R228	L130-A160 HydrophobicContact CD1-CB 4.34Å; L130-V166 HydrophobicContact CD1-CB 4.48Å; L130-V166 HydrophobicContact CD1-CG2 4.27Å; L130-A217 HydrophobicContact CD1-CB 4.23Å; L130-V219 HydrophobicContact CB-CG1 4.36Å; L130-V219 HydrophobicContact CD1-CG1 4.42Å; L130-V219 HydrophobicContact CD2-CG1 4.39Å; L130-V219 HydrophobicContact CD2-CG2 4.37Å; L130-I225 HydrophobicContact CB-CG2 3.61Å; L130-I225 HydrophobicContact CD2-CG2 4.35Å; L130-R228 HydrophobicContact CD2-CB 4.29Å; L130-R228 HydrophobicContact CD2-CG 3.89Å; L130-R228 HydrophobicContact CG-CG 3.94Å
131	D	93.7	Very high	89.7	Confident	51 Å²	51	44.8 Å²	44.8	27%	0.273	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-75.3	161.9	176.5	-66.6	-23.2	0	0	0	111.2	R101 N161	R101-D131 IonicContact CZ-OD1 2.82Å; R101-D131 IonicContact CZ-OD2 2.67Å; R101-D131 IonicContact NH1-OD1 3.11Å; R101-D131 PolarHBondContact NH1-OD1 2.69Å; R101-D131 IonicContact NH1-OD2 2.79Å; R101-D131 PolarHBondContact NH1-OD2 2.88Å; R101-D131 IonicContact NH2-OD1 3.72Å; R101-D131 PolarHBondContact NH2-OD1 3.45Å; R101-D131 IonicContact NH2-OD2 3.47Å; D131-N161 PolarHBondContact N-O 3.48Å
132	N	93.5	Very high	88.9	Confident	110 Å²	110	40.7 Å²	40.7	59%	0.588	22%	0.22	S	C	*	.	P	Polyproline II helix	trans	-68.4	130.8	178.9	-67.5	-45.2	0	0	0	110.5	R228	N132-R228 WeakPolarHBondContact OD1-CD 3.35Å
133	P	94.7	Very high	87.5	Confident	8 Å²	8	46.9 Å²	46.9	5%	0.052	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-68.6	145.5	179.8	25.8	-32.8	0	0	0	112.4	V159 A160 A217 R228 V230	P133-V159 CarbonylContact C-O 3.51Å; P133-V159 WeakPolarHBondContact CA-O 3.48Å; P133-A160 HydrophobicContact CB-CB 4.07Å; P133-A217 HydrophobicContact CB-CB 4.07Å; P133-A217 HydrophobicContact CG-CB 4.03Å; P133-R228 VanDerWaalsContact CD-CB 3.41Å; P133-R228 HydrophobicContact CG-CB 4.2Å; P133-V230 HydrophobicContact CB-CG1 3.8Å; P133-V230 HydrophobicContact CG-CB 4.12Å; P133-V230 HydrophobicContact CG-CG1 3.75Å; P133-V230 WeakPolarHBondContact O-CB 3.28Å; P133-V230 WeakPolarHBondContact O-CG1 3.43Å
134	V	92.9	Very high	86.3	Confident	72 Å²	72	47.8 Å²	47.8	44%	0.436	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	131.7	172.7	-178.1	0	0	0	0	108.8	C158 V159	V134-C158 WeakPolarHBondContact O-CA 3.33Å; V134-V159 PolarHBondContact N-O 2.83Å; V134-V159 PolarHBondContact O-N 2.89Å
135	I	94.7	Very high	84.8	Confident	6 Å²	6	55 Å²	55	3%	0.031	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	129.6	167.2	-68.6	165.9	0	0	0	109	V137 L156 R157 C158 W170 C215 V230 F232 N314	I135-V137 HydrophobicContact CG2-CG2 3.79Å; I135-L156 HydrophobicContact CG2-CB 4.38Å; I135-R157 CarbonylContact C-O 3.58Å; I135-R157 VanDerWaalsContact CA-O 3.29Å; I135-R157 WeakPolarHBondContact CA-O 3.18Å; I135-C158 HydrophobicContact CG1-CB 4.38Å; I135-W170 HydrophobicContact CD1-CH2 4.11Å; I135-W170 HydrophobicContact CD1-CZ3 3.81Å; I135-W170 HydrophobicContact CG1-CH2 3.94Å; I135-W170 HydrophobicContact CG1-CZ3 4.17Å; I135-W170 HydrophobicContact CG2-CH2 4.44Å; I135-C215 HydrophobicContact CD1-CB 3.83Å; I135-C215 HydrophobicContact CG1-CB 3.97Å; I135-V230 HydrophobicContact CD1-CG1 3.78Å; I135-V230 HydrophobicContact CG1-CG1 3.7Å; I135-F232 HydrophobicContact CB-CB 4.28Å; I135-F232 HydrophobicContact CD1-CB 3.92Å; I135-F232 HydrophobicContact CG2-CB 3.89Å; I135-F232 HydrophobicContact CG2-CD2 4.27Å; I135-F232 HydrophobicContact CG2-CG 4.16Å; I135-N314 WeakPolarHBondContact O-CB 3.13Å
136	T	93.8	Very high	83.4	Confident	36 Å²	36	64 Å²	64	22%	0.221	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	151.5	159.6	72.6	0	0	0	0	110.5	L156 R157 N314	T136-L156 CarbonylContact O-C 3.58Å; T136-L156 WeakPolarHBondContact O-CA 3.42Å; T136-R157 PolarHBondContact N-O 2.92Å; T136-R157 PolarHBondContact O-N 3.04Å; T136-N314 CarbonylContact C-O 3.58Å; T136-N314 WeakPolarHBondContact CA-O 3.36Å; T136-N314 WeakPolarHBondContact CB-O 3.49Å; T136-N314 HydrophobicContact CG2-CB 4.22Å
137	V	94.1	Very high	81.8	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	113.5	-173.3	-176.9	0	0	0	0	111	I135 V154 F155 L156 F232 L234 N314 V315 G316	I135-V137 HydrophobicContact CG2-CG2 3.79Å; V137-V154 HydrophobicContact CG1-CG1 3.54Å; V137-F155 CarbonylContact C-O 3.59Å; V137-F155 WeakPolarHBondContact CA-O 3.08Å; V137-L156 HydrophobicContact CG1-CG 4.41Å; V137-L156 HydrophobicContact CG2-CD2 4.24Å; V137-L156 HydrophobicContact CG2-CG 4.04Å; V137-F232 HydrophobicContact CB-CE1 4.4Å; V137-F232 HydrophobicContact CB-CZ 4.24Å; V137-F232 HydrophobicContact CG2-CD1 3.76Å; V137-F232 HydrophobicContact CG2-CD2 3.91Å; V137-F232 HydrophobicContact CG2-CE1 3.69Å; V137-F232 HydrophobicContact CG2-CE2 3.82Å; V137-F232 HydrophobicContact CG2-CG 3.89Å; V137-F232 HydrophobicContact CG2-CZ 3.72Å; V137-L234 HydrophobicContact CG1-CD1 4.47Å; V137-N314 PolarHBondContact N-O 2.87Å; V137-V315 CarbonylContact O-C 3.29Å; V137-V315 WeakPolarHBondContact O-CA 3.46Å; V137-V315 WeakPolarHBondContact O-CG1 3.34Å; V137-G316 PolarHBondContact O-N 2.65Å
138	H	91.3	Very high	80.1	Confident	70 Å²	70	78.7 Å²	78.7	32%	0.324	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	147.2	173.4	-63.5	-96.3	0	0	0	110.5	V154 F155 G316	H138-V154 WeakPolarHBondContact O-CA 3.47Å; H138-F155 PolarHBondContact N-O 2.96Å; H138-F155 PolarHBondContact O-N 2.9Å; H138-G316 PolarHBondContact CE1-O 2.93Å; H138-G316 VanDerWaalsContact CE1-O 3.26Å
139	Q	88.8	Confident	78.5	Confident	77 Å²	77	82.2 Å²	82.2	36%	0.36	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	139.3	177.5	-54.4	-175.6	26.7	0	0	109.2	T153 V154 T238	Q139-T153 WeakPolarHBondContact CA-O 3.11Å; Q139-V154 HydrophobicContact CG-CG1 4.44Å; Q139-V154 HydrophobicContact CG-CG2 4.21Å; Q139-T238 PolarHBondContact NE2-O 2.69Å
140	S	84	Confident	77	Confident	50 Å²	50	87 Å²	87	35%	0.35	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	136.9	172.3	64	0	0	0	0	109.9	T153	S140-T153 PolarHBondContact N-O 2.88Å; S140-T153 PolarHBondContact O-N 2.85Å
141	I	79.1	Confident	76.2	Confident	108 Å²	108	89.9 Å²	89.9	55%	0.554	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	118.1	174.6	-53.3	-176.1	0	0	0	107.1	Y150 R152	I141-Y150 HydrophobicContact CG2-CD1 3.99Å; I141-Y150 HydrophobicContact CG2-CG 4.06Å; I141-R152 HydrophobicContact CG1-CG 4.42Å
142	G	65.1	Low	75.7	Confident	33 Å²	33	93 Å²	93	34%	0.34	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	145.6	175	0	0	0	0	0	111.6	Y150 E151	G142-Y150 CarbonylContact O-C 3.56Å; G142-Y150 WeakPolarHBondContact O-CA 3.24Å; G142-E151 PolarHBondContact N-O 2.83Å; G142-E151 PolarHBondContact O-N 2.94Å
143	E	58.1	Low	75.5	Confident	162 Å²	162	88.7 Å²	88.7	76%	0.757	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.3	122.9	169.4	-62.6	-176.3	151.7	0	0	109.3	Y150	E143-Y150 HydrophobicContact CG-CD1 4.22Å; E143-Y150 HydrophobicContact CG-CE1 4.05Å
144	A	55.8	Low	75.4	Confident	24 Å²	24	88.3 Å²	88.3	20%	0.198	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-72.9	128.7	175.8	0	0	0	0	0	109.7	E146 Y149 E151	A144-E146 PolarHBondContact O-N 2.79Å; A144-Y149 HydrophobicContact CB-CD2 3.8Å; A144-Y149 HydrophobicContact CB-CE2 3.56Å; A144-Y149 WeakPolarHBondContact CB-O 3.49Å; A144-Y149 PolarHBondContact N-O 3.42Å; A144-E151 HydrophobicContact CB-CG 4.41Å
145	K	54.1	Low	75.4	Confident	211 Å²	211	87.3 Å²	87.3	92%	0.917	41%	0.411	S	S	*	.	S	Bend	trans	-66.5	-13.2	-166.6	-85.3	-169	170.5	-172.9	0	116.7
146	E	57.6	Low	75.4	Confident	188 Å²	188	87 Å²	87	88%	0.879	41%	0.41	S	S	*	.	S	Bend	trans	-136.3	-4.2	-173.5	-62.8	-172.2	154.3	0	0	115.1	A144	A144-E146 PolarHBondContact O-N 2.79Å
147	Q	55.2	Low	75.4	Confident	118 Å²	118	89.7 Å²	89.7	55%	0.551	42%	0.416	S	S	*	.	S	Bend	trans	-144	145.2	-175	-67.8	-179.1	-23.9	0	0	111.5	Y149	Q147-Y149 HydrophobicContact CB-CD1 3.92Å; Q147-Y149 HydrophobicContact CB-CE1 3.43Å; Q147-Y149 VanDerWaalsContact CB-CE1 3.43Å; Q147-Y149 HydrophobicContact CG-CE1 4.29Å; Q147-Y149 PolarHBondContact O-N 2.95Å; Q147-Y149 PolarHBondContact OE1-OH 3.26Å
148	F	55.7	Low	75.3	Confident	227 Å²	227	89.7 Å²	89.7	100%	0.996	42%	0.416	S	S	*	.	S	Bend	trans	-72.3	40.4	-170.6	-66.7	-87.5	0	0	0	115.5
149	Y	59.8	Low	75.4	Confident	111 Å²	111	88.6 Å²	88.6	44%	0.435	41%	0.414	S	S	.	.			trans	-125.6	155.1	172.5	55.8	-106.1	0	0	0	112.1	A144 Q147 E151	A144-Y149 HydrophobicContact CB-CD2 3.8Å; A144-Y149 HydrophobicContact CB-CE2 3.56Å; A144-Y149 WeakPolarHBondContact CB-O 3.49Å; A144-Y149 PolarHBondContact N-O 3.42Å; Q147-Y149 HydrophobicContact CB-CD1 3.92Å; Q147-Y149 HydrophobicContact CB-CE1 3.43Å; Q147-Y149 VanDerWaalsContact CB-CE1 3.43Å; Q147-Y149 HydrophobicContact CG-CE1 4.29Å; Q147-Y149 PolarHBondContact O-N 2.95Å; Q147-Y149 PolarHBondContact OE1-OH 3.26Å; Y149-E151 HydrophobicContact CD2-CG 4.47Å; Y149-E151 HydrophobicContact CE2-CG 4.29Å
150	Y	61.5	Low	75.6	Confident	152 Å²	152	85.1 Å²	85.1	60%	0.596	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99	122.7	177.7	-62.3	-80.7	0	0	0	110.5	I141 G142 E143 R152	I141-Y150 HydrophobicContact CG2-CD1 3.99Å; I141-Y150 HydrophobicContact CG2-CG 4.06Å; G142-Y150 CarbonylContact O-C 3.56Å; G142-Y150 WeakPolarHBondContact O-CA 3.24Å; E143-Y150 HydrophobicContact CG-CD1 4.22Å; E143-Y150 HydrophobicContact CG-CE1 4.05Å; Y150-R152 PolarHBondContact O-N 2.85Å
151	E	76.3	Confident	76	Confident	74 Å²	74	86.7 Å²	86.7	35%	0.346	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	111.6	172.9	-67.6	-157.2	148.8	0	0	110.1	G142 A144 Y149 N204	G142-E151 PolarHBondContact N-O 2.83Å; G142-E151 PolarHBondContact O-N 2.94Å; A144-E151 HydrophobicContact CB-CG 4.41Å; Y149-E151 HydrophobicContact CD2-CG 4.47Å; Y149-E151 HydrophobicContact CE2-CG 4.29Å; E151-N204 PolarHBondContact OE1-ND2 2.88Å
152	R	83.6	Confident	76.5	Confident	117 Å²	117	82.7 Å²	82.7	44%	0.442	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	124.5	169.7	-63.7	-169.3	178.1	-164.8	-0.8	109.5	I141 Y150 N204 L205	I141-R152 HydrophobicContact CG1-CG 4.42Å; Y150-R152 PolarHBondContact O-N 2.85Å; R152-N204 WeakPolarHBondContact O-CA 3.29Å; R152-N204 PolarHBondContact O-N 2.98Å; R152-N204 VanDerWaalsContact O-N 3.14Å; R152-L205 HydrophobicContact CB-CB 4.24Å; R152-L205 PolarHBondContact O-N 3.1Å
153	T	88.9	Confident	77.7	Confident	18 Å²	18	83.4 Å²	83.4	11%	0.11	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	135.7	171.9	-64.5	0	0	0	0	109.5	Q139 S140 F155 K201 L202	Q139-T153 WeakPolarHBondContact CA-O 3.11Å; S140-T153 PolarHBondContact N-O 2.88Å; S140-T153 PolarHBondContact O-N 2.85Å; T153-F155 HydrophobicContact CG2-CD2 4.37Å; T153-F155 HydrophobicContact CG2-CE1 4.48Å; T153-F155 HydrophobicContact CG2-CE2 3.75Å; T153-F155 HydrophobicContact CG2-CZ 3.82Å; T153-K201 HydrophobicContact CG2-CG 3.94Å; T153-L202 CarbonylContact C-O 3.59Å; T153-L202 VanDerWaalsContact CA-O 3.25Å; T153-L202 WeakPolarHBondContact CA-O 3.35Å; T153-L202 WeakPolarHBondContact CG2-O 3.24Å
154	V	92.1	Very high	79.1	Confident	1 Å²	1	76.8 Å²	76.8	1%	0.006	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	137.9	-179.4	-176	0	0	0	0	109.8	V137 H138 Q139 L156 K201 L202 L205 L234	V137-V154 HydrophobicContact CG1-CG1 3.54Å; H138-V154 WeakPolarHBondContact O-CA 3.47Å; Q139-V154 HydrophobicContact CG-CG1 4.44Å; Q139-V154 HydrophobicContact CG-CG2 4.21Å; V154-L156 HydrophobicContact CG1-CD1 3.98Å; V154-K201 CarbonylContact O-C 3.58Å; V154-K201 WeakPolarHBondContact O-CA 3.25Å; V154-L202 HydrophobicContact CB-CB 4.4Å; V154-L202 PolarHBondContact N-O 2.83Å; V154-L202 PolarHBondContact O-N 3.14Å; V154-L205 HydrophobicContact CB-CD1 4.47Å; V154-L205 HydrophobicContact CG2-CD1 3.94Å; V154-L205 HydrophobicContact CG2-CD2 3.73Å; V154-L205 HydrophobicContact CG2-CG 4.35Å; V154-L234 HydrophobicContact CG1-CD1 4.3Å; V154-L234 HydrophobicContact CG1-CD2 4.07Å
155	F	93.3	Very high	80.7	Confident	51 Å²	51	80.5 Å²	80.5	22%	0.224	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	107.2	177.7	-54.9	-102.3	0	0	0	108.5	V137 H138 T153 I199 L200 K201	V137-F155 CarbonylContact C-O 3.59Å; V137-F155 WeakPolarHBondContact CA-O 3.08Å; H138-F155 PolarHBondContact N-O 2.96Å; H138-F155 PolarHBondContact O-N 2.9Å; T153-F155 HydrophobicContact CG2-CD2 4.37Å; T153-F155 HydrophobicContact CG2-CE1 4.48Å; T153-F155 HydrophobicContact CG2-CE2 3.75Å; T153-F155 HydrophobicContact CG2-CZ 3.82Å; F155-I199 HydrophobicContact CB-CG2 4.17Å; F155-I199 HydrophobicContact CD1-CG2 4.13Å; F155-L200 CarbonylContact C-O 3.49Å; F155-L200 WeakPolarHBondContact CA-O 3.38Å; F155-K201 HydrophobicContact CD1-CB 4.07Å; F155-K201 HydrophobicContact CD1-CD 4.09Å; F155-K201 HydrophobicContact CD1-CG 3.88Å; F155-K201 HydrophobicContact CE1-CB 4.41Å; F155-K201 HydrophobicContact CE1-CD 3.6Å; F155-K201 HydrophobicContact CE1-CG 3.77Å; F155-K201 HydrophobicContact CZ-CD 4.36Å; F155-K201 HydrophobicContact CZ-CG 4.44Å
156	L	94.4	Very high	82.5	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	114	169.1	-58.6	90.1	0	0	0	107.6	I135 T136 V137 V154 W170 I199 L200 L202 Y213 F232 L234	I135-L156 HydrophobicContact CG2-CB 4.38Å; T136-L156 CarbonylContact O-C 3.58Å; T136-L156 WeakPolarHBondContact O-CA 3.42Å; V137-L156 HydrophobicContact CG1-CG 4.41Å; V137-L156 HydrophobicContact CG2-CD2 4.24Å; V137-L156 HydrophobicContact CG2-CG 4.04Å; V154-L156 HydrophobicContact CG1-CD1 3.98Å; L156-W170 HydrophobicContact CB-CH2 3.56Å; L156-W170 HydrophobicContact CB-CZ2 4.22Å; L156-W170 HydrophobicContact CB-CZ3 4Å; L156-W170 HydrophobicContact CD2-CZ3 4.35Å; L156-W170 VanDerWaalsContact O-CZ2 3.23Å; L156-W170 WeakPolarHBondContact O-CZ2 3.41Å; L156-I199 CarbonylContact O-C 3.56Å; L156-I199 WeakPolarHBondContact O-CA 3.34Å; L156-L200 HydrophobicContact CB-CB 4.41Å; L156-L200 HydrophobicContact CD1-CD2 4.28Å; L156-L200 HydrophobicContact CD1-CG 4.34Å; L156-L200 PolarHBondContact N-O 2.67Å; L156-L200 PolarHBondContact O-N 2.82Å; L156-L202 HydrophobicContact CD1-CD1 3.72Å; L156-L202 HydrophobicContact CD1-CG 4.14Å; L156-Y213 HydrophobicContact CD2-CD2 3.96Å; L156-Y213 HydrophobicContact CD2-CG 3.79Å; L156-F232 HydrophobicContact CD2-CD1 4.46Å; L156-L234 HydrophobicContact CD1-CD2 4.48Å
157	R	93.7	Very high	84	Confident	92 Å²	92	68.9 Å²	68.9	35%	0.347	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	124.8	177.7	-176.4	-179.3	-171	170.6	0.1	108.7	I135 T136 V159 T197 I199	I135-R157 CarbonylContact C-O 3.58Å; I135-R157 VanDerWaalsContact CA-O 3.29Å; I135-R157 WeakPolarHBondContact CA-O 3.18Å; T136-R157 PolarHBondContact N-O 2.92Å; T136-R157 PolarHBondContact O-N 3.04Å; R157-V159 HydrophobicContact CG-CG2 4Å; R157-T197 WeakPolarHBondContact CG-OG1 3.26Å; R157-T197 PolarHBondContact NE-OG1 3.2Å; R157-I199 HydrophobicContact CB-CG1 4.15Å; R157-I199 HydrophobicContact CG-CG1 4.01Å
158	C	94	Very high	85.8	Confident	0 Å²	0	64 Å²	64	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	133.3	173.9	-173	0	0	0	0	110	V134 I135 Y168 W170 T197 K198 C215	V134-C158 WeakPolarHBondContact O-CA 3.33Å; I135-C158 HydrophobicContact CG1-CB 4.38Å; C158-Y168 HydrophobicContact CB-CD1 4.37Å; C158-Y168 HydrophobicContact CB-CE1 4.43Å; C158-W170 HydrophobicContact CB-CH2 3.8Å; C158-W170 HydrophobicContact CB-CZ2 3.49Å; C158-W170 VanDerWaalsContact CB-CZ2 3.49Å; C158-T197 VanDerWaalsContact O-CA 3.25Å; C158-T197 WeakPolarHBondContact O-CA 3.3Å; C158-K198 PolarHBondContact N-O 2.03Å; C158-K198 PolarHBondContact O-N 2.92Å; C158-C215 HydrophobicContact CB-CB 3.71Å; C158-C215 WeakPolarHBondContact CB-SG 3.4Å; C158-C215 WeakPolarHBondContact SG-CB 3.1Å; C158-C215 CovalentContact SG-SG 2.03Å; C158-C215 PolarHBondContact SG-SG 2.82Å
159	V	93.1	Very high	87.5	Confident	47 Å²	47	55.1 Å²	55.1	29%	0.285	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	136.5	-177.6	-165.5	0	0	0	0	110	P133 V134 R157 Y168	P133-V159 CarbonylContact C-O 3.51Å; P133-V159 WeakPolarHBondContact CA-O 3.48Å; V134-V159 PolarHBondContact N-O 2.83Å; V134-V159 PolarHBondContact O-N 2.89Å; R157-V159 HydrophobicContact CG-CG2 4Å; V159-Y168 WeakPolarHBondContact CA-OH 3.23Å
160	A	92.4	Very high	89.1	Confident	4 Å²	4	50 Å²	50	3%	0.033	24%	0.24	C	C	.	.			trans	-155.5	134.8	177.4	0	0	0	0	0	107.9	L130 P133 Y168 A217	L130-A160 HydrophobicContact CD1-CB 4.34Å; P133-A160 HydrophobicContact CB-CB 4.07Å; A160-Y168 HydrophobicContact CB-CE1 4.14Å; A160-Y168 PolarHBondContact N-OH 3.26Å; A160-Y168 PolarHBondContact O-OH 3.26Å; A160-A217 HydrophobicContact CB-CB 4.22Å
161	N	91.6	Very high	90.6	Very high	83 Å²	83	45.2 Å²	45.2	44%	0.444	22%	0.223	S	C	.	.			trans	-86.8	138.7	174.8	-59.3	-13.9	0	0	0	109.2	Y129 D131	Y129-N161 HydrophobicContact CE2-CB 4.28Å; D131-N161 PolarHBondContact N-O 3.48Å
162	S	90.8	Very high	91.4	Very high	24 Å²	24	43.5 Å²	43.5	17%	0.168	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	159.5	179.1	72.8	0	0	0	0	113.1	Y129 P164 V166	Y129-S162 WeakPolarHBondContact O-CA 3.26Å; Y129-S162 VanDerWaalsContact O-CB 3.26Å; Y129-S162 WeakPolarHBondContact O-CB 3.43Å; S162-P164 CarbonylContact C-O 3.55Å; S162-P164 WeakPolarHBondContact CB-O 2.98Å; S162-P164 PolarHBondContact OG-O 2.8Å; S162-V166 VanDerWaalsContact OG-CB 3.31Å; S162-V166 WeakPolarHBondContact OG-CB 3.38Å; S162-V166 PolarHBondContact OG-N 2.82Å
163	N	89.4	Confident	91.5	Very high	48 Å²	48	40.2 Å²	40.2	26%	0.257	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	121.3	159.6	-172.9	23.2	0	0	0	106.5	V127 Y128 Y129	V127-N163 PolarHBondContact O-ND2 2.91Å; Y128-N163 CarbonylContact C-O 3.58Å; Y128-N163 WeakPolarHBondContact CA-O 3.34Å; Y128-N163 VanDerWaalsContact CB-O 3.23Å; Y128-N163 WeakPolarHBondContact CB-O 3.06Å; Y128-N163 HydrophobicContact CD1-CB 4.17Å; Y128-N163 WeakPolarHBondContact CD1-ND2 3.44Å; Y129-N163 HydrophobicContact CD1-CB 3.93Å; Y129-N163 HydrophobicContact CE1-CB 3.6Å; Y129-N163 PolarHBondContact N-O 2.88Å; Y129-N163 PolarHBondContact O-N 2.95Å; Y129-N163 VanDerWaalsContact O-O 3.13Å
164	P	88.8	Confident	91.3	Very high	23 Å²	23	51.1 Å²	51.1	15%	0.149	26%	0.255	C	S	.	.	S	Bend	cis	-73.4	178.5	2.4	36	-37.5	0	0	0	112.1	Y128 S162 V166 V219 V222	Y128-P164 HydrophobicContact CD2-CG 4.42Å; Y128-P164 HydrophobicContact CE1-CB 4.43Å; Y128-P164 HydrophobicContact CE2-CB 4.38Å; Y128-P164 HydrophobicContact CE2-CG 4.07Å; S162-P164 CarbonylContact C-O 3.55Å; S162-P164 WeakPolarHBondContact CB-O 2.98Å; S162-P164 PolarHBondContact OG-O 2.8Å; P164-V166 PolarHBondContact O-N 2.88Å; P164-V219 HydrophobicContact CG-CB 4.2Å; P164-V219 HydrophobicContact CG-CG1 4.35Å; P164-V222 HydrophobicContact CG-CG1 4.44Å
165	P	88.6	Confident	91.1	Very high	102 Å²	102	55.4 Å²	55.4	66%	0.662	28%	0.275	S	S	*	.			trans	-55.1	125.8	179.9	-29.5	37.1	0	0	0	114.2
166	V	91.3	Very high	91	Very high	13 Å²	13	56.9 Å²	56.9	8%	0.079	29%	0.288	C	S	.	.			trans	-62.3	144.3	-179.4	51.5	0	0	0	0	112.5	L130 S162 P164 Y168 A217	L130-V166 HydrophobicContact CD1-CB 4.48Å; L130-V166 HydrophobicContact CD1-CG2 4.27Å; S162-V166 VanDerWaalsContact OG-CB 3.31Å; S162-V166 WeakPolarHBondContact OG-CB 3.38Å; S162-V166 PolarHBondContact OG-N 2.82Å; P164-V166 PolarHBondContact O-N 2.88Å; V166-Y168 HydrophobicContact CB-CE2 4.44Å; V166-Y168 HydrophobicContact CG1-CE1 4.48Å; V166-Y168 HydrophobicContact CG1-CE2 3.63Å; V166-Y168 WeakPolarHBondContact CG1-OH 3.48Å; V166-Y168 HydrophobicContact CG2-CD1 4.03Å; V166-Y168 HydrophobicContact CG2-CD2 4.31Å; V166-Y168 HydrophobicContact CG2-CE1 3.68Å; V166-Y168 HydrophobicContact CG2-CE2 3.97Å; V166-Y168 HydrophobicContact CG2-CG 4.36Å; V166-A217 HydrophobicContact CG2-CB 3.73Å
167	R	89.6	Confident	90.8	Very high	142 Å²	142	57.3 Å²	57.3	54%	0.536	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	128.9	168.3	-67.6	179	174.3	-100.6	-3.7	110	S218	R167-S218 PolarHBondContact N-O 2.77Å; R167-S218 PolarHBondContact O-N 2.75Å
168	Y	92.2	Very high	90.4	Very high	14 Å²	14	56.9 Å²	56.9	6%	0.055	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	134.7	178.9	-56.6	-80.2	0	0	0	113	C158 V159 A160 V166 E196 K198 C215 I216 A217	C158-Y168 HydrophobicContact CB-CD1 4.37Å; C158-Y168 HydrophobicContact CB-CE1 4.43Å; V159-Y168 WeakPolarHBondContact CA-OH 3.23Å; A160-Y168 HydrophobicContact CB-CE1 4.14Å; A160-Y168 PolarHBondContact N-OH 3.26Å; A160-Y168 PolarHBondContact O-OH 3.26Å; V166-Y168 HydrophobicContact CB-CE2 4.44Å; V166-Y168 HydrophobicContact CG1-CE1 4.48Å; V166-Y168 HydrophobicContact CG1-CE2 3.63Å; V166-Y168 WeakPolarHBondContact CG1-OH 3.48Å; V166-Y168 HydrophobicContact CG2-CD1 4.03Å; V166-Y168 HydrophobicContact CG2-CD2 4.31Å; V166-Y168 HydrophobicContact CG2-CE1 3.68Å; V166-Y168 HydrophobicContact CG2-CE2 3.97Å; V166-Y168 HydrophobicContact CG2-CG 4.36Å; Y168-E196 PolarHBondContact OH-O 2.7Å; Y168-K198 HydrophobicContact CD2-CB 3.6Å; Y168-K198 HydrophobicContact CD2-CD 4.38Å; Y168-K198 HydrophobicContact CE2-CB 4.34Å; Y168-K198 HydrophobicContact CG-CB 4.02Å; Y168-K198 PolarHBondContact O-NZ 2.89Å; Y168-K198 VanDerWaalsContact O-NZ 3.07Å; Y168-C215 VanDerWaalsContact CD1-SG 3.52Å; Y168-I216 WeakPolarHBondContact CA-O 3.27Å; Y168-A217 HydrophobicContact CD1-CB 3.93Å; Y168-A217 HydrophobicContact CE1-CB 3.79Å
169	S	91.5	Very high	89.8	Confident	42 Å²	42	62.8 Å²	62.8	29%	0.294	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	145.3	160.7	67.8	0	0	0	0	110.7	H171 I216	S169-H171 WeakPolarHBondContact CB-NE2 3.49Å; S169-H171 PolarHBondContact OG-NE2 3.09Å; S169-I216 PolarHBondContact N-O 2.71Å; S169-I216 PolarHBondContact O-N 2.9Å
170	W	94.5	Very high	88.8	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.008	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	137.8	177.6	-78.8	106.4	0	0	0	109.7	I135 L156 C158 L177 I187 L200 C215	I135-W170 HydrophobicContact CD1-CH2 4.11Å; I135-W170 HydrophobicContact CD1-CZ3 3.81Å; I135-W170 HydrophobicContact CG1-CH2 3.94Å; I135-W170 HydrophobicContact CG1-CZ3 4.17Å; I135-W170 HydrophobicContact CG2-CH2 4.44Å; L156-W170 HydrophobicContact CB-CH2 3.56Å; L156-W170 HydrophobicContact CB-CZ2 4.22Å; L156-W170 HydrophobicContact CB-CZ3 4Å; L156-W170 HydrophobicContact CD2-CZ3 4.35Å; L156-W170 VanDerWaalsContact O-CZ2 3.23Å; L156-W170 WeakPolarHBondContact O-CZ2 3.41Å; C158-W170 HydrophobicContact CB-CH2 3.8Å; C158-W170 HydrophobicContact CB-CZ2 3.49Å; C158-W170 VanDerWaalsContact CB-CZ2 3.49Å; W170-L177 HydrophobicContact CB-CB 4.31Å; W170-L177 PolarHBondContact O-N 2.98Å; W170-I187 HydrophobicContact CB-CD1 4.36Å; W170-L200 HydrophobicContact CB-CD2 4.31Å; W170-L200 HydrophobicContact CD2-CB 3.69Å; W170-L200 HydrophobicContact CD2-CD2 3.96Å; W170-L200 HydrophobicContact CD2-CG 4.47Å; W170-L200 HydrophobicContact CE3-CB 4.25Å; W170-L200 HydrophobicContact CE3-CD2 3.86Å; W170-L200 HydrophobicContact CG-CB 3.92Å; W170-L200 HydrophobicContact CG-CD2 4.19Å; W170-L200 HydrophobicContact CH2-CB 4.49Å; W170-L200 HydrophobicContact CZ2-CB 3.98Å; W170-L200 HydrophobicContact CZ3-CD2 4.43Å; W170-C215 HydrophobicContact CE3-CB 4.09Å; W170-C215 HydrophobicContact CH2-CB 4.13Å; W170-C215 HydrophobicContact CZ3-CB 3.88Å
171	H	93.3	Very high	88	Confident	52 Å²	52	65.3 Å²	65.3	24%	0.241	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	140.4	179.9	-58.5	-119.8	0	0	0	110.6	S169 E175 V176 Y213 S214 I216	S169-H171 WeakPolarHBondContact CB-NE2 3.49Å; S169-H171 PolarHBondContact OG-NE2 3.09Å; H171-E175 CarbonylContact C-O 3.57Å; H171-E175 WeakPolarHBondContact CA-O 3.34Å; H171-V176 VanDerWaalsContact CE1-CG2 3.49Å; H171-V176 WeakPolarHBondContact CE1-CG2 3.47Å; H171-Y213 CarbonylContact O-C 3.55Å; H171-Y213 WeakPolarHBondContact O-CA 3.46Å; H171-S214 PolarHBondContact N-O 3.33Å; H171-S214 PolarHBondContact O-N 3.16Å; H171-I216 WeakPolarHBondContact NE2-CD1 3.48Å
172	R	92.5	Very high	87.3	Confident	39 Å²	39	62.8 Å²	62.8	15%	0.147	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	100.5	171.3	-178.9	170.2	61	-177.4	-3	108.1	R174 E175 L177 D182 D209 A211 Y213	R172-R174 PolarHBondContact O-N 3.08Å; R172-E175 IonicContact CZ-OE2 3.18Å; R172-E175 PolarHBondContact N-O 2.59Å; R172-E175 IonicContact NE-OE2 2.79Å; R172-E175 PolarHBondContact NE-OE2 3.21Å; R172-E175 IonicContact NH2-OE1 2.73Å; R172-E175 PolarHBondContact NH2-OE1 2.82Å; R172-E175 IonicContact NH2-OE2 3.22Å; R172-E175 PolarHBondContact NH2-OE2 2.85Å; R172-E175 WeakPolarHBondContact O-CB 3.12Å; R172-E175 PolarHBondContact O-N 3.4Å; R172-L177 HydrophobicContact CB-CD1 4.14Å; R172-L177 HydrophobicContact CB-CD2 4.08Å; R172-L177 HydrophobicContact CB-CG 4.18Å; R172-D182 IonicContact NH1-OD2 3.92Å; R172-D209 IonicContact NH1-OD1 2.62Å; R172-D209 PolarHBondContact NH1-OD1 2.85Å; R172-A211 HydrophobicContact CG-CB 3.81Å; R172-Y213 HydrophobicContact CB-CD1 4.46Å; R172-Y213 HydrophobicContact CB-CE1 4.11Å; R172-Y213 HydrophobicContact CG-CE1 4.16Å
173	G	86.6	Confident	86.4	Confident	48 Å²	48	71.8 Å²	71.8	50%	0.495	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	-97.7	-169.6	0	0	0	0	0	112.1	N212	G173-N212 PolarHBondContact N-O 3.05Å
174	R	83.6	Confident	86.1	Confident	247 Å²	247	69.9 Å²	69.9	93%	0.932	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.9	-3.7	174.6	-64.6	-173.1	179.6	-166.7	0.1	113.9	R172	R172-R174 PolarHBondContact O-N 3.08Å
175	E	88.3	Confident	86	Confident	91 Å²	91	69 Å²	69	43%	0.425	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	129.8	-176.9	-179.5	-171.4	-153.7	0	0	110.5	H171 R172	H171-E175 CarbonylContact C-O 3.57Å; H171-E175 WeakPolarHBondContact CA-O 3.34Å; R172-E175 IonicContact CZ-OE2 3.18Å; R172-E175 PolarHBondContact N-O 2.59Å; R172-E175 IonicContact NE-OE2 2.79Å; R172-E175 PolarHBondContact NE-OE2 3.21Å; R172-E175 IonicContact NH2-OE1 2.73Å; R172-E175 PolarHBondContact NH2-OE1 2.82Å; R172-E175 IonicContact NH2-OE2 3.22Å; R172-E175 PolarHBondContact NH2-OE2 2.85Å; R172-E175 WeakPolarHBondContact O-CB 3.12Å; R172-E175 PolarHBondContact O-N 3.4Å
176	V	90.2	Very high	86	Confident	81 Å²	81	66.4 Å²	66.4	49%	0.491	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	124.9	174.5	-171.6	0	0	0	0	109.5	H171	H171-V176 VanDerWaalsContact CE1-CG2 3.49Å; H171-V176 WeakPolarHBondContact CE1-CG2 3.47Å
177	L	90.5	Very high	85.9	Confident	9 Å²	9	66.9 Å²	66.9	5%	0.047	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	137.2	176.2	-60.1	-179.7	0	0	0	111.3	W170 R172 I187 L200 Y213	W170-L177 HydrophobicContact CB-CB 4.31Å; W170-L177 PolarHBondContact O-N 2.98Å; R172-L177 HydrophobicContact CB-CD1 4.14Å; R172-L177 HydrophobicContact CB-CD2 4.08Å; R172-L177 HydrophobicContact CB-CG 4.18Å; L177-I187 HydrophobicContact CB-CD1 3.91Å; L177-L200 HydrophobicContact CD1-CD1 3.95Å; L177-L200 HydrophobicContact CD1-CD2 3.74Å; L177-Y213 HydrophobicContact CD1-CD1 4.23Å; L177-Y213 HydrophobicContact CD1-CE1 3.92Å
178	T	85.8	Confident	85.8	Confident	84 Å²	84	64 Å²	64	52%	0.515	33%	0.333	S	S	.	.			trans	-127.7	165.4	176	59.7	0	0	0	0	110.2	G180 S181	T178-G180 PolarHBondContact O-N 3.01Å; T178-G180 VanDerWaalsContact O-N 3.13Å; T178-S181 WeakPolarHBondContact O-CB 3.44Å; T178-S181 PolarHBondContact O-N 3.07Å; T178-S181 PolarHBondContact O-OG 2.92Å
179	Q	81.3	Confident	85.4	Confident	124 Å²	124	68.7 Å²	68.7	58%	0.579	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	118.4	176.6	174.1	61	7.7	0	0	109.9	I187	Q179-I187 PolarHBondContact OE1-O 3.42Å
180	G	72.9	Confident	84.9	Confident	53 Å²	53	67.8 Å²	67.8	55%	0.546	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	17.4	-177.9	0	0	0	0	0	115.5	T178 D182 V185	T178-G180 PolarHBondContact O-N 3.01Å; T178-G180 VanDerWaalsContact O-N 3.13Å; G180-D182 PolarHBondContact O-N 3.07Å; G180-D182 VanDerWaalsContact O-N 3.15Å; G180-V185 PolarHBondContact N-O 2.78Å
181	S	75.4	Confident	83.7	Confident	51 Å²	51	76.5 Å²	76.5	36%	0.357	39%	0.386	S	S	.	.	S	Bend	trans	-61.2	-18.4	172.5	67.4	0	0	0	0	113.4	T178	T178-S181 WeakPolarHBondContact O-CB 3.44Å; T178-S181 PolarHBondContact O-N 3.07Å; T178-S181 PolarHBondContact O-OG 2.92Å
182	D	76.8	Confident	82.5	Confident	30 Å²	30	84.3 Å²	84.3	16%	0.16	42%	0.42	C	S	.	.	S	Bend	trans	-148.3	151.6	174.3	-169.9	-28.4	0	0	0	107.6	R172 G180 G184 V185 R206 Q208	R172-D182 IonicContact NH1-OD2 3.92Å; G180-D182 PolarHBondContact O-N 3.07Å; G180-D182 VanDerWaalsContact O-N 3.15Å; D182-G184 PolarHBondContact O-N 2.98Å; D182-G184 VanDerWaalsContact O-N 3.1Å; D182-G184 PolarHBondContact OD1-N 2.65Å; D182-V185 HydrophobicContact CB-CB 4.15Å; D182-V185 HydrophobicContact CB-CG2 3.82Å; D182-V185 PolarHBondContact O-N 3.04Å; D182-R206 VanDerWaalsContact CG-NH1 3.3Å; D182-R206 IonicContact OD1-CZ 3.53Å; D182-R206 IonicContact OD1-NH1 2.69Å; D182-R206 PolarHBondContact OD1-NH1 3.47Å; D182-R206 IonicContact OD1-NH2 3.31Å; D182-R206 IonicContact OD2-CZ 2.7Å; D182-R206 VanDerWaalsContact OD2-CZ 3.32Å; D182-R206 IonicContact OD2-NH1 3.7Å; D182-R206 PolarHBondContact OD2-NH1 3.13Å; D182-R206 VanDerWaalsContact OD2-NH1 3.08Å; D182-R206 IonicContact OD2-NH2 2.79Å; D182-R206 PolarHBondContact OD2-NH2 2.91Å; D182-Q208 PolarHBondContact OD2-NE2 2.73Å
183	K	72.7	Confident	81.4	Confident	212 Å²	212	84.3 Å²	84.3	92%	0.922	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.4	178.1	-67.6	-176.7	177.9	-179.5	0	112.9
184	G	81.1	Confident	80.5	Confident	8 Å²	8	90.6 Å²	90.6	8%	0.082	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-9.3	175.1	0	0	0	0	0	115.8	D182 L202 K203	D182-G184 PolarHBondContact O-N 2.98Å; D182-G184 VanDerWaalsContact O-N 3.1Å; D182-G184 PolarHBondContact OD1-N 2.65Å; G184-L202 CarbonylContact O-C 3.44Å; G184-L202 WeakPolarHBondContact O-CA 3.31Å; G184-K203 PolarHBondContact O-N 3.34Å
185	V	88.2	Confident	79.8	Confident	4 Å²	4	79.6 Å²	79.6	2%	0.024	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	117.6	-167	170.8	0	0	0	0	112.6	G180 D182 I187 L200 L202	G180-V185 PolarHBondContact N-O 2.78Å; D182-V185 HydrophobicContact CB-CB 4.15Å; D182-V185 HydrophobicContact CB-CG2 3.82Å; D182-V185 PolarHBondContact O-N 3.04Å; V185-I187 HydrophobicContact CG1-CD1 4.36Å; V185-I187 HydrophobicContact CG1-CG1 4.12Å; V185-L200 HydrophobicContact CG1-CD1 3.87Å; V185-L202 HydrophobicContact CG2-CD2 3.96Å
186	E	88.8	Confident	79.4	Confident	49 Å²	49	80.2 Å²	80.2	23%	0.229	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	136.7	167.7	-72.2	176.5	161.4	0	0	110.1	Y188 K201 K203	E186-Y188 HydrophobicContact CB-CD1 4.49Å; E186-K201 HydrophobicContact CB-CB 4.24Å; E186-K201 HydrophobicContact CB-CD 4.33Å; E186-K201 PolarHBondContact N-O 3.3Å; E186-K201 PolarHBondContact O-N 3.06Å; E186-K201 VanDerWaalsContact OE2-CD 3.31Å; E186-K201 WeakPolarHBondContact OE2-CD 3.07Å; E186-K201 VanDerWaalsContact OE2-CE 3.26Å; E186-K201 WeakPolarHBondContact OE2-CE 3.3Å; E186-K201 IonicContact OE2-NZ 2.73Å; E186-K201 PolarHBondContact OE2-NZ 3.28Å; E186-K203 VanDerWaalsContact OE1-CE 3.25Å; E186-K203 WeakPolarHBondContact OE1-CE 3.37Å; E186-K203 IonicContact OE1-NZ 3.58Å; E186-K203 PolarHBondContact OE1-NZ 2.68Å; E186-K203 WeakPolarHBondContact OE2-CE 3.27Å; E186-K203 IonicContact OE2-NZ 2.71Å; E186-K203 PolarHBondContact OE2-NZ 3Å
187	I	89.3	Confident	79.3	Confident	23 Å²	23	76.5 Å²	76.5	12%	0.118	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	117	177.1	-53.7	179.4	0	0	0	108.8	W170 L177 Q179 V185 K198 I199 L200	W170-I187 HydrophobicContact CB-CD1 4.36Å; L177-I187 HydrophobicContact CB-CD1 3.91Å; Q179-I187 PolarHBondContact OE1-O 3.42Å; V185-I187 HydrophobicContact CG1-CD1 4.36Å; V185-I187 HydrophobicContact CG1-CG1 4.12Å; I187-K198 HydrophobicContact CG2-CD 4.09Å; I187-K198 HydrophobicContact CG2-CG 4.03Å; I187-I199 VanDerWaalsContact CA-O 3.3Å; I187-I199 WeakPolarHBondContact CA-O 3.47Å; I187-L200 HydrophobicContact CD1-CD1 4.19Å; I187-L200 HydrophobicContact CG1-CD1 3.78Å
188	Y	87.3	Confident	79.2	Confident	82 Å²	82	78.3 Å²	78.3	32%	0.322	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	162.5	-175	63.5	-82.2	0	0	0	112.8	E186 I199 K201	E186-Y188 HydrophobicContact CB-CD1 4.49Å; Y188-I199 HydrophobicContact CE1-CB 4.36Å; Y188-I199 HydrophobicContact CE1-CG2 4.03Å; Y188-I199 HydrophobicContact CE2-CB 4.42Å; Y188-I199 HydrophobicContact CE2-CD1 4.16Å; Y188-I199 PolarHBondContact N-O 3.04Å; Y188-I199 PolarHBondContact O-N 2.84Å; Y188-K201 HydrophobicContact CE1-CB 3.95Å; Y188-K201 HydrophobicContact CE1-CD 3.86Å
189	E	83.6	Confident	79.5	Confident	111 Å²	111	75.1 Å²	75.1	52%	0.519	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-93.9	131.1	170.7	-73.9	153.1	-148.7	0	0	108.1	K198	E189-K198 HydrophobicContact CG-CG 4.31Å
190	P	79.8	Confident	80.1	Confident	23 Å²	23	69.2 Å²	69.2	15%	0.149	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-73.7	151.1	-177.1	27.3	-28.8	0	0	0	111.8	T193 T197 I199	P190-T193 HydrophobicContact CG-CG2 4.32Å; P190-T193 WeakPolarHBondContact CG-OG1 3.34Å; P190-T193 PolarHBondContact O-OG1 3.16Å; P190-T197 VanDerWaalsContact CD-O 3.3Å; P190-T197 WeakPolarHBondContact CD-O 3.31Å; P190-T197 HydrophobicContact CG-CG2 3.76Å; P190-I199 HydrophobicContact CB-CD1 3.83Å; P190-I199 HydrophobicContact CG-CD1 3.93Å; P190-I199 HydrophobicContact CG-CG1 4.36Å
191	F	71	Confident	81	Confident	185 Å²	185	68.8 Å²	68.8	81%	0.811	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	148.9	172.5	-56.9	-73.6	0	0	0	111.6	T193	F191-T193 VanDerWaalsContact C-N 3.34Å; F191-T193 PolarHBondContact O-N 3Å
192	F	67.5	Low	81.8	Confident	216 Å²	216	66.4 Å²	66.4	95%	0.947	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	21.6	179.9	-44.7	-77.6	0	0	0	116.2
193	T	68.7	Low	82.3	Confident	39 Å²	39	68.6 Å²	68.6	24%	0.239	32%	0.319	C	S	.	.			trans	-132.2	139.8	175.5	64.4	0	0	0	0	112	P190 F191 G195 T197	P190-T193 HydrophobicContact CG-CG2 4.32Å; P190-T193 WeakPolarHBondContact CG-OG1 3.34Å; P190-T193 PolarHBondContact O-OG1 3.16Å; F191-T193 VanDerWaalsContact C-N 3.34Å; F191-T193 PolarHBondContact O-N 3Å; T193-G195 VanDerWaalsContact C-N 3.28Å; T193-G195 PolarHBondContact O-N 2.82Å; T193-G195 VanDerWaalsContact O-N 3.14Å; T193-T197 VanDerWaalsContact CB-CG2 3.46Å; T193-T197 HydrophobicContact CG2-CG2 3.61Å; T193-T197 WeakPolarHBondContact OG1-CG2 3.34Å
194	Q	67.8	Low	82.8	Confident	180 Å²	180	61.9 Å²	61.9	84%	0.841	29%	0.293	S	S	*	.			trans	-90.9	50.5	-171.2	-60.6	-170.7	9.3	0	0	112.4	E196	Q194-E196 PolarHBondContact O-N 2.81Å
195	G	69.4	Low	83.1	Confident	16 Å²	16	62.6 Å²	62.6	17%	0.165	30%	0.295	C	S	.	.	S	Bend	trans	76.9	-8.8	-178.3	0	0	0	0	0	115.4	T193 T197	T193-G195 VanDerWaalsContact C-N 3.28Å; T193-G195 PolarHBondContact O-N 2.82Å; T193-G195 VanDerWaalsContact O-N 3.14Å; G195-T197 PolarHBondContact O-N 2.86Å
196	E	80.4	Confident	83.1	Confident	104 Å²	104	65.8 Å²	65.8	49%	0.486	31%	0.306	S	S	.	.	S	Bend	trans	-56.9	-12.7	177.5	-58.7	170.7	129.5	0	0	114.5	Y168 Q194	Y168-E196 PolarHBondContact OH-O 2.7Å; Q194-E196 PolarHBondContact O-N 2.81Å
197	T	86.6	Confident	83	Confident	3 Å²	3	69 Å²	69	2%	0.018	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	137	-174.4	159.6	0	0	0	0	111	R157 C158 P190 T193 G195	R157-T197 WeakPolarHBondContact CG-OG1 3.26Å; R157-T197 PolarHBondContact NE-OG1 3.2Å; C158-T197 VanDerWaalsContact O-CA 3.25Å; C158-T197 WeakPolarHBondContact O-CA 3.3Å; P190-T197 VanDerWaalsContact CD-O 3.3Å; P190-T197 WeakPolarHBondContact CD-O 3.31Å; P190-T197 HydrophobicContact CG-CG2 3.76Å; T193-T197 VanDerWaalsContact CB-CG2 3.46Å; T193-T197 HydrophobicContact CG2-CG2 3.61Å; T193-T197 WeakPolarHBondContact OG1-CG2 3.34Å; G195-T197 PolarHBondContact O-N 2.86Å
198	K	90.1	Very high	82.9	Confident	47 Å²	47	73.1 Å²	73.1	20%	0.204	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	136.3	175.5	-160.5	171.5	-165.2	165.6	0	111	C158 Y168 I187 E189	C158-K198 PolarHBondContact N-O 2.03Å; C158-K198 PolarHBondContact O-N 2.92Å; Y168-K198 HydrophobicContact CD2-CB 3.6Å; Y168-K198 HydrophobicContact CD2-CD 4.38Å; Y168-K198 HydrophobicContact CE2-CB 4.34Å; Y168-K198 HydrophobicContact CG-CB 4.02Å; Y168-K198 PolarHBondContact O-NZ 2.89Å; Y168-K198 VanDerWaalsContact O-NZ 3.07Å; I187-K198 HydrophobicContact CG2-CD 4.09Å; I187-K198 HydrophobicContact CG2-CG 4.03Å; E189-K198 HydrophobicContact CG-CG 4.31Å
199	I	91.9	Very high	83	Confident	18 Å²	18	69.2 Å²	69.2	9%	0.092	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	127.6	-177.8	-62.8	176.8	0	0	0	109.1	F155 L156 R157 I187 Y188 P190 K201	F155-I199 HydrophobicContact CB-CG2 4.17Å; F155-I199 HydrophobicContact CD1-CG2 4.13Å; L156-I199 CarbonylContact O-C 3.56Å; L156-I199 WeakPolarHBondContact O-CA 3.34Å; R157-I199 HydrophobicContact CB-CG1 4.15Å; R157-I199 HydrophobicContact CG-CG1 4.01Å; I187-I199 VanDerWaalsContact CA-O 3.3Å; I187-I199 WeakPolarHBondContact CA-O 3.47Å; Y188-I199 HydrophobicContact CE1-CB 4.36Å; Y188-I199 HydrophobicContact CE1-CG2 4.03Å; Y188-I199 HydrophobicContact CE2-CB 4.42Å; Y188-I199 HydrophobicContact CE2-CD1 4.16Å; Y188-I199 PolarHBondContact N-O 3.04Å; Y188-I199 PolarHBondContact O-N 2.84Å; P190-I199 HydrophobicContact CB-CD1 3.83Å; P190-I199 HydrophobicContact CG-CD1 3.93Å; P190-I199 HydrophobicContact CG-CG1 4.36Å; I199-K201 HydrophobicContact CG2-CB 4.46Å
200	L	93.2	Very high	83.4	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	121.7	160.1	166.7	64.4	0	0	0	108	F155 L156 W170 L177 V185 I187 L202 Y213	F155-L200 CarbonylContact C-O 3.49Å; F155-L200 WeakPolarHBondContact CA-O 3.38Å; L156-L200 HydrophobicContact CB-CB 4.41Å; L156-L200 HydrophobicContact CD1-CD2 4.28Å; L156-L200 HydrophobicContact CD1-CG 4.34Å; L156-L200 PolarHBondContact N-O 2.67Å; L156-L200 PolarHBondContact O-N 2.82Å; W170-L200 HydrophobicContact CB-CD2 4.31Å; W170-L200 HydrophobicContact CD2-CB 3.69Å; W170-L200 HydrophobicContact CD2-CD2 3.96Å; W170-L200 HydrophobicContact CD2-CG 4.47Å; W170-L200 HydrophobicContact CE3-CB 4.25Å; W170-L200 HydrophobicContact CE3-CD2 3.86Å; W170-L200 HydrophobicContact CG-CB 3.92Å; W170-L200 HydrophobicContact CG-CD2 4.19Å; W170-L200 HydrophobicContact CH2-CB 4.49Å; W170-L200 HydrophobicContact CZ2-CB 3.98Å; W170-L200 HydrophobicContact CZ3-CD2 4.43Å; L177-L200 HydrophobicContact CD1-CD1 3.95Å; L177-L200 HydrophobicContact CD1-CD2 3.74Å; V185-L200 HydrophobicContact CG1-CD1 3.87Å; I187-L200 HydrophobicContact CD1-CD1 4.19Å; I187-L200 HydrophobicContact CG1-CD1 3.78Å; L200-L202 HydrophobicContact CD1-CD2 3.97Å; L200-L202 HydrophobicContact CD2-CD2 4.44Å; L200-L202 HydrophobicContact CG-CD2 4.14Å; L200-Y213 HydrophobicContact CD2-CD1 3.46Å; L200-Y213 VanDerWaalsContact CD2-CD1 3.46Å; L200-Y213 HydrophobicContact CD2-CE1 3.74Å; L200-Y213 HydrophobicContact CD2-CG 4.39Å
201	K	92.2	Very high	84	Confident	43 Å²	43	67.8 Å²	67.8	19%	0.187	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.9	-179	174	-174.8	172.2	-164.1	0	109.6	T153 V154 F155 E186 Y188 I199	T153-K201 HydrophobicContact CG2-CG 3.94Å; V154-K201 CarbonylContact O-C 3.58Å; V154-K201 WeakPolarHBondContact O-CA 3.25Å; F155-K201 HydrophobicContact CD1-CB 4.07Å; F155-K201 HydrophobicContact CD1-CD 4.09Å; F155-K201 HydrophobicContact CD1-CG 3.88Å; F155-K201 HydrophobicContact CE1-CB 4.41Å; F155-K201 HydrophobicContact CE1-CD 3.6Å; F155-K201 HydrophobicContact CE1-CG 3.77Å; F155-K201 HydrophobicContact CZ-CD 4.36Å; F155-K201 HydrophobicContact CZ-CG 4.44Å; E186-K201 HydrophobicContact CB-CB 4.24Å; E186-K201 HydrophobicContact CB-CD 4.33Å; E186-K201 PolarHBondContact N-O 3.3Å; E186-K201 PolarHBondContact O-N 3.06Å; E186-K201 VanDerWaalsContact OE2-CD 3.31Å; E186-K201 WeakPolarHBondContact OE2-CD 3.07Å; E186-K201 VanDerWaalsContact OE2-CE 3.26Å; E186-K201 WeakPolarHBondContact OE2-CE 3.3Å; E186-K201 IonicContact OE2-NZ 2.73Å; E186-K201 PolarHBondContact OE2-NZ 3.28Å; Y188-K201 HydrophobicContact CE1-CB 3.95Å; Y188-K201 HydrophobicContact CE1-CD 3.86Å; I199-K201 HydrophobicContact CG2-CB 4.46Å
202	L	91.5	Very high	85.1	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	101.6	179.8	-52.8	175.2	0	0	0	107.9	T153 V154 L156 G184 V185 L200 L205 Y213 L234	T153-L202 CarbonylContact C-O 3.59Å; T153-L202 VanDerWaalsContact CA-O 3.25Å; T153-L202 WeakPolarHBondContact CA-O 3.35Å; T153-L202 WeakPolarHBondContact CG2-O 3.24Å; V154-L202 HydrophobicContact CB-CB 4.4Å; V154-L202 PolarHBondContact N-O 2.83Å; V154-L202 PolarHBondContact O-N 3.14Å; L156-L202 HydrophobicContact CD1-CD1 3.72Å; L156-L202 HydrophobicContact CD1-CG 4.14Å; G184-L202 CarbonylContact O-C 3.44Å; G184-L202 WeakPolarHBondContact O-CA 3.31Å; V185-L202 HydrophobicContact CG2-CD2 3.96Å; L200-L202 HydrophobicContact CD1-CD2 3.97Å; L200-L202 HydrophobicContact CD2-CD2 4.44Å; L200-L202 HydrophobicContact CG-CD2 4.14Å; L202-L205 HydrophobicContact CB-CD1 3.96Å; L202-L205 HydrophobicContact CD1-CD1 4Å; L202-Y213 HydrophobicContact CD1-CE1 4.21Å; L202-Y213 HydrophobicContact CD1-CE2 4.09Å; L202-Y213 WeakPolarHBondContact CD1-OH 3.47Å; L202-Y213 HydrophobicContact CD2-CE1 4.37Å; L202-L234 HydrophobicContact CD1-CD2 3.77Å
203	K	87.1	Confident	86.4	Confident	76 Å²	76	53.4 Å²	53.4	33%	0.33	27%	0.269	S	S	.	.	S	Bend	trans	-78.2	145.7	174.9	-65.3	179.4	-176.2	165.7	0	111	G184 E186 L205	G184-K203 PolarHBondContact O-N 3.34Å; E186-K203 VanDerWaalsContact OE1-CE 3.25Å; E186-K203 WeakPolarHBondContact OE1-CE 3.37Å; E186-K203 IonicContact OE1-NZ 3.58Å; E186-K203 PolarHBondContact OE1-NZ 2.68Å; E186-K203 WeakPolarHBondContact OE2-CE 3.27Å; E186-K203 IonicContact OE2-NZ 2.71Å; E186-K203 PolarHBondContact OE2-NZ 3Å; K203-L205 PolarHBondContact O-N 2.97Å
204	N	84.4	Confident	87.7	Confident	72 Å²	72	52.4 Å²	52.4	39%	0.385	26%	0.264	S	S	.	.	S	Bend	trans	44.7	64.3	173.1	-163	-14.6	0	0	0	112.1	E151 R152 R206	E151-N204 PolarHBondContact OE1-ND2 2.88Å; R152-N204 WeakPolarHBondContact O-CA 3.29Å; R152-N204 PolarHBondContact O-N 2.98Å; R152-N204 VanDerWaalsContact O-N 3.14Å; N204-R206 PolarHBondContact O-N 3.26Å
205	L	86.6	Confident	89	Confident	23 Å²	23	43.9 Å²	43.9	12%	0.12	22%	0.224	C	C	.	.			trans	-56.3	118.1	-165.8	-168.1	76.9	0	0	0	113.4	R152 V154 L202 K203 D209 Y210 L234	R152-L205 HydrophobicContact CB-CB 4.24Å; R152-L205 PolarHBondContact O-N 3.1Å; V154-L205 HydrophobicContact CB-CD1 4.47Å; V154-L205 HydrophobicContact CG2-CD1 3.94Å; V154-L205 HydrophobicContact CG2-CD2 3.73Å; V154-L205 HydrophobicContact CG2-CG 4.35Å; L202-L205 HydrophobicContact CB-CD1 3.96Å; L202-L205 HydrophobicContact CD1-CD1 4Å; K203-L205 PolarHBondContact O-N 2.97Å; L205-D209 HydrophobicContact CD1-CB 3.55Å; L205-D209 HydrophobicContact CG-CB 4.26Å; L205-Y210 HydrophobicContact CD2-CD1 4.36Å; L205-Y210 HydrophobicContact CD2-CE1 3.52Å; L205-Y210 HydrophobicContact CG-CE1 4.41Å; L205-L234 HydrophobicContact CD1-CD2 4.29Å
206	R	88	Confident	90.2	Very high	70 Å²	70	45 Å²	45	26%	0.264	23%	0.226	S	C	.	.			trans	-98.1	165.7	-177.8	-60.1	151.7	-59.2	177.5	9.7	111.4	D182 N204 Q208 D209	D182-R206 VanDerWaalsContact CG-NH1 3.3Å; D182-R206 IonicContact OD1-CZ 3.53Å; D182-R206 IonicContact OD1-NH1 2.69Å; D182-R206 PolarHBondContact OD1-NH1 3.47Å; D182-R206 IonicContact OD1-NH2 3.31Å; D182-R206 IonicContact OD2-CZ 2.7Å; D182-R206 VanDerWaalsContact OD2-CZ 3.32Å; D182-R206 IonicContact OD2-NH1 3.7Å; D182-R206 PolarHBondContact OD2-NH1 3.13Å; D182-R206 VanDerWaalsContact OD2-NH1 3.08Å; D182-R206 IonicContact OD2-NH2 2.79Å; D182-R206 PolarHBondContact OD2-NH2 2.91Å; N204-R206 PolarHBondContact O-N 3.26Å; R206-Q208 HydrophobicContact CB-CG 4.06Å; R206-Q208 VanDerWaalsContact CZ-NE2 3.28Å; R206-Q208 PolarHBondContact O-N 3.42Å; R206-Q208 VanDerWaalsContact O-N 3.14Å; R206-D209 WeakPolarHBondContact CB-OD2 3.37Å; R206-D209 IonicContact CZ-OD1 3.05Å; R206-D209 IonicContact CZ-OD2 3.65Å; R206-D209 PolarHBondContact N-OD2 2.86Å; R206-D209 IonicContact NE-OD1 3.22Å; R206-D209 IonicContact NE-OD2 3.26Å; R206-D209 PolarHBondContact NE-OD2 2.98Å; R206-D209 VanDerWaalsContact NH2-CG 3.3Å; R206-D209 IonicContact NH2-OD1 2.72Å; R206-D209 PolarHBondContact NH2-OD1 3.47Å; R206-D209 IonicContact NH2-OD2 3.75Å; R206-D209 PolarHBondContact NH2-OD2 2.87Å; R206-D209 WeakPolarHBondContact O-CB 3.42Å; R206-D209 PolarHBondContact O-N 2.9Å
207	P	86.9	Confident	90.9	Very high	116 Å²	116	40 Å²	40	75%	0.753	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-53.5	-33.6	174.9	-29.1	36.9	0	0	0	114.8	D209 Y210	P207-D209 PolarHBondContact O-N 3.32Å; P207-Y210 PolarHBondContact O-N 2.85Å
208	Q	86.1	Confident	91.2	Very high	110 Å²	110	40.8 Å²	40.8	51%	0.514	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-71.1	-13.4	177.1	69	179.1	44.2	0	0	114.7	D182 R206	D182-Q208 PolarHBondContact OD2-NE2 2.73Å; R206-Q208 HydrophobicContact CB-CG 4.06Å; R206-Q208 VanDerWaalsContact CZ-NE2 3.28Å; R206-Q208 PolarHBondContact O-N 3.42Å; R206-Q208 VanDerWaalsContact O-N 3.14Å
209	D	89.5	Confident	91.3	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-93.2	-0.1	-179.6	-55.2	-49.6	0	0	0	111.9	R172 L205 R206 P207 A211 Y213	R172-D209 IonicContact NH1-OD1 2.62Å; R172-D209 PolarHBondContact NH1-OD1 2.85Å; L205-D209 HydrophobicContact CD1-CB 3.55Å; L205-D209 HydrophobicContact CG-CB 4.26Å; R206-D209 WeakPolarHBondContact CB-OD2 3.37Å; R206-D209 IonicContact CZ-OD1 3.05Å; R206-D209 IonicContact CZ-OD2 3.65Å; R206-D209 PolarHBondContact N-OD2 2.86Å; R206-D209 IonicContact NE-OD1 3.22Å; R206-D209 IonicContact NE-OD2 3.26Å; R206-D209 PolarHBondContact NE-OD2 2.98Å; R206-D209 VanDerWaalsContact NH2-CG 3.3Å; R206-D209 IonicContact NH2-OD1 2.72Å; R206-D209 PolarHBondContact NH2-OD1 3.47Å; R206-D209 IonicContact NH2-OD2 3.75Å; R206-D209 PolarHBondContact NH2-OD2 2.87Å; R206-D209 WeakPolarHBondContact O-CB 3.42Å; R206-D209 PolarHBondContact O-N 2.9Å; P207-D209 PolarHBondContact O-N 3.32Å; D209-A211 PolarHBondContact O-N 2.88Å; D209-Y213 WeakPolarHBondContact O-CE2 3.44Å; D209-Y213 PolarHBondContact O-OH 2.83Å; D209-Y213 VanDerWaalsContact O-OH 3.08Å
210	Y	92.3	Very high	91.1	Very high	79 Å²	79	46.1 Å²	46.1	31%	0.31	23%	0.226	S	C	.	.			trans	-84.9	91.2	166	-63.1	-62	0	0	0	109.7	L205 P207 L234 T235 N236	L205-Y210 HydrophobicContact CD2-CD1 4.36Å; L205-Y210 HydrophobicContact CD2-CE1 3.52Å; L205-Y210 HydrophobicContact CG-CE1 4.41Å; P207-Y210 PolarHBondContact O-N 2.85Å; Y210-L234 CarbonylContact C-O 3.25Å; Y210-L234 VanDerWaalsContact C-O 3.25Å; Y210-L234 WeakPolarHBondContact CA-O 3.04Å; Y210-L234 WeakPolarHBondContact CB-O 3.29Å; Y210-L234 HydrophobicContact CD1-CG 4.32Å; Y210-T235 VanDerWaalsContact CE1-C 3.45Å; Y210-T235 WeakPolarHBondContact CE1-O 3.25Å; Y210-N236 HydrophobicContact CD1-CB 4.44Å; Y210-N236 VanDerWaalsContact CD1-N 3.34Å; Y210-N236 HydrophobicContact CD2-CB 4.45Å; Y210-N236 VanDerWaalsContact CE1-CA 3.47Å; Y210-N236 HydrophobicContact CE1-CB 3.98Å; Y210-N236 HydrophobicContact CE2-CB 4.01Å
211	A	92.8	Very high	90.7	Very high	24 Å²	24	51 Å²	51	20%	0.198	25%	0.252	C	S	.	.	S	Bend	trans	-144.6	169.7	-173.4	0	0	0	0	0	112.3	R172 D209 Y213 L234	R172-A211 HydrophobicContact CG-CB 3.81Å; D209-A211 PolarHBondContact O-N 2.88Å; A211-Y213 HydrophobicContact CB-CE2 4.02Å; A211-Y213 VanDerWaalsContact O-CD2 3.23Å; A211-Y213 WeakPolarHBondContact O-CD2 3.3Å; A211-Y213 PolarHBondContact O-N 3.22Å; A211-L234 PolarHBondContact N-O 3.31Å; A211-L234 VanDerWaalsContact N-O 3.15Å; A211-L234 PolarHBondContact O-N 2.69Å
212	N	94.6	Very high	90.3	Very high	100 Å²	100	51.8 Å²	51.8	54%	0.535	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	113.7	167.2	-70.5	-13.7	0	0	0	109.3	G173 I231 G233	G173-N212 PolarHBondContact N-O 3.05Å; N212-I231 HydrophobicContact CB-CG2 4Å; N212-G233 WeakPolarHBondContact OD1-CA 3.25Å
213	Y	94.6	Very high	89.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	122.3	176.2	-71.7	-87.8	0	0	0	110	L156 H171 R172 L177 L200 L202 D209 A211 I231 F232 L234	L156-Y213 HydrophobicContact CD2-CD2 3.96Å; L156-Y213 HydrophobicContact CD2-CG 3.79Å; H171-Y213 CarbonylContact O-C 3.55Å; H171-Y213 WeakPolarHBondContact O-CA 3.46Å; R172-Y213 HydrophobicContact CB-CD1 4.46Å; R172-Y213 HydrophobicContact CB-CE1 4.11Å; R172-Y213 HydrophobicContact CG-CE1 4.16Å; L177-Y213 HydrophobicContact CD1-CD1 4.23Å; L177-Y213 HydrophobicContact CD1-CE1 3.92Å; L200-Y213 HydrophobicContact CD2-CD1 3.46Å; L200-Y213 VanDerWaalsContact CD2-CD1 3.46Å; L200-Y213 HydrophobicContact CD2-CE1 3.74Å; L200-Y213 HydrophobicContact CD2-CG 4.39Å; L202-Y213 HydrophobicContact CD1-CE1 4.21Å; L202-Y213 HydrophobicContact CD1-CE2 4.09Å; L202-Y213 WeakPolarHBondContact CD1-OH 3.47Å; L202-Y213 HydrophobicContact CD2-CE1 4.37Å; D209-Y213 WeakPolarHBondContact O-CE2 3.44Å; D209-Y213 PolarHBondContact O-OH 2.83Å; D209-Y213 VanDerWaalsContact O-OH 3.08Å; A211-Y213 HydrophobicContact CB-CE2 4.02Å; A211-Y213 VanDerWaalsContact O-CD2 3.23Å; A211-Y213 WeakPolarHBondContact O-CD2 3.3Å; A211-Y213 PolarHBondContact O-N 3.22Å; Y213-I231 WeakPolarHBondContact O-CA 3.38Å; Y213-F232 PolarHBondContact N-O 3.42Å; Y213-F232 PolarHBondContact O-N 2.84Å; Y213-L234 HydrophobicContact CD2-CB 3.93Å; Y213-L234 HydrophobicContact CD2-CD2 4.43Å; Y213-L234 HydrophobicContact CE2-CB 3.98Å; Y213-L234 HydrophobicContact CE2-CD2 3.94Å
214	S	95.4	Very high	89.8	Confident	18 Å²	18	50.7 Å²	50.7	13%	0.126	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	126.5	174.8	-48	0	0	0	0	109.6	H171 V230	H171-S214 PolarHBondContact N-O 3.33Å; H171-S214 PolarHBondContact O-N 3.16Å; S214-V230 WeakPolarHBondContact CA-O 3.48Å
215	C	95.1	Very high	90.1	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	129.2	162.1	177	0	0	0	0	108.2	I135 C158 Y168 W170 S229 V230	I135-C215 HydrophobicContact CD1-CB 3.83Å; I135-C215 HydrophobicContact CG1-CB 3.97Å; C158-C215 HydrophobicContact CB-CB 3.71Å; C158-C215 WeakPolarHBondContact CB-SG 3.4Å; C158-C215 WeakPolarHBondContact SG-CB 3.1Å; C158-C215 CovalentContact SG-SG 2.03Å; C158-C215 PolarHBondContact SG-SG 2.82Å; Y168-C215 VanDerWaalsContact CD1-SG 3.52Å; W170-C215 HydrophobicContact CE3-CB 4.09Å; W170-C215 HydrophobicContact CH2-CB 4.13Å; W170-C215 HydrophobicContact CZ3-CB 3.88Å; C215-S229 VanDerWaalsContact O-CA 3.24Å; C215-S229 WeakPolarHBondContact O-CA 3.47Å; C215-V230 HydrophobicContact CB-CG1 4.04Å; C215-V230 PolarHBondContact N-O 3.29Å; C215-V230 PolarHBondContact O-N 3.3Å
216	I	94.8	Very high	90.3	Very high	40 Å²	40	50 Å²	50	21%	0.205	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	117.1	169.8	-47.6	-175.4	0	0	0	108	Y168 S169 H171 D227 R228	Y168-I216 WeakPolarHBondContact CA-O 3.27Å; S169-I216 PolarHBondContact N-O 2.71Å; S169-I216 PolarHBondContact O-N 2.9Å; H171-I216 WeakPolarHBondContact NE2-CD1 3.48Å; I216-D227 HydrophobicContact CG2-CB 4.04Å; I216-R228 CarbonylContact C-O 3.44Å; I216-R228 WeakPolarHBondContact CA-O 3.42Å
217	A	95	Very high	90.6	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	126.8	172	0	0	0	0	0	109.3	L130 P133 A160 V166 Y168 D227 R228	L130-A217 HydrophobicContact CD1-CB 4.23Å; P133-A217 HydrophobicContact CB-CB 4.07Å; P133-A217 HydrophobicContact CG-CB 4.03Å; A160-A217 HydrophobicContact CB-CB 4.22Å; V166-A217 HydrophobicContact CG2-CB 3.73Å; Y168-A217 HydrophobicContact CD1-CB 3.93Å; Y168-A217 HydrophobicContact CE1-CB 3.79Å; A217-D227 WeakPolarHBondContact O-CA 3.12Å; A217-R228 PolarHBondContact N-O 3.03Å; A217-R228 PolarHBondContact O-N 2.95Å
218	S	92.9	Very high	91	Very high	19 Å²	19	50.1 Å²	50.1	13%	0.133	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	133.2	-174.9	-179.3	0	0	0	0	111.1	R167 R220 D227	R167-S218 PolarHBondContact N-O 2.77Å; R167-S218 PolarHBondContact O-N 2.75Å; S218-R220 VanDerWaalsContact C-N 3.32Å; S218-R220 WeakPolarHBondContact OG-CA 3.2Å; S218-R220 PolarHBondContact OG-N 3.18Å; S218-D227 WeakPolarHBondContact CA-OD1 3.26Å; S218-D227 VanDerWaalsContact CB-CG 3.42Å; S218-D227 WeakPolarHBondContact CB-OD1 3.22Å; S218-D227 WeakPolarHBondContact CB-OD2 3.31Å; S218-D227 PolarHBondContact OG-OD1 2.78Å; S218-D227 PolarHBondContact OG-OD2 2.96Å
219	V	91.4	Very high	91.4	Very high	5 Å²	5	48.7 Å²	48.7	3%	0.03	26%	0.263	C	S	.	.			trans	-99.5	26.5	162	-64.3	0	0	0	0	111.2	L130 P164 N221 V222 I225	L130-V219 HydrophobicContact CB-CG1 4.36Å; L130-V219 HydrophobicContact CD1-CG1 4.42Å; L130-V219 HydrophobicContact CD2-CG1 4.39Å; L130-V219 HydrophobicContact CD2-CG2 4.37Å; P164-V219 HydrophobicContact CG-CB 4.2Å; P164-V219 HydrophobicContact CG-CG1 4.35Å; V219-N221 VanDerWaalsContact C-N 3.28Å; V219-N221 PolarHBondContact O-N 3.2Å; V219-V222 VanDerWaalsContact O-CB 3.25Å; V219-V222 WeakPolarHBondContact O-CB 3.39Å; V219-V222 WeakPolarHBondContact O-CG2 3.24Å; V219-V222 PolarHBondContact O-N 3.38Å; V219-I225 HydrophobicContact CG2-CB 3.63Å; V219-I225 HydrophobicContact CG2-CD1 4.34Å; V219-I225 HydrophobicContact CG2-CG2 3.58Å
220	R	87.9	Confident	91.7	Very high	172 Å²	172	50.6 Å²	50.6	65%	0.649	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	33	-179.6	-63.6	175.8	154.3	-172.7	-8.3	114.5	S218 V222	S218-R220 VanDerWaalsContact C-N 3.32Å; S218-R220 WeakPolarHBondContact OG-CA 3.2Å; S218-R220 PolarHBondContact OG-N 3.18Å; R220-V222 HydrophobicContact CB-CG2 4.44Å; R220-V222 PolarHBondContact O-N 2.03Å; R220-V222 VanDerWaalsContact O-N 3.08Å
221	N	85.9	Confident	91.8	Very high	101 Å²	101	52.1 Å²	52.1	54%	0.54	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	20.1	-172.2	-164.9	47	0	0	0	114.5	V219 C223 G224 I225	V219-N221 VanDerWaalsContact C-N 3.28Å; V219-N221 PolarHBondContact O-N 3.2Å; N221-C223 PolarHBondContact O-N 2.82Å; N221-G224 PolarHBondContact O-N 2.97Å; N221-G224 VanDerWaalsContact O-N 3.09Å; N221-I225 WeakPolarHBondContact CA-O 2.99Å
222	V	83.9	Confident	91.9	Very high	60 Å²	60	51.7 Å²	51.7	36%	0.364	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-58.8	135.3	172	173.7	0	0	0	0	108.3	Y128 P164 V219 R220 G224 I225	Y128-V222 HydrophobicContact CD2-CG1 3.86Å; Y128-V222 HydrophobicContact CE2-CG1 3.59Å; P164-V222 HydrophobicContact CG-CG1 4.44Å; V219-V222 VanDerWaalsContact O-CB 3.25Å; V219-V222 WeakPolarHBondContact O-CB 3.39Å; V219-V222 WeakPolarHBondContact O-CG2 3.24Å; V219-V222 PolarHBondContact O-N 3.38Å; R220-V222 HydrophobicContact CB-CG2 4.44Å; R220-V222 PolarHBondContact O-N 2.03Å; R220-V222 VanDerWaalsContact O-N 3.08Å; V222-G224 PolarHBondContact O-N 2.97Å; V222-I225 WeakPolarHBondContact O-CB 3.48Å; V222-I225 PolarHBondContact O-N 2.63Å
223	C	82.9	Confident	91.9	Very high	17 Å²	17	48.4 Å²	48.4	12%	0.115	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	59.3	24.6	-176.9	-159.2	0	0	0	0	114.4	C37 R52 Y128 N221 I225	C37-C223 HydrophobicContact CB-CB 3.4Å; C37-C223 VanDerWaalsContact CB-CB 3.4Å; C37-C223 WeakPolarHBondContact CB-SG 3.5Å; C37-C223 WeakPolarHBondContact SG-CA 3.49Å; C37-C223 WeakPolarHBondContact SG-CB 3.2Å; C37-C223 CovalentContact SG-SG 2.03Å; C37-C223 PolarHBondContact SG-SG 2.9Å; R52-C223 PolarHBondContact N-SG 3.25Å; R52-C223 VanDerWaalsContact N-SG 3.38Å; Y128-C223 HydrophobicContact CD2-CB 3.99Å; N221-C223 PolarHBondContact O-N 2.82Å; C223-I225 HydrophobicContact CB-CD1 4.17Å; C223-I225 HydrophobicContact CB-CG1 4.3Å; C223-I225 PolarHBondContact O-N 3.28Å
224	G	85.6	Confident	91.8	Very high	37 Å²	37	48.6 Å²	48.6	38%	0.381	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	63.1	27.3	-179.2	0	0	0	0	0	113.4	R52 N221 V222 P226	R52-G224 PolarHBondContact NH1-O 2.66Å; N221-G224 PolarHBondContact O-N 2.97Å; N221-G224 VanDerWaalsContact O-N 3.09Å; V222-G224 PolarHBondContact O-N 2.97Å; G224-P226 WeakPolarHBondContact O-CD 3.23Å
225	I	89.6	Confident	91.7	Very high	9 Å²	9	50.2 Å²	50.2	5%	0.046	28%	0.28	C	S	.	.			trans	-88	110.8	178.1	-62.9	171.5	0	0	0	108.2	R52 L130 V219 N221 V222 C223	R52-I225 HydrophobicContact CG-CD1 4.29Å; R52-I225 HydrophobicContact CG-CG1 4Å; L130-I225 HydrophobicContact CB-CG2 3.61Å; L130-I225 HydrophobicContact CD2-CG2 4.35Å; V219-I225 HydrophobicContact CG2-CB 3.63Å; V219-I225 HydrophobicContact CG2-CD1 4.34Å; V219-I225 HydrophobicContact CG2-CG2 3.58Å; N221-I225 WeakPolarHBondContact CA-O 2.99Å; V222-I225 WeakPolarHBondContact O-CB 3.48Å; V222-I225 PolarHBondContact O-N 2.63Å; C223-I225 HydrophobicContact CB-CD1 4.17Å; C223-I225 HydrophobicContact CB-CG1 4.3Å; C223-I225 PolarHBondContact O-N 3.28Å
226	P	92.1	Very high	91.4	Very high	73 Å²	73	55.8 Å²	55.8	47%	0.474	31%	0.31	S	S	.	.			trans	-70.5	148.4	-177.2	30.3	-35.8	0	0	0	111.5	G224	G224-P226 WeakPolarHBondContact O-CD 3.23Å
227	D	94.3	Very high	91.2	Very high	82 Å²	82	61.1 Å²	61.1	44%	0.439	33%	0.331	S	S	.	.			trans	-57.4	142.8	173.9	-71.5	2.2	0	0	0	111.3	I216 A217 S218	I216-D227 HydrophobicContact CG2-CB 4.04Å; A217-D227 WeakPolarHBondContact O-CA 3.12Å; S218-D227 WeakPolarHBondContact CA-OD1 3.26Å; S218-D227 VanDerWaalsContact CB-CG 3.42Å; S218-D227 WeakPolarHBondContact CB-OD1 3.22Å; S218-D227 WeakPolarHBondContact CB-OD2 3.31Å; S218-D227 PolarHBondContact OG-OD1 2.78Å; S218-D227 PolarHBondContact OG-OD2 2.96Å
228	R	94.8	Very high	91.1	Very high	105 Å²	105	61.5 Å²	61.5	40%	0.396	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	139.4	178.8	-62.5	-62.3	-167.7	163.1	-0.6	109.5	L130 N132 P133 I216 A217	L130-R228 HydrophobicContact CD2-CB 4.29Å; L130-R228 HydrophobicContact CD2-CG 3.89Å; L130-R228 HydrophobicContact CG-CG 3.94Å; N132-R228 WeakPolarHBondContact OD1-CD 3.35Å; P133-R228 VanDerWaalsContact CD-CB 3.41Å; P133-R228 HydrophobicContact CG-CB 4.2Å; I216-R228 CarbonylContact C-O 3.44Å; I216-R228 WeakPolarHBondContact CA-O 3.42Å; A217-R228 PolarHBondContact N-O 3.03Å; A217-R228 PolarHBondContact O-N 2.95Å
229	S	94.4	Very high	91.1	Very high	81 Å²	81	62.3 Å²	62.3	57%	0.566	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.5	153.1	179.5	62.5	0	0	0	0	112.9	C215	C215-S229 VanDerWaalsContact O-CA 3.24Å; C215-S229 WeakPolarHBondContact O-CA 3.47Å
230	V	95.2	Very high	91.2	Very high	40 Å²	40	64.8 Å²	64.8	24%	0.242	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	143.9	177.1	62.6	0	0	0	0	108.7	P133 I135 S214 C215	P133-V230 HydrophobicContact CB-CG1 3.8Å; P133-V230 HydrophobicContact CG-CB 4.12Å; P133-V230 HydrophobicContact CG-CG1 3.75Å; P133-V230 WeakPolarHBondContact O-CB 3.28Å; P133-V230 WeakPolarHBondContact O-CG1 3.43Å; I135-V230 HydrophobicContact CD1-CG1 3.78Å; I135-V230 HydrophobicContact CG1-CG1 3.7Å; S214-V230 WeakPolarHBondContact CA-O 3.48Å; C215-V230 HydrophobicContact CB-CG1 4.04Å; C215-V230 PolarHBondContact N-O 3.29Å; C215-V230 PolarHBondContact O-N 3.3Å
231	I	94.8	Very high	91.6	Very high	111 Å²	111	56.9 Å²	56.9	57%	0.569	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.8	132.4	-175.2	-50.8	-177.5	0	0	0	109.2	N212 Y213	N212-I231 HydrophobicContact CB-CG2 4Å; Y213-I231 WeakPolarHBondContact O-CA 3.38Å
232	F	94.6	Very high	92	Very high	16 Å²	16	54.7 Å²	54.7	7%	0.07	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.1	171.8	-172.7	-81.7	0	0	0	110.3	I135 V137 L156 Y213 L234 T238 P270 V315	I135-F232 HydrophobicContact CB-CB 4.28Å; I135-F232 HydrophobicContact CD1-CB 3.92Å; I135-F232 HydrophobicContact CG2-CB 3.89Å; I135-F232 HydrophobicContact CG2-CD2 4.27Å; I135-F232 HydrophobicContact CG2-CG 4.16Å; V137-F232 HydrophobicContact CB-CE1 4.4Å; V137-F232 HydrophobicContact CB-CZ 4.24Å; V137-F232 HydrophobicContact CG2-CD1 3.76Å; V137-F232 HydrophobicContact CG2-CD2 3.91Å; V137-F232 HydrophobicContact CG2-CE1 3.69Å; V137-F232 HydrophobicContact CG2-CE2 3.82Å; V137-F232 HydrophobicContact CG2-CG 3.89Å; V137-F232 HydrophobicContact CG2-CZ 3.72Å; L156-F232 HydrophobicContact CD2-CD1 4.46Å; Y213-F232 PolarHBondContact N-O 3.42Å; Y213-F232 PolarHBondContact O-N 2.84Å; F232-L234 HydrophobicContact CD1-CB 4.38Å; F232-L234 HydrophobicContact CE1-CB 4.39Å; F232-L234 HydrophobicContact CE1-CD1 4.35Å; F232-L234 PolarHBondContact O-N 3.03Å; F232-T238 HydrophobicContact CE1-CG2 3.92Å; F232-T238 HydrophobicContact CZ-CG2 3.77Å; F232-P270 HydrophobicContact CE2-CG 4.4Å; F232-V315 HydrophobicContact CE2-CG2 3.97Å; F232-V315 HydrophobicContact CZ-CG2 3.68Å
233	G	93.9	Very high	92.6	Very high	31 Å²	31	52.6 Å²	52.6	32%	0.32	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	103.1	174.8	0	0	0	0	0	111.5	N212	N212-G233 WeakPolarHBondContact OD1-CA 3.25Å
234	L	93.9	Very high	93.1	Very high	4 Å²	4	57.6 Å²	57.6	2%	0.021	33%	0.329	C	S	.	.			trans	-84.4	118.5	176.1	-175.6	59.9	0	0	0	109.9	V137 V154 L156 L202 L205 Y210 A211 Y213 F232 T238	V137-L234 HydrophobicContact CG1-CD1 4.47Å; V154-L234 HydrophobicContact CG1-CD1 4.3Å; V154-L234 HydrophobicContact CG1-CD2 4.07Å; L156-L234 HydrophobicContact CD1-CD2 4.48Å; L202-L234 HydrophobicContact CD1-CD2 3.77Å; L205-L234 HydrophobicContact CD1-CD2 4.29Å; Y210-L234 CarbonylContact C-O 3.25Å; Y210-L234 VanDerWaalsContact C-O 3.25Å; Y210-L234 WeakPolarHBondContact CA-O 3.04Å; Y210-L234 WeakPolarHBondContact CB-O 3.29Å; Y210-L234 HydrophobicContact CD1-CG 4.32Å; A211-L234 PolarHBondContact N-O 3.31Å; A211-L234 VanDerWaalsContact N-O 3.15Å; A211-L234 PolarHBondContact O-N 2.69Å; Y213-L234 HydrophobicContact CD2-CB 3.93Å; Y213-L234 HydrophobicContact CD2-CD2 4.43Å; Y213-L234 HydrophobicContact CE2-CB 3.98Å; Y213-L234 HydrophobicContact CE2-CD2 3.94Å; F232-L234 HydrophobicContact CD1-CB 4.38Å; F232-L234 HydrophobicContact CE1-CB 4.39Å; F232-L234 HydrophobicContact CE1-CD1 4.35Å; F232-L234 PolarHBondContact O-N 3.03Å; L234-T238 HydrophobicContact CD1-CG2 4.01Å
235	T	92.4	Very high	93.6	Very high	51 Å²	51	57 Å²	57	31%	0.313	32%	0.317	S	S	.	.			trans	-125.9	166	-179	74.4	0	0	0	0	110.9	Y210 K237 T238	Y210-T235 VanDerWaalsContact CE1-C 3.45Å; Y210-T235 WeakPolarHBondContact CE1-O 3.25Å; T235-K237 PolarHBondContact O-N 3.09Å; T235-K237 PolarHBondContact OG1-N 2.8Å; T235-T238 PolarHBondContact N-OG1 2.76Å; T235-T238 WeakPolarHBondContact O-CB 3.18Å; T235-T238 PolarHBondContact O-N 2.96Å; T235-T238 VanDerWaalsContact O-N 3.14Å; T235-T238 PolarHBondContact O-OG1 3.06Å; T235-T238 PolarHBondContact OG1-N 3.19Å; T235-T238 PolarHBondContact OG1-OG1 2.62Å; T235-T238 VanDerWaalsContact OG1-OG1 3.12Å
236	N	89.6	Confident	93.8	Very high	118 Å²	118	60.5 Å²	60.5	63%	0.631	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-9	173.1	68.1	-17.6	0	0	0	113.9	Y210	Y210-N236 HydrophobicContact CD1-CB 4.44Å; Y210-N236 VanDerWaalsContact CD1-N 3.34Å; Y210-N236 HydrophobicContact CD2-CB 4.45Å; Y210-N236 VanDerWaalsContact CE1-CA 3.47Å; Y210-N236 HydrophobicContact CE1-CB 3.98Å; Y210-N236 HydrophobicContact CE2-CB 4.01Å
237	K	90.7	Very high	93.7	Very high	151 Å²	151	59.1 Å²	59.1	66%	0.657	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-17.8	172.9	-63.9	-177.6	-177.4	178.9	0	113.3	T235 A239 E269	T235-K237 PolarHBondContact O-N 3.09Å; T235-K237 PolarHBondContact OG1-N 2.8Å; K237-A239 WeakPolarHBondContact O-CB 3.3Å; K237-A239 PolarHBondContact O-N 3.45Å; K237-E269 HydrophobicContact CB-CB 4.45Å; K237-E269 HydrophobicContact CB-CG 4.02Å; K237-E269 WeakPolarHBondContact O-CB 3.45Å
238	T	93.1	Very high	93.3	Very high	8 Å²	8	63.3 Å²	63.3	5%	0.049	34%	0.342	C	S	.	.			trans	-53.2	120.8	-173.6	-64.4	0	0	0	0	110.6	Q139 F232 L234 T235 E269 V315	Q139-T238 PolarHBondContact NE2-O 2.69Å; F232-T238 HydrophobicContact CE1-CG2 3.92Å; F232-T238 HydrophobicContact CZ-CG2 3.77Å; L234-T238 HydrophobicContact CD1-CG2 4.01Å; T235-T238 PolarHBondContact N-OG1 2.76Å; T235-T238 WeakPolarHBondContact O-CB 3.18Å; T235-T238 PolarHBondContact O-N 2.96Å; T235-T238 VanDerWaalsContact O-N 3.14Å; T235-T238 PolarHBondContact O-OG1 3.06Å; T235-T238 PolarHBondContact OG1-N 3.19Å; T235-T238 PolarHBondContact OG1-OG1 2.62Å; T235-T238 VanDerWaalsContact OG1-OG1 3.12Å; T238-E269 WeakPolarHBondContact CA-O 3.49Å; T238-V315 HydrophobicContact CG2-CG1 4.02Å; T238-V315 HydrophobicContact CG2-CG2 3.92Å
239	A	92	Very high	93	Very high	37 Å²	37	63.1 Å²	63.1	31%	0.306	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	146.9	-169.1	0	0	0	0	0	111.4	K237 G268 E269 N313	K237-A239 WeakPolarHBondContact O-CB 3.3Å; K237-A239 PolarHBondContact O-N 3.45Å; A239-G268 WeakPolarHBondContact O-CA 3.42Å; A239-E269 PolarHBondContact N-O 3.2Å; A239-E269 PolarHBondContact O-N 2.74Å; A239-N313 PolarHBondContact O-ND2 3.04Å
240	S	93.3	Very high	92.9	Very high	56 Å²	56	62.9 Å²	62.9	39%	0.392	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	151.3	172	52.4	0	0	0	0	111.6	G268 V315	S240-G268 WeakPolarHBondContact O-CA 3.35Å; S240-V315 VanDerWaalsContact CA-O 3.3Å; S240-V315 WeakPolarHBondContact CA-O 3.21Å; S240-V315 WeakPolarHBondContact CB-O 3.49Å
241	P	95.7	Very high	92.8	Very high	7 Å²	7	62.1 Å²	62.1	5%	0.045	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	152.4	-178.1	26.9	-34	0	0	0	111.5	P272 A311 N313 V315 A319	P241-P272 HydrophobicContact CB-CB 3.84Å; P241-P272 HydrophobicContact CB-CG 4.01Å; P241-A311 HydrophobicContact CB-CB 3.95Å; P241-A311 VanDerWaalsContact CG-O 3.27Å; P241-A311 WeakPolarHBondContact CG-O 3.42Å; P241-N313 WeakPolarHBondContact CD-OD1 3.48Å; P241-V315 WeakPolarHBondContact CD-O 3.48Å; P241-A319 HydrophobicContact CB-CB 4.03Å; P241-A319 HydrophobicContact CG-CB 3.93Å
242	S	94.6	Very high	92.7	Very high	55 Å²	55	59 Å²	59	39%	0.385	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	132.8	170.8	-73.6	0	0	0	0	108.7	T266 G267	S242-T266 VanDerWaalsContact C-OG1 3.28Å; S242-T266 PolarHBondContact O-N 3.06Å; S242-T266 PolarHBondContact O-OG1 3.36Å; S242-G267 PolarHBondContact N-O 3.45Å; S242-G267 PolarHBondContact O-N 3.34Å; S242-G267 VanDerWaalsContact O-N 3.17Å
243	I	96.2	Very high	92.6	Very high	16 Å²	16	59.3 Å²	59.3	8%	0.082	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	149.7	-177.4	51.7	171.7	0	0	0	111.4	I264 T265 T266 L274 C309 A311 A319 K321	I243-I264 CarbonylContact C-O 3.56Å; I243-I264 VanDerWaalsContact CA-O 3.23Å; I243-I264 WeakPolarHBondContact CA-O 3.44Å; I243-I264 WeakPolarHBondContact CB-O 3.39Å; I243-T265 HydrophobicContact CG2-CG2 4.44Å; I243-T266 PolarHBondContact N-OG1 2.76Å; I243-L274 HydrophobicContact CG2-CD2 3.69Å; I243-C309 HydrophobicContact CD1-CB 4.23Å; I243-A311 HydrophobicContact CD1-CB 4.34Å; I243-A311 HydrophobicContact CG2-CB 3.51Å; I243-A319 HydrophobicContact CD1-CB 4.42Å; I243-A319 WeakPolarHBondContact CD1-O 3.28Å; I243-A319 HydrophobicContact CG1-CB 3.97Å; I243-K321 HydrophobicContact CD1-CB 3.97Å; I243-K321 HydrophobicContact CD1-CG 4.06Å; I243-K321 HydrophobicContact CG1-CB 4.38Å; I243-K321 HydrophobicContact CG1-CG 3.93Å
244	K	94.9	Very high	92.5	Very high	121 Å²	121	58.9 Å²	58.9	53%	0.526	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	131	166	-174.3	179.3	178.6	-172.1	0	108.7	L246 I264 T266	K244-L246 HydrophobicContact CD-CD2 3.68Å; K244-L246 HydrophobicContact CG-CD2 3.89Å; K244-I264 HydrophobicContact CB-CG1 4.12Å; K244-I264 PolarHBondContact N-O 3.33Å; K244-I264 WeakPolarHBondContact O-CG1 3.41Å; K244-I264 PolarHBondContact O-N 3.4Å; K244-T266 HydrophobicContact CB-CG2 3.66Å
245	L	94.8	Very high	92.5	Very high	26 Å²	26	62 Å²	62	14%	0.136	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	134.5	167.7	-169.7	66.2	0	0	0	108.1	V247 C263 W276 K321 T323	L245-V247 HydrophobicContact CD2-CG2 3.58Å; L245-V247 HydrophobicContact CG-CG2 3.67Å; L245-C263 HydrophobicContact CD1-CB 3.98Å; L245-W276 HydrophobicContact CD1-CH2 3.53Å; L245-W276 HydrophobicContact CD1-CZ2 3.81Å; L245-K321 HydrophobicContact CB-CB 4.22Å; L245-T323 HydrophobicContact CD2-CG2 3.83Å
246	L	93.6	Very high	92.4	Very high	81 Å²	81	62 Å²	62	42%	0.424	35%	0.35	S	S	.	.			trans	-108.8	60.3	-174.2	-58.4	179.9	0	0	0	110.7	K244 V262 I264	K244-L246 HydrophobicContact CD-CD2 3.68Å; K244-L246 HydrophobicContact CG-CD2 3.89Å; L246-V262 HydrophobicContact CB-CB 4.24Å; L246-V262 HydrophobicContact CB-CG1 4.49Å; L246-V262 HydrophobicContact CD1-CG1 4.07Å; L246-V262 PolarHBondContact N-O 3Å; L246-I264 HydrophobicContact CD1-CD1 3.99Å; L246-I264 HydrophobicContact CD1-CG1 4.13Å; L246-I264 HydrophobicContact CD1-CG2 4.13Å; L246-I264 HydrophobicContact CD2-CD1 4.37Å; L246-I264 HydrophobicContact CG-CD1 4.38Å; L246-I264 HydrophobicContact CG-CG1 4.23Å
247	V	90.8	Very high	92.6	Very high	44 Å²	44	60.7 Å²	60.7	27%	0.267	34%	0.34	S	S	.	.	S	Bend	trans	-142.4	162.7	178.7	-56.3	0	0	0	0	110.1	L245 I251 L261 T323	L245-V247 HydrophobicContact CD2-CG2 3.58Å; L245-V247 HydrophobicContact CG-CG2 3.67Å; V247-I251 HydrophobicContact CB-CD1 3.92Å; V247-I251 HydrophobicContact CG1-CD1 4.27Å; V247-I251 HydrophobicContact CG2-CD1 3.99Å; V247-L261 HydrophobicContact CG1-CB 4.45Å; V247-L261 HydrophobicContact CG1-CD2 4.04Å; V247-T323 HydrophobicContact CG2-CG2 4.06Å
248	E	86.3	Confident	92.8	Very high	170 Å²	170	57.7 Å²	57.7	79%	0.794	34%	0.335	S	S	*	.			trans	-77	156.2	165	-64.6	171.4	179.9	0	0	109.7	I251	E248-I251 WeakPolarHBondContact O-CG1 3.45Å
249	D	89	Confident	92.9	Very high	101 Å²	101	57.7 Å²	57.7	54%	0.54	34%	0.335	S	S	.	.	S	Bend	trans	-142.1	124.1	-179.5	-167.2	40.4	0	0	0	110.3	T323 T324	D249-T323 WeakPolarHBondContact OD1-CA 3.4Å; D249-T323 VanDerWaalsContact OD1-CB 3.29Å; D249-T323 WeakPolarHBondContact OD1-CB 3.1Å; D249-T323 PolarHBondContact OD1-OG1 2.71Å; D249-T324 PolarHBondContact OD1-N 3.14Å
250	P	91	Very high	93	Very high	76 Å²	76	58.8 Å²	58.8	49%	0.494	34%	0.34	S	S	.	.	S	Bend	cis	-72.6	158.2	-4.7	32.9	-36.6	0	0	0	113.3	V252 T324 V326	P250-V252 HydrophobicContact CG-CG2 4.43Å; P250-T324 WeakPolarHBondContact CA-O 3.3Å; P250-V326 HydrophobicContact CB-CG2 4.09Å
251	I	93.2	Very high	93.1	Very high	24 Å²	24	56.1 Å²	56.1	12%	0.123	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	108.5	175	-59.9	174.1	0	0	0	108.9	V247 E248 V253 V259 L261 T323 T324 I325 V326	V247-I251 HydrophobicContact CB-CD1 3.92Å; V247-I251 HydrophobicContact CG1-CD1 4.27Å; V247-I251 HydrophobicContact CG2-CD1 3.99Å; E248-I251 WeakPolarHBondContact O-CG1 3.45Å; I251-V253 HydrophobicContact CG2-CG1 3.82Å; I251-V259 HydrophobicContact CD1-CG1 4.45Å; I251-V259 HydrophobicContact CG2-CG1 4.31Å; I251-L261 HydrophobicContact CD1-CD2 3.28Å; I251-T323 HydrophobicContact CD1-CG2 4.05Å; I251-T324 PolarHBondContact N-O 3.45Å; I251-I325 HydrophobicContact CB-CG1 4.47Å; I251-I325 HydrophobicContact CD1-CG1 4.44Å; I251-V326 PolarHBondContact O-N 3.14Å
252	V	92.4	Very high	93.1	Very high	47 Å²	47	58.1 Å²	58.1	29%	0.285	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	104.9	-178.7	-163.8	0	0	0	0	111.8	P250 V326 R328 P365	P250-V252 HydrophobicContact CG-CG2 4.43Å; V252-V326 WeakPolarHBondContact CA-O 3.42Å; V252-V326 HydrophobicContact CG1-CB 4.42Å; V252-V326 HydrophobicContact CG1-CG1 4.26Å; V252-V326 HydrophobicContact CG2-CB 4.31Å; V252-R328 HydrophobicContact CG1-CG 3.97Å; V252-R328 PolarHBondContact O-NH1 2.99Å; V252-P365 HydrophobicContact CG1-CG 4.07Å
253	V	93.3	Very high	93.2	Very high	21 Å²	21	55.5 Å²	55.5	13%	0.127	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	160	-171.3	-74.6	0	0	0	0	112.9	I251 V259 I299 I325 V326 V327 R328	I251-V253 HydrophobicContact CG2-CG1 3.82Å; V253-V259 HydrophobicContact CG1-CG2 4.27Å; V253-V259 HydrophobicContact CG2-CG2 3.95Å; V253-I299 HydrophobicContact CG2-CG2 4.16Å; V253-I325 HydrophobicContact CG2-CG2 3.85Å; V253-V326 PolarHBondContact N-O 3.03Å; V253-V327 HydrophobicContact CG2-CG2 4.22Å; V253-V327 CarbonylContact O-C 3.58Å; V253-V327 WeakPolarHBondContact O-CA 3.5Å; V253-R328 PolarHBondContact O-N 2.81Å
254	N	92.7	Very high	93.1	Very high	23 Å²	23	58 Å²	58	12%	0.123	33%	0.328	C	S	.	.			trans	-93.6	148	177.2	-66.6	6.9	0	0	0	110.3	Q257 R328 G424	N254-Q257 HydrophobicContact CB-CG 4.29Å; N254-Q257 VanDerWaalsContact O-CB 3.28Å; N254-Q257 WeakPolarHBondContact O-CB 3.35Å; N254-Q257 WeakPolarHBondContact O-CG 3.4Å; N254-Q257 PolarHBondContact O-N 2.83Å; N254-Q257 VanDerWaalsContact O-N 3.15Å; N254-R328 VanDerWaalsContact OD1-CD 3.27Å; N254-R328 WeakPolarHBondContact OD1-CD 3.4Å; N254-R328 PolarHBondContact OD1-NH1 2.82Å; N254-G424 PolarHBondContact ND2-O 3.06Å
255	P	92.5	Very high	93.1	Very high	68 Å²	68	55.7 Å²	55.7	44%	0.442	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	143.3	179.9	26.5	-34.3	0	0	0	110.9	Q257 I299 V327 I426	P255-Q257 VanDerWaalsContact C-N 3.28Å; P255-Q257 PolarHBondContact O-N 2.93Å; P255-I299 CarbonylContact C-O 3.51Å; P255-I299 WeakPolarHBondContact CA-O 3.46Å; P255-V327 HydrophobicContact CB-CG1 4.09Å; P255-I426 HydrophobicContact CG-CD1 3.81Å
256	G	91.6	Very high	93.1	Very high	51 Å²	51	58.5 Å²	58.5	53%	0.526	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	-5.1	-173.3	0	0	0	0	0	115.1	A298 I299	G256-A298 WeakPolarHBondContact O-CA 3.45Å; G256-I299 PolarHBondContact N-O 2.95Å
257	Q	93.6	Very high	93	Very high	91 Å²	91	56 Å²	56	43%	0.425	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-75.9	157.3	168.8	-66.6	-177	-32.5	0	0	111.8	N254 P255 A298 I299	N254-Q257 HydrophobicContact CB-CG 4.29Å; N254-Q257 VanDerWaalsContact O-CB 3.28Å; N254-Q257 WeakPolarHBondContact O-CB 3.35Å; N254-Q257 WeakPolarHBondContact O-CG 3.4Å; N254-Q257 PolarHBondContact O-N 2.83Å; N254-Q257 VanDerWaalsContact O-N 3.15Å; P255-Q257 VanDerWaalsContact C-N 3.28Å; P255-Q257 PolarHBondContact O-N 2.93Å; Q257-A298 CarbonylContact O-C 3.57Å; Q257-A298 VanDerWaalsContact O-CA 3.26Å; Q257-A298 WeakPolarHBondContact O-CA 3.44Å; Q257-A298 PolarHBondContact O-N 2.92Å; Q257-I299 PolarHBondContact O-N 3.44Å
258	T	94.5	Very high	93.1	Very high	88 Å²	88	55 Å²	55	54%	0.54	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-100.1	121	175.2	-65.9	0	0	0	0	109.9	T295 L296 A298	T258-T295 HydrophobicContact CG2-CG2 3.65Å; T258-L296 WeakPolarHBondContact CA-O 3.39Å; T258-A298 PolarHBondContact OG1-N 2.75Å
259	V	95	Very high	93.3	Very high	9 Å²	9	50.1 Å²	50.1	6%	0.055	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	143.9	175.9	-169.6	0	0	0	0	109.3	I251 V253 L261 T295 L296 I299 I325	I251-V259 HydrophobicContact CD1-CG1 4.45Å; I251-V259 HydrophobicContact CG2-CG1 4.31Å; V253-V259 HydrophobicContact CG1-CG2 4.27Å; V253-V259 HydrophobicContact CG2-CG2 3.95Å; V259-L261 HydrophobicContact CG1-CD2 3.73Å; V259-L261 HydrophobicContact CG1-CG 4.45Å; V259-T295 CarbonylContact O-C 3.43Å; V259-T295 WeakPolarHBondContact O-CA 3.42Å; V259-L296 HydrophobicContact CB-CB 4.38Å; V259-L296 PolarHBondContact N-O 3.13Å; V259-L296 PolarHBondContact O-N 2.75Å; V259-I299 HydrophobicContact CG2-CB 4.49Å; V259-I299 HydrophobicContact CG2-CD1 3.95Å; V259-I299 HydrophobicContact CG2-CG2 4.28Å; V259-I325 HydrophobicContact CB-CD1 4.45Å; V259-I325 HydrophobicContact CG1-CD1 3.97Å
260	S	94.6	Very high	93.6	Very high	59 Å²	59	47.7 Å²	47.7	41%	0.413	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	115.9	171.1	-68.7	0	0	0	0	111.1	L294 T295	S260-L294 CarbonylContact C-O 3.58Å; S260-L294 WeakPolarHBondContact CA-O 3.36Å; S260-T295 PolarHBondContact OG-OG1 3.14Å
261	L	95.1	Very high	93.7	Very high	0 Å²	0	49 Å²	49	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	111	-179.6	-48.6	-174.6	0	0	0	109.5	V247 I251 V259 W276 T293 L294 Y307 T323 I325	V247-L261 HydrophobicContact CG1-CB 4.45Å; V247-L261 HydrophobicContact CG1-CD2 4.04Å; I251-L261 HydrophobicContact CD1-CD2 3.28Å; V259-L261 HydrophobicContact CG1-CD2 3.73Å; V259-L261 HydrophobicContact CG1-CG 4.45Å; L261-W276 HydrophobicContact CB-CH2 3.44Å; L261-W276 VanDerWaalsContact CB-CH2 3.44Å; L261-W276 HydrophobicContact CB-CZ2 3.58Å; L261-W276 HydrophobicContact CB-CZ3 4.3Å; L261-W276 HydrophobicContact CD1-CE3 4.42Å; L261-W276 HydrophobicContact CD1-CH2 3.54Å; L261-W276 HydrophobicContact CD1-CZ2 4.38Å; L261-W276 HydrophobicContact CD1-CZ3 3.57Å; L261-W276 HydrophobicContact CG-CH2 4.16Å; L261-T293 CarbonylContact O-C 3.49Å; L261-T293 VanDerWaalsContact O-CA 3.3Å; L261-T293 WeakPolarHBondContact O-CA 3.47Å; L261-L294 HydrophobicContact CB-CB 4.45Å; L261-L294 HydrophobicContact CD1-CD2 4.26Å; L261-L294 PolarHBondContact N-O 3.48Å; L261-L294 PolarHBondContact O-N 3.49Å; L261-Y307 HydrophobicContact CD1-CG 4.21Å; L261-T323 HydrophobicContact CD1-CG2 3.96Å; L261-T323 HydrophobicContact CD2-CG2 4.12Å; L261-I325 HydrophobicContact CD1-CD1 4.24Å; L261-I325 HydrophobicContact CD2-CD1 4.33Å
262	V	95.5	Very high	93.7	Very high	49 Å²	49	48.6 Å²	48.6	30%	0.297	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	109.2	-178.2	-178.6	0	0	0	0	110	L246 I264 T293	L246-V262 HydrophobicContact CB-CB 4.24Å; L246-V262 HydrophobicContact CB-CG1 4.49Å; L246-V262 HydrophobicContact CD1-CG1 4.07Å; L246-V262 PolarHBondContact N-O 3Å; V262-I264 HydrophobicContact CG1-CG2 4.23Å; V262-T293 HydrophobicContact CG2-CG2 3.93Å
263	C	95.9	Very high	93.8	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.007	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	129.5	173	-173.4	0	0	0	0	110.8	L245 W276 G292 C309	L245-C263 HydrophobicContact CD1-CB 3.98Å; C263-W276 HydrophobicContact CB-CZ2 3.81Å; C263-G292 WeakPolarHBondContact CB-O 3.36Å; C263-G292 PolarHBondContact N-O 2.91Å; C263-G292 VanDerWaalsContact N-O 3.16Å; C263-C309 HydrophobicContact CB-CB 3.59Å; C263-C309 WeakPolarHBondContact CB-SG 3Å; C263-C309 WeakPolarHBondContact SG-CB 3.3Å; C263-C309 CovalentContact SG-SG 2.03Å; C263-C309 PolarHBondContact SG-SG 2.92Å
264	I	95.1	Very high	93.9	Very high	68 Å²	68	53.4 Å²	53.4	35%	0.349	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	145.2	178.3	60.3	161.4	0	0	0	112.2	I243 K244 L246 V262 T266	I243-I264 CarbonylContact C-O 3.56Å; I243-I264 VanDerWaalsContact CA-O 3.23Å; I243-I264 WeakPolarHBondContact CA-O 3.44Å; I243-I264 WeakPolarHBondContact CB-O 3.39Å; K244-I264 HydrophobicContact CB-CG1 4.12Å; K244-I264 PolarHBondContact N-O 3.33Å; K244-I264 WeakPolarHBondContact O-CG1 3.41Å; K244-I264 PolarHBondContact O-N 3.4Å; L246-I264 HydrophobicContact CD1-CD1 3.99Å; L246-I264 HydrophobicContact CD1-CG1 4.13Å; L246-I264 HydrophobicContact CD1-CG2 4.13Å; L246-I264 HydrophobicContact CD2-CD1 4.37Å; L246-I264 HydrophobicContact CG-CD1 4.38Å; L246-I264 HydrophobicContact CG-CG1 4.23Å; V262-I264 HydrophobicContact CG1-CG2 4.23Å; I264-T266 HydrophobicContact CD1-CG2 4.43Å
265	T	94.5	Very high	94	Very high	72 Å²	72	55.8 Å²	55.8	44%	0.442	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	119.3	169.7	52.8	0	0	0	0	110.4	I243 P272 L274	I243-T265 HydrophobicContact CG2-CG2 4.44Å; T265-P272 HydrophobicContact CG2-CG 3.77Å; T265-L274 HydrophobicContact CG2-CD1 4.21Å; T265-L274 HydrophobicContact CG2-CD2 3.8Å; T265-L274 HydrophobicContact CG2-CG 4.06Å
266	T	94.3	Very high	94.1	Very high	86 Å²	86	53.3 Å²	53.3	53%	0.528	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-12	173.3	53.2	0	0	0	0	113	S242 I243 K244 I264	S242-T266 VanDerWaalsContact C-OG1 3.28Å; S242-T266 PolarHBondContact O-N 3.06Å; S242-T266 PolarHBondContact O-OG1 3.36Å; I243-T266 PolarHBondContact N-OG1 2.76Å; K244-T266 HydrophobicContact CB-CG2 3.66Å; I264-T266 HydrophobicContact CD1-CG2 4.43Å
267	G	91.6	Very high	94.2	Very high	29 Å²	29	53.5 Å²	53.5	30%	0.299	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.5	177.1	175	0	0	0	0	0	112.9	S242	S242-G267 PolarHBondContact N-O 3.45Å; S242-G267 PolarHBondContact O-N 3.34Å; S242-G267 VanDerWaalsContact O-N 3.17Å
268	G	92.5	Very high	94.1	Very high	21 Å²	21	49.6 Å²	49.6	22%	0.216	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	117.8	132.1	-175.4	0	0	0	0	0	111.4	A239 S240 P270	A239-G268 WeakPolarHBondContact O-CA 3.42Å; S240-G268 WeakPolarHBondContact O-CA 3.35Å; G268-P270 CarbonylContact C-O 3.58Å
269	E	92.3	Very high	93.8	Very high	68 Å²	68	48.6 Å²	48.6	32%	0.318	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	120.9	177.9	177.7	75.1	149.7	0	0	108.3	K237 T238 A239 P271 N313	K237-E269 HydrophobicContact CB-CB 4.45Å; K237-E269 HydrophobicContact CB-CG 4.02Å; K237-E269 WeakPolarHBondContact O-CB 3.45Å; T238-E269 WeakPolarHBondContact CA-O 3.49Å; A239-E269 PolarHBondContact N-O 3.2Å; A239-E269 PolarHBondContact O-N 2.74Å; E269-P271 WeakPolarHBondContact OE2-CD 3.33Å; E269-N313 PolarHBondContact N-ND2 3.24Å
270	P	93.8	Very high	93.2	Very high	50 Å²	50	52.8 Å²	52.8	33%	0.325	32%	0.321	S	S	.	.	S	Bend	cis	-61.3	164.9	3	-23	34.9	0	0	0	114.4	F232 G268 P272 N313	F232-P270 HydrophobicContact CE2-CG 4.4Å; G268-P270 CarbonylContact C-O 3.58Å; P270-P272 WeakPolarHBondContact O-CD 3.37Å; P270-N313 WeakPolarHBondContact O-CB 3.49Å; P270-N313 PolarHBondContact O-ND2 2.84Å
271	P	93.5	Very high	92.4	Very high	103 Å²	103	57.4 Å²	57.4	67%	0.669	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-57.4	123.4	178.9	-26.3	36	0	0	0	111.6	E269	E269-P271 WeakPolarHBondContact OE2-CD 3.33Å
272	P	94.3	Very high	92	Very high	17 Å²	17	61.4 Å²	61.4	11%	0.11	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-79.9	143.5	-172.9	30	-33.8	0	0	0	113.3	P241 T265 P270 A311 S312 N313	P241-P272 HydrophobicContact CB-CB 3.84Å; P241-P272 HydrophobicContact CB-CG 4.01Å; T265-P272 HydrophobicContact CG2-CG 3.77Å; P270-P272 WeakPolarHBondContact O-CD 3.37Å; P272-A311 HydrophobicContact CB-CB 4.25Å; P272-S312 CarbonylContact C-O 3.05Å; P272-S312 WeakPolarHBondContact CA-O 3.26Å; P272-N313 HydrophobicContact CB-CB 3.95Å
273	I	94.3	Very high	91.7	Very high	128 Å²	128	61.3 Å²	61.3	66%	0.656	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	128.4	172.4	-59.3	173.7	0	0	0	108.1	T275 A311 S312	I273-T275 HydrophobicContact CG2-CG2 4.42Å; I273-A311 WeakPolarHBondContact O-CA 3.42Å; I273-S312 PolarHBondContact N-O 2.97Å; I273-S312 PolarHBondContact O-N 3.05Å; I273-S312 VanDerWaalsContact O-N 3.1Å
274	L	94.6	Very high	91.3	Very high	41 Å²	41	62.3 Å²	62.3	22%	0.215	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	129.2	173.2	-60.9	-176	0	0	0	110.6	I243 T265 V310 A311	I243-L274 HydrophobicContact CG2-CD2 3.69Å; T265-L274 HydrophobicContact CG2-CD1 4.21Å; T265-L274 HydrophobicContact CG2-CD2 3.8Å; T265-L274 HydrophobicContact CG2-CG 4.06Å; L274-V310 WeakPolarHBondContact CA-O 3.04Å; L274-A311 HydrophobicContact CD2-CB 3.6Å
275	T	94.6	Very high	91	Very high	72 Å²	72	68.8 Å²	68.8	44%	0.442	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	154.8	169.3	58.8	0	0	0	0	110.5	I273 V310	I273-T275 HydrophobicContact CG2-CG2 4.42Å; T275-V310 PolarHBondContact N-O 2.9Å; T275-V310 PolarHBondContact O-N 3.34Å
276	W	94.6	Very high	90.8	Very high	17 Å²	17	70 Å²	70	6%	0.064	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	133.5	177.5	-87.4	102.6	0	0	0	109.8	L245 L261 C263 L283 G292 L294 S308 C309	L245-W276 HydrophobicContact CD1-CH2 3.53Å; L245-W276 HydrophobicContact CD1-CZ2 3.81Å; L261-W276 HydrophobicContact CB-CH2 3.44Å; L261-W276 VanDerWaalsContact CB-CH2 3.44Å; L261-W276 HydrophobicContact CB-CZ2 3.58Å; L261-W276 HydrophobicContact CB-CZ3 4.3Å; L261-W276 HydrophobicContact CD1-CE3 4.42Å; L261-W276 HydrophobicContact CD1-CH2 3.54Å; L261-W276 HydrophobicContact CD1-CZ2 4.38Å; L261-W276 HydrophobicContact CD1-CZ3 3.57Å; L261-W276 HydrophobicContact CG-CH2 4.16Å; C263-W276 HydrophobicContact CB-CZ2 3.81Å; W276-L283 HydrophobicContact CB-CD1 3.91Å; W276-L283 HydrophobicContact CB-CD2 4.38Å; W276-G292 PolarHBondContact NE1-O 3.19Å; W276-L294 HydrophobicContact CB-CD2 4.14Å; W276-L294 HydrophobicContact CD2-CB 3.79Å; W276-L294 HydrophobicContact CD2-CD2 3.71Å; W276-L294 HydrophobicContact CD2-CG 4.4Å; W276-L294 HydrophobicContact CE3-CB 4.49Å; W276-L294 HydrophobicContact CE3-CD2 3.69Å; W276-L294 HydrophobicContact CG-CB 3.84Å; W276-L294 HydrophobicContact CG-CD2 3.94Å; W276-L294 HydrophobicContact CG-CG 4.47Å; W276-L294 HydrophobicContact CZ2-CB 4.24Å; W276-L294 HydrophobicContact CZ3-CD2 4.33Å; W276-S308 WeakPolarHBondContact CA-O 3.28Å; W276-S308 VanDerWaalsContact CZ3-C 3.49Å; W276-C309 HydrophobicContact CD2-CB 4.28Å; W276-C309 HydrophobicContact CE3-CB 4.33Å; W276-C309 HydrophobicContact CH2-CB 3.94Å; W276-C309 HydrophobicContact CZ2-CB 3.88Å; W276-C309 HydrophobicContact CZ3-CB 4.17Å
277	V	93.3	Very high	90.7	Very high	55 Å²	55	67.4 Å²	67.4	33%	0.333	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	145	175.8	-59.8	0	0	0	0	110.7	S308 V310	V277-S308 PolarHBondContact N-O 3.48Å; V277-S308 PolarHBondContact O-N 3.27Å; V277-V310 HydrophobicContact CG2-CG2 4.17Å
278	S	92.1	Very high	90.8	Very high	9 Å²	9	69 Å²	69	6%	0.063	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	168.9	173.1	54.4	0	0	0	0	111.5	N280 D281 S282 V306	S278-N280 PolarHBondContact O-N 2.91Å; S278-N280 PolarHBondContact OG-N 2.9Å; S278-D281 PolarHBondContact O-N 2.76Å; S278-S282 VanDerWaalsContact OG-C 3.3Å; S278-S282 PolarHBondContact OG-N 2.89Å; S278-S282 PolarHBondContact OG-O 3.12Å; S278-V306 CarbonylContact C-O 3.5Å; S278-V306 WeakPolarHBondContact CA-O 3.35Å
279	S	89.3	Confident	90.8	Very high	67 Å²	67	71.4 Å²	71.4	47%	0.469	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-21.1	165.2	48.7	0	0	0	0	114.5	V306	S279-V306 PolarHBondContact N-O 3.25Å
280	N	81.3	Confident	90.8	Very high	97 Å²	97	75.6 Å²	75.6	52%	0.519	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	22.5	-176.1	-52.9	4.1	0	0	0	112	S278 S282	S278-N280 PolarHBondContact O-N 2.91Å; S278-N280 PolarHBondContact OG-N 2.9Å; N280-S282 PolarHBondContact O-N 2.84Å; N280-S282 PolarHBondContact O-OG 3.32Å; N280-S282 VanDerWaalsContact O-OG 3.1Å
281	D	77.6	Confident	90.3	Very high	155 Å²	155	77.4 Å²	77.4	83%	0.829	44%	0.442	S	S	*	.	S	Bend	trans	52.9	-7.7	-175.7	-67.4	-39.5	0	0	0	117.7	S278	S278-D281 PolarHBondContact O-N 2.76Å
282	S	86.4	Confident	90	Very high	84 Å²	84	72.9 Å²	72.9	59%	0.587	41%	0.414	S	S	*	.	S	Bend	trans	-138.8	127.6	-176.2	54.1	0	0	0	0	110.9	S278 N280	S278-S282 VanDerWaalsContact OG-C 3.3Å; S278-S282 PolarHBondContact OG-N 2.89Å; S278-S282 PolarHBondContact OG-O 3.12Å; N280-S282 PolarHBondContact O-N 2.84Å; N280-S282 PolarHBondContact O-OG 3.32Å; N280-S282 VanDerWaalsContact O-OG 3.1Å
283	L	89.6	Confident	90	Very high	47 Å²	47	74 Å²	74	25%	0.246	42%	0.42	C	S	.	.			trans	-67.9	145.7	175.5	-60.2	176.4	0	0	0	110.1	W276 Q285 S287 V289 L294 Y307	W276-L283 HydrophobicContact CB-CD1 3.91Å; W276-L283 HydrophobicContact CB-CD2 4.38Å; L283-Q285 PolarHBondContact O-N 2.92Å; L283-S287 WeakPolarHBondContact CB-OG 3.4Å; L283-V289 HydrophobicContact CD1-CG2 4.05Å; L283-L294 HydrophobicContact CD1-CD1 4.42Å; L283-L294 HydrophobicContact CD2-CD2 4.11Å; L283-Y307 HydrophobicContact CD2-CD1 4.16Å; L283-Y307 HydrophobicContact CD2-CE1 4.16Å
284	P	88.8	Confident	90.1	Very high	23 Å²	23	67.9 Å²	67.9	15%	0.149	39%	0.389	C	S	.	.			trans	-54.6	140.9	174.8	-25.4	34.2	0	0	0	111.4	R286 S287 L296 E303	P284-R286 PolarHBondContact O-N 2.95Å; P284-S287 WeakPolarHBondContact O-CB 3.37Å; P284-S287 PolarHBondContact O-N 2.56Å; P284-S287 PolarHBondContact O-OG 3.48Å; P284-L296 HydrophobicContact CG-CD2 4.33Å; P284-E303 HydrophobicContact CB-CG 4.21Å; P284-E303 WeakPolarHBondContact CB-OE1 3.47Å; P284-E303 HydrophobicContact CG-CB 4.28Å; P284-E303 HydrophobicContact CG-CG 3.79Å
285	Q	88.1	Confident	90.2	Very high	204 Å²	204	67.7 Å²	67.7	95%	0.953	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-19.2	-178.3	-68.8	-169.9	-6.2	0	0	113.9	L283 S287	L283-Q285 PolarHBondContact O-N 2.92Å; Q285-S287 VanDerWaalsContact C-N 3.28Å
286	R	90.2	Very high	90.2	Very high	97 Å²	97	64.4 Å²	64.4	37%	0.366	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-11.6	177.7	-44.2	-167.5	-64.6	152.5	-1.9	113.1	P284 P297 A298 E303	P284-R286 PolarHBondContact O-N 2.95Å; R286-P297 HydrophobicContact CB-CG 4.12Å; R286-P297 VanDerWaalsContact CZ-O 3.23Å; R286-P297 PolarHBondContact NH1-O 2.82Å; R286-P297 VanDerWaalsContact NH1-O 3.11Å; R286-P297 PolarHBondContact NH2-O 2.77Å; R286-P297 WeakPolarHBondContact O-CD 3.49Å; R286-P297 VanDerWaalsContact O-CG 3.23Å; R286-P297 WeakPolarHBondContact O-CG 3.43Å; R286-A298 VanDerWaalsContact CZ-O 3.28Å; R286-A298 PolarHBondContact NH1-O 3.26Å; R286-A298 PolarHBondContact NH2-O 2.83Å; R286-E303 IonicContact CZ-OE1 3.86Å; R286-E303 IonicContact CZ-OE2 3.02Å; R286-E303 IonicContact NE-OE1 3.32Å; R286-E303 PolarHBondContact NE-OE1 3.34Å; R286-E303 IonicContact NH2-OE1 2.79Å; R286-E303 PolarHBondContact NH2-OE1 3.19Å; R286-E303 IonicContact NH2-OE2 3.33Å; R286-E303 PolarHBondContact NH2-OE2 3.01Å
287	S	92.2	Very high	90.2	Very high	31 Å²	31	65.8 Å²	65.8	22%	0.217	38%	0.381	C	S	.	.			trans	-70.6	144.8	-173.7	63.3	0	0	0	0	113.1	L283 P284 Q285 T295	L283-S287 WeakPolarHBondContact CB-OG 3.4Å; P284-S287 WeakPolarHBondContact O-CB 3.37Å; P284-S287 PolarHBondContact O-N 2.56Å; P284-S287 PolarHBondContact O-OG 3.48Å; Q285-S287 VanDerWaalsContact C-N 3.28Å; S287-T295 WeakPolarHBondContact CA-O 3.47Å
288	V	93.4	Very high	90.1	Very high	63 Å²	63	65.1 Å²	65.1	38%	0.382	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	114.5	177.1	179.5	0	0	0	0	108.9	K290 T295	V288-K290 HydrophobicContact CG1-CD 4.16Å; V288-K290 HydrophobicContact CG1-CG 4.11Å; V288-T295 PolarHBondContact N-O 3.19Å; V288-T295 PolarHBondContact O-N 3.28Å
289	V	93.5	Very high	90.2	Very high	72 Å²	72	64.8 Å²	64.8	44%	0.436	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	121.1	175.9	-178.7	0	0	0	0	109.9	L283 T293 L294	L283-V289 HydrophobicContact CD1-CG2 4.05Å; V289-T293 CarbonylContact C-O 3.4Å; V289-T293 VanDerWaalsContact CA-O 3.32Å; V289-T293 WeakPolarHBondContact CA-O 3.33Å; V289-L294 HydrophobicContact CG2-CB 4.47Å; V289-L294 HydrophobicContact CG2-CD1 3.9Å
290	K	91.2	Very high	90.3	Very high	156 Å²	156	64.1 Å²	64.1	68%	0.678	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141	118.8	177.1	-70.9	-178.5	-179.9	178	0	110.4	V288 G292 T293	V288-K290 HydrophobicContact CG1-CD 4.16Å; V288-K290 HydrophobicContact CG1-CG 4.11Å; K290-G292 VanDerWaalsContact C-N 3.35Å; K290-G292 PolarHBondContact O-N 2.81Å; K290-T293 PolarHBondContact N-O 2.82Å; K290-T293 WeakPolarHBondContact O-CB 3.41Å; K290-T293 PolarHBondContact O-N 2.87Å
291	G	82.7	Confident	90.7	Very high	87 Å²	87	61.3 Å²	61.3	90%	0.897	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	43.3	171.4	0	0	0	0	0	114.7	T293	G291-T293 PolarHBondContact O-N 3.39Å
292	G	88.5	Confident	91.2	Very high	8 Å²	8	59.6 Å²	59.6	8%	0.082	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	-12.1	-176	0	0	0	0	0	115.3	C263 W276 K290	C263-G292 WeakPolarHBondContact CB-O 3.36Å; C263-G292 PolarHBondContact N-O 2.91Å; C263-G292 VanDerWaalsContact N-O 3.16Å; W276-G292 PolarHBondContact NE1-O 3.19Å; K290-G292 VanDerWaalsContact C-N 3.35Å; K290-G292 PolarHBondContact O-N 2.81Å
293	T	94.9	Very high	91.4	Very high	40 Å²	40	56.8 Å²	56.8	25%	0.245	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	131.1	172.7	-55.3	0	0	0	0	110.9	L261 V262 V289 K290 G291	L261-T293 CarbonylContact O-C 3.49Å; L261-T293 VanDerWaalsContact O-CA 3.3Å; L261-T293 WeakPolarHBondContact O-CA 3.47Å; V262-T293 HydrophobicContact CG2-CG2 3.93Å; V289-T293 CarbonylContact C-O 3.4Å; V289-T293 VanDerWaalsContact CA-O 3.32Å; V289-T293 WeakPolarHBondContact CA-O 3.33Å; K290-T293 PolarHBondContact N-O 2.82Å; K290-T293 WeakPolarHBondContact O-CB 3.41Å; K290-T293 PolarHBondContact O-N 2.87Å; G291-T293 PolarHBondContact O-N 3.39Å
294	L	95.6	Very high	91.5	Very high	0 Å²	0	56 Å²	56	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	117.9	169.3	163.9	60.2	0	0	0	109	S260 L261 W276 L283 V289 L296 Y307	S260-L294 CarbonylContact C-O 3.58Å; S260-L294 WeakPolarHBondContact CA-O 3.36Å; L261-L294 HydrophobicContact CB-CB 4.45Å; L261-L294 HydrophobicContact CD1-CD2 4.26Å; L261-L294 PolarHBondContact N-O 3.48Å; L261-L294 PolarHBondContact O-N 3.49Å; W276-L294 HydrophobicContact CB-CD2 4.14Å; W276-L294 HydrophobicContact CD2-CB 3.79Å; W276-L294 HydrophobicContact CD2-CD2 3.71Å; W276-L294 HydrophobicContact CD2-CG 4.4Å; W276-L294 HydrophobicContact CE3-CB 4.49Å; W276-L294 HydrophobicContact CE3-CD2 3.69Å; W276-L294 HydrophobicContact CG-CB 3.84Å; W276-L294 HydrophobicContact CG-CD2 3.94Å; W276-L294 HydrophobicContact CG-CG 4.47Å; W276-L294 HydrophobicContact CZ2-CB 4.24Å; W276-L294 HydrophobicContact CZ3-CD2 4.33Å; L283-L294 HydrophobicContact CD1-CD1 4.42Å; L283-L294 HydrophobicContact CD2-CD2 4.11Å; V289-L294 HydrophobicContact CG2-CB 4.47Å; V289-L294 HydrophobicContact CG2-CD1 3.9Å; L294-L296 HydrophobicContact CD1-CD2 3.97Å; L294-L296 HydrophobicContact CD1-CG 4.38Å; L294-L296 HydrophobicContact CG-CD2 4.42Å; L294-L296 HydrophobicContact CG-CG 4.36Å; L294-Y307 HydrophobicContact CD2-CD1 3.83Å; L294-Y307 HydrophobicContact CD2-CE1 4.41Å
295	T	95.5	Very high	91.7	Very high	38 Å²	38	55.9 Å²	55.9	23%	0.233	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	130.6	172.8	-61.7	0	0	0	0	110.4	T258 V259 S260 S287 V288	T258-T295 HydrophobicContact CG2-CG2 3.65Å; V259-T295 CarbonylContact O-C 3.43Å; V259-T295 WeakPolarHBondContact O-CA 3.42Å; S260-T295 PolarHBondContact OG-OG1 3.14Å; S287-T295 WeakPolarHBondContact CA-O 3.47Å; V288-T295 PolarHBondContact N-O 3.19Å; V288-T295 PolarHBondContact O-N 3.28Å
296	L	94.9	Very high	92	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.01	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	99.1	175.9	-62.1	174.3	0	0	0	108.5	T258 V259 P284 L294 I299 Y307 I325	T258-L296 WeakPolarHBondContact CA-O 3.39Å; V259-L296 HydrophobicContact CB-CB 4.38Å; V259-L296 PolarHBondContact N-O 3.13Å; V259-L296 PolarHBondContact O-N 2.75Å; P284-L296 HydrophobicContact CG-CD2 4.33Å; L294-L296 HydrophobicContact CD1-CD2 3.97Å; L294-L296 HydrophobicContact CD1-CG 4.38Å; L294-L296 HydrophobicContact CG-CD2 4.42Å; L294-L296 HydrophobicContact CG-CG 4.36Å; L296-I299 HydrophobicContact CD1-CD1 4.3Å; L296-Y307 HydrophobicContact CD1-CD1 4.38Å; L296-Y307 HydrophobicContact CD1-CE1 3.84Å; L296-Y307 HydrophobicContact CD1-CE2 4.22Å; L296-Y307 HydrophobicContact CD2-CE1 4.43Å; L296-I325 HydrophobicContact CD1-CD1 3.61Å
297	P	94.3	Very high	92.3	Very high	46 Å²	46	44.6 Å²	44.6	30%	0.299	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	132.9	-176.7	31.1	-33.5	0	0	0	112.1	R286	R286-P297 HydrophobicContact CB-CG 4.12Å; R286-P297 VanDerWaalsContact CZ-O 3.23Å; R286-P297 PolarHBondContact NH1-O 2.82Å; R286-P297 VanDerWaalsContact NH1-O 3.11Å; R286-P297 PolarHBondContact NH2-O 2.77Å; R286-P297 WeakPolarHBondContact O-CD 3.49Å; R286-P297 VanDerWaalsContact O-CG 3.23Å; R286-P297 WeakPolarHBondContact O-CG 3.43Å
298	A	92.9	Very high	92.4	Very high	42 Å²	42	43.3 Å²	43.3	35%	0.347	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	55.9	174.7	0	0	0	0	0	114.9	G256 Q257 T258 R286	G256-A298 WeakPolarHBondContact O-CA 3.45Å; Q257-A298 CarbonylContact O-C 3.57Å; Q257-A298 VanDerWaalsContact O-CA 3.26Å; Q257-A298 WeakPolarHBondContact O-CA 3.44Å; Q257-A298 PolarHBondContact O-N 2.92Å; T258-A298 PolarHBondContact OG1-N 2.75Å; R286-A298 VanDerWaalsContact CZ-O 3.28Å; R286-A298 PolarHBondContact NH1-O 3.26Å; R286-A298 PolarHBondContact NH2-O 2.83Å
299	I	93.1	Very high	92.5	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	26%	0.259	C	S	.	.			trans	-56.4	145.9	-169.5	-160.4	171.7	0	0	0	114.4	V253 P255 G256 Q257 V259 L296 E303 I325 V327	V253-I299 HydrophobicContact CG2-CG2 4.16Å; P255-I299 CarbonylContact C-O 3.51Å; P255-I299 WeakPolarHBondContact CA-O 3.46Å; G256-I299 PolarHBondContact N-O 2.95Å; Q257-I299 PolarHBondContact O-N 3.44Å; V259-I299 HydrophobicContact CG2-CB 4.49Å; V259-I299 HydrophobicContact CG2-CD1 3.95Å; V259-I299 HydrophobicContact CG2-CG2 4.28Å; L296-I299 HydrophobicContact CD1-CD1 4.3Å; I299-E303 WeakPolarHBondContact CA-OE2 3.21Å; I299-E303 HydrophobicContact CG1-CB 3.98Å; I299-E303 WeakPolarHBondContact CG1-OE2 3.13Å; I299-I325 HydrophobicContact CD1-CD1 4.31Å; I299-I325 HydrophobicContact CD1-CG2 3.64Å; I299-V327 HydrophobicContact CD1-CG2 3.79Å; I299-V327 HydrophobicContact CG1-CG2 4.01Å; I299-V327 HydrophobicContact CG2-CG2 4.07Å
300	T	92.3	Very high	92.6	Very high	53 Å²	53	38.4 Å²	38.4	33%	0.325	25%	0.247	S	C	.	.			trans	-110.4	167.6	175.3	68.2	0	0	0	0	112.8	D302 E303	T300-D302 PolarHBondContact O-N 3.09Å; T300-D302 VanDerWaalsContact O-N 3.14Å; T300-E303 PolarHBondContact N-OE2 2.74Å; T300-E303 PolarHBondContact O-N 3.45Å
301	S	88.6	Confident	92.8	Very high	38 Å²	38	31 Å²	31	27%	0.266	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-58.2	-26.5	176.8	50.8	0	0	0	0	113.7	A304 K331	S301-A304 VanDerWaalsContact O-CB 3.26Å; S301-A304 WeakPolarHBondContact O-CB 3.49Å; S301-A304 PolarHBondContact O-N 2.92Å; S301-K331 PolarHBondContact OG-NZ 3.24Å
302	D	88.5	Confident	93.3	Very high	119 Å²	119	28.7 Å²	28.7	64%	0.636	19%	0.185	S	C	*	.	G	3₁₀ helix	trans	-95.1	-6.9	-168.3	-32.5	-40.8	0	0	0	111.1	T300	T300-D302 PolarHBondContact O-N 3.09Å; T300-D302 VanDerWaalsContact O-N 3.14Å
303	E	90.8	Very high	93.6	Very high	25 Å²	25	29 Å²	29	12%	0.117	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-95	0.9	167.4	-65.1	172	155.9	0	0	112.3	P284 R286 I299 T300 Y307	P284-E303 HydrophobicContact CB-CG 4.21Å; P284-E303 WeakPolarHBondContact CB-OE1 3.47Å; P284-E303 HydrophobicContact CG-CB 4.28Å; P284-E303 HydrophobicContact CG-CG 3.79Å; R286-E303 IonicContact CZ-OE1 3.86Å; R286-E303 IonicContact CZ-OE2 3.02Å; R286-E303 IonicContact NE-OE1 3.32Å; R286-E303 PolarHBondContact NE-OE1 3.34Å; R286-E303 IonicContact NH2-OE1 2.79Å; R286-E303 PolarHBondContact NH2-OE1 3.19Å; R286-E303 IonicContact NH2-OE2 3.33Å; R286-E303 PolarHBondContact NH2-OE2 3.01Å; I299-E303 WeakPolarHBondContact CA-OE2 3.21Å; I299-E303 HydrophobicContact CG1-CB 3.98Å; I299-E303 WeakPolarHBondContact CG1-OE2 3.13Å; T300-E303 PolarHBondContact N-OE2 2.74Å; T300-E303 PolarHBondContact O-N 3.45Å; E303-Y307 VanDerWaalsContact O-CE2 3.3Å; E303-Y307 WeakPolarHBondContact O-CE2 3Å; E303-Y307 PolarHBondContact O-OH 2.9Å
304	A	91.3	Very high	93.5	Very high	32 Å²	32	30.5 Å²	30.5	26%	0.264	19%	0.192	S	C	.	.			trans	-66.4	154	172.3	0	0	0	0	0	111.4	S301 V327	S301-A304 VanDerWaalsContact O-CB 3.26Å; S301-A304 WeakPolarHBondContact O-CB 3.49Å; S301-A304 PolarHBondContact O-N 2.92Å; A304-V327 HydrophobicContact CB-CB 4.27Å; A304-V327 HydrophobicContact CB-CG2 3.99Å
305	G	92.9	Very high	93.4	Very high	19 Å²	19	30.6 Å²	30.6	20%	0.196	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	138.5	-162.6	-179.6	0	0	0	0	0	113.9	I325	G305-I325 PolarHBondContact N-O 2.79Å; G305-I325 PolarHBondContact O-N 2.96Å
306	V	95.1	Very high	93.2	Very high	58 Å²	58	29.8 Å²	29.8	35%	0.352	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	119.4	-173.5	-176.4	0	0	0	0	110.5	S278 S279	S278-V306 CarbonylContact C-O 3.5Å; S278-V306 WeakPolarHBondContact CA-O 3.35Å; S279-V306 PolarHBondContact N-O 3.25Å
307	Y	94.9	Very high	93	Very high	7 Å²	7	35.5 Å²	35.5	3%	0.027	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	131.5	174.3	-72.1	-95.8	0	0	0	109.7	L261 L283 L294 L296 E303 S322 T323 I325	L261-Y307 HydrophobicContact CD1-CG 4.21Å; L283-Y307 HydrophobicContact CD2-CD1 4.16Å; L283-Y307 HydrophobicContact CD2-CE1 4.16Å; L294-Y307 HydrophobicContact CD2-CD1 3.83Å; L294-Y307 HydrophobicContact CD2-CE1 4.41Å; L296-Y307 HydrophobicContact CD1-CD1 4.38Å; L296-Y307 HydrophobicContact CD1-CE1 3.84Å; L296-Y307 HydrophobicContact CD1-CE2 4.22Å; L296-Y307 HydrophobicContact CD2-CE1 4.43Å; E303-Y307 VanDerWaalsContact O-CE2 3.3Å; E303-Y307 WeakPolarHBondContact O-CE2 3Å; E303-Y307 PolarHBondContact O-OH 2.9Å; Y307-S322 CarbonylContact O-C 3.55Å; Y307-S322 VanDerWaalsContact O-CA 3.24Å; Y307-S322 WeakPolarHBondContact O-CA 3.42Å; Y307-T323 PolarHBondContact N-O 3.5Å; Y307-T323 PolarHBondContact O-N 2.83Å; Y307-I325 HydrophobicContact CD2-CB 4.36Å; Y307-I325 HydrophobicContact CD2-CD1 3.59Å; Y307-I325 HydrophobicContact CD2-CG1 3.87Å; Y307-I325 HydrophobicContact CE2-CB 4.42Å; Y307-I325 HydrophobicContact CE2-CD1 3.78Å; Y307-I325 HydrophobicContact CE2-CG1 4.28Å; Y307-I325 HydrophobicContact CG-CD1 4.23Å
308	S	94.9	Very high	93	Very high	4 Å²	4	37 Å²	37	3%	0.028	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	123.6	-174.9	-53.5	0	0	0	0	112	W276 V277 K320 K321 S322	W276-S308 WeakPolarHBondContact CA-O 3.28Å; W276-S308 VanDerWaalsContact CZ3-C 3.49Å; V277-S308 PolarHBondContact N-O 3.48Å; V277-S308 PolarHBondContact O-N 3.27Å; S308-K320 WeakPolarHBondContact OG-CE 3.4Å; S308-K321 CarbonylContact C-O 3.54Å; S308-K321 WeakPolarHBondContact CA-O 3.28Å; S308-S322 WeakPolarHBondContact CB-OG 3.46Å; S308-S322 PolarHBondContact OG-OG 2.84Å
309	C	95.4	Very high	93.1	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	128.2	161	-178.6	0	0	0	0	108.5	I243 C263 W276 K320 K321	I243-C309 HydrophobicContact CD1-CB 4.23Å; C263-C309 HydrophobicContact CB-CB 3.59Å; C263-C309 WeakPolarHBondContact CB-SG 3Å; C263-C309 WeakPolarHBondContact SG-CB 3.3Å; C263-C309 CovalentContact SG-SG 2.03Å; C263-C309 PolarHBondContact SG-SG 2.92Å; W276-C309 HydrophobicContact CD2-CB 4.28Å; W276-C309 HydrophobicContact CE3-CB 4.33Å; W276-C309 HydrophobicContact CH2-CB 3.94Å; W276-C309 HydrophobicContact CZ2-CB 3.88Å; W276-C309 HydrophobicContact CZ3-CB 4.17Å; C309-K320 WeakPolarHBondContact O-CA 3.37Å; C309-K321 PolarHBondContact N-O 2.85Å; C309-K321 PolarHBondContact O-N 3.26Å
310	V	95.2	Very high	93.2	Very high	31 Å²	31	42 Å²	42	19%	0.188	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	135.2	175.2	-179.1	0	0	0	0	108.3	L274 T275 V277 P318 A319 K320	L274-V310 WeakPolarHBondContact CA-O 3.04Å; T275-V310 PolarHBondContact N-O 2.9Å; T275-V310 PolarHBondContact O-N 3.34Å; V277-V310 HydrophobicContact CG2-CG2 4.17Å; V310-P318 HydrophobicContact CG1-CB 4.22Å; V310-A319 CarbonylContact C-O 3.6Å; V310-A319 WeakPolarHBondContact CA-O 3.39Å; V310-K320 HydrophobicContact CG2-CD 4.43Å; V310-K320 HydrophobicContact CG2-CG 4.14Å
311	A	95.5	Very high	93.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	130.3	178	0	0	0	0	0	110.7	P241 I243 P272 I273 L274 P318 A319	P241-A311 HydrophobicContact CB-CB 3.95Å; P241-A311 VanDerWaalsContact CG-O 3.27Å; P241-A311 WeakPolarHBondContact CG-O 3.42Å; I243-A311 HydrophobicContact CD1-CB 4.34Å; I243-A311 HydrophobicContact CG2-CB 3.51Å; P272-A311 HydrophobicContact CB-CB 4.25Å; I273-A311 WeakPolarHBondContact O-CA 3.42Å; L274-A311 HydrophobicContact CD2-CB 3.6Å; A311-P318 CarbonylContact O-C 3.43Å; A311-P318 VanDerWaalsContact O-CA 3.28Å; A311-P318 WeakPolarHBondContact O-CA 3.32Å; A311-P318 WeakPolarHBondContact O-CB 3.29Å; A311-A319 HydrophobicContact CB-CB 4.4Å; A311-A319 PolarHBondContact N-O 2.75Å; A311-A319 PolarHBondContact O-N 3.42Å
312	S	94.6	Very high	93.6	Very high	39 Å²	39	45.3 Å²	45.3	27%	0.273	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	137.4	174.3	-173.2	0	0	0	0	112.4	P272 I273 N314	P272-S312 CarbonylContact C-O 3.05Å; P272-S312 WeakPolarHBondContact CA-O 3.26Å; I273-S312 PolarHBondContact N-O 2.97Å; I273-S312 PolarHBondContact O-N 3.05Å; I273-S312 VanDerWaalsContact O-N 3.1Å; S312-N314 PolarHBondContact OG-N 2.82Å
313	N	93.6	Very high	93.9	Very high	15 Å²	15	39.7 Å²	39.7	8%	0.08	23%	0.231	C	C	.	.	S	Bend	trans	-125.3	17.4	165	62.7	-0.6	0	0	0	111.5	A239 P241 E269 P270 P272 V315	A239-N313 PolarHBondContact O-ND2 3.04Å; P241-N313 WeakPolarHBondContact CD-OD1 3.48Å; E269-N313 PolarHBondContact N-ND2 3.24Å; P270-N313 WeakPolarHBondContact O-CB 3.49Å; P270-N313 PolarHBondContact O-ND2 2.84Å; P272-N313 HydrophobicContact CB-CB 3.95Å; N313-V315 PolarHBondContact O-N 3.29Å; N313-V315 WeakPolarHBondContact OD1-CA 3.3Å; N313-V315 VanDerWaalsContact OD1-CB 3.27Å; N313-V315 WeakPolarHBondContact OD1-CB 3.43Å; N313-V315 PolarHBondContact OD1-N 2.82Å; N313-V315 PolarHBondContact OD1-O 2.93Å
314	N	93.6	Very high	94.1	Very high	71 Å²	71	41.1 Å²	41.1	38%	0.38	24%	0.241	S	C	.	.	S	Bend	trans	61.5	12.5	-171.2	-55	-21.6	0	0	0	115.6	I135 T136 V137 S312	I135-N314 WeakPolarHBondContact O-CB 3.13Å; T136-N314 CarbonylContact C-O 3.58Å; T136-N314 WeakPolarHBondContact CA-O 3.36Å; T136-N314 WeakPolarHBondContact CB-O 3.49Å; T136-N314 HydrophobicContact CG2-CB 4.22Å; V137-N314 PolarHBondContact N-O 2.87Å; S312-N314 PolarHBondContact OG-N 2.82Å
315	V	93.3	Very high	94.3	Very high	3 Å²	3	39.6 Å²	39.6	2%	0.018	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-105.1	126.8	174.8	-171	0	0	0	0	110.6	V137 F232 T238 S240 P241 N313	V137-V315 CarbonylContact O-C 3.29Å; V137-V315 WeakPolarHBondContact O-CA 3.46Å; V137-V315 WeakPolarHBondContact O-CG1 3.34Å; F232-V315 HydrophobicContact CE2-CG2 3.97Å; F232-V315 HydrophobicContact CZ-CG2 3.68Å; T238-V315 HydrophobicContact CG2-CG1 4.02Å; T238-V315 HydrophobicContact CG2-CG2 3.92Å; S240-V315 VanDerWaalsContact CA-O 3.3Å; S240-V315 WeakPolarHBondContact CA-O 3.21Å; S240-V315 WeakPolarHBondContact CB-O 3.49Å; P241-V315 WeakPolarHBondContact CD-O 3.48Å; N313-V315 PolarHBondContact O-N 3.29Å; N313-V315 WeakPolarHBondContact OD1-CA 3.3Å; N313-V315 VanDerWaalsContact OD1-CB 3.27Å; N313-V315 WeakPolarHBondContact OD1-CB 3.43Å; N313-V315 PolarHBondContact OD1-N 2.82Å; N313-V315 PolarHBondContact OD1-O 2.93Å
316	G	90.9	Very high	94.3	Very high	20 Å²	20	40 Å²	40	21%	0.206	23%	0.227	C	C	.	.	S	Bend	trans	61.5	-142.5	-179.4	0	0	0	0	0	112.9	V137 H138	V137-G316 PolarHBondContact O-N 2.65Å; H138-G316 PolarHBondContact CE1-O 2.93Å; H138-G316 VanDerWaalsContact CE1-O 3.26Å
317	N	90.6	Very high	94.2	Very high	122 Å²	122	37.4 Å²	37.4	65%	0.652	21%	0.211	S	C	*	.	S	Bend	trans	-91.7	137.9	175.8	-62.5	-12.3	0	0	0	109.4	A319	N317-A319 PolarHBondContact O-N 3.46Å
318	P	93.9	Very high	94.1	Very high	78 Å²	78	38.7 Å²	38.7	51%	0.506	22%	0.216	S	C	.	.	P	Polyproline II helix	trans	-55.6	134.5	170.9	-25.5	35	0	0	0	111.3	V310 A311	V310-P318 HydrophobicContact CG1-CB 4.22Å; A311-P318 CarbonylContact O-C 3.43Å; A311-P318 VanDerWaalsContact O-CA 3.28Å; A311-P318 WeakPolarHBondContact O-CA 3.32Å; A311-P318 WeakPolarHBondContact O-CB 3.29Å
319	A	95.1	Very high	93.9	Very high	20 Å²	20	39.1 Å²	39.1	17%	0.165	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	124.2	-179.8	0	0	0	0	0	109.2	P241 I243 V310 A311 N317	P241-A319 HydrophobicContact CB-CB 4.03Å; P241-A319 HydrophobicContact CG-CB 3.93Å; I243-A319 HydrophobicContact CD1-CB 4.42Å; I243-A319 WeakPolarHBondContact CD1-O 3.28Å; I243-A319 HydrophobicContact CG1-CB 3.97Å; V310-A319 CarbonylContact C-O 3.6Å; V310-A319 WeakPolarHBondContact CA-O 3.39Å; A311-A319 HydrophobicContact CB-CB 4.4Å; A311-A319 PolarHBondContact N-O 2.75Å; A311-A319 PolarHBondContact O-N 3.42Å; N317-A319 PolarHBondContact O-N 3.46Å
320	K	95.3	Very high	93.6	Very high	128 Å²	128	40.1 Å²	40.1	56%	0.557	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-115.2	132	177.7	-174.9	173.5	-179.5	179.7	0	110	S308 C309 V310	S308-K320 WeakPolarHBondContact OG-CE 3.4Å; C309-K320 WeakPolarHBondContact O-CA 3.37Å; V310-K320 HydrophobicContact CG2-CD 4.43Å; V310-K320 HydrophobicContact CG2-CG 4.14Å
321	K	95.3	Very high	93.3	Very high	112 Å²	112	42.7 Å²	42.7	49%	0.487	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	132	166.3	-74.2	-64.9	-178	-178.2	0	108.7	I243 L245 S308 C309	I243-K321 HydrophobicContact CD1-CB 3.97Å; I243-K321 HydrophobicContact CD1-CG 4.06Å; I243-K321 HydrophobicContact CG1-CB 4.38Å; I243-K321 HydrophobicContact CG1-CG 3.93Å; L245-K321 HydrophobicContact CB-CB 4.22Å; S308-K321 CarbonylContact C-O 3.54Å; S308-K321 WeakPolarHBondContact CA-O 3.28Å; C309-K321 PolarHBondContact N-O 2.85Å; C309-K321 PolarHBondContact O-N 3.26Å
322	S	94.9	Very high	92.9	Very high	49 Å²	49	48.4 Å²	48.4	34%	0.343	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	156.9	-175.3	-57.3	0	0	0	0	109.8	Y307 S308	Y307-S322 CarbonylContact O-C 3.55Å; Y307-S322 VanDerWaalsContact O-CA 3.24Å; Y307-S322 WeakPolarHBondContact O-CA 3.42Å; S308-S322 WeakPolarHBondContact CB-OG 3.46Å; S308-S322 PolarHBondContact OG-OG 2.84Å
323	T	95.6	Very high	92.8	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.006	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	154	163.4	178.9	0	0	0	0	108.8	L245 V247 D249 I251 L261 Y307	L245-T323 HydrophobicContact CD2-CG2 3.83Å; V247-T323 HydrophobicContact CG2-CG2 4.06Å; D249-T323 WeakPolarHBondContact OD1-CA 3.4Å; D249-T323 VanDerWaalsContact OD1-CB 3.29Å; D249-T323 WeakPolarHBondContact OD1-CB 3.1Å; D249-T323 PolarHBondContact OD1-OG1 2.71Å; I251-T323 HydrophobicContact CD1-CG2 4.05Å; L261-T323 HydrophobicContact CD1-CG2 3.96Å; L261-T323 HydrophobicContact CD2-CG2 4.12Å; Y307-T323 PolarHBondContact N-O 3.5Å; Y307-T323 PolarHBondContact O-N 2.83Å
324	T	95.3	Very high	92.7	Very high	54 Å²	54	49.3 Å²	49.3	33%	0.331	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	121.2	173.4	-50.3	0	0	0	0	109.7	D249 P250 I251 V326	D249-T324 PolarHBondContact OD1-N 3.14Å; P250-T324 WeakPolarHBondContact CA-O 3.3Å; I251-T324 PolarHBondContact N-O 3.45Å; T324-V326 HydrophobicContact CG2-CG2 4.13Å
325	I	94.6	Very high	92.8	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	120.4	168.1	-55.2	177.8	0	0	0	108.5	I251 V253 V259 L261 L296 I299 G305 Y307 V327	I251-I325 HydrophobicContact CB-CG1 4.47Å; I251-I325 HydrophobicContact CD1-CG1 4.44Å; V253-I325 HydrophobicContact CG2-CG2 3.85Å; V259-I325 HydrophobicContact CB-CD1 4.45Å; V259-I325 HydrophobicContact CG1-CD1 3.97Å; L261-I325 HydrophobicContact CD1-CD1 4.24Å; L261-I325 HydrophobicContact CD2-CD1 4.33Å; L296-I325 HydrophobicContact CD1-CD1 3.61Å; I299-I325 HydrophobicContact CD1-CD1 4.31Å; I299-I325 HydrophobicContact CD1-CG2 3.64Å; G305-I325 PolarHBondContact N-O 2.79Å; G305-I325 PolarHBondContact O-N 2.96Å; Y307-I325 HydrophobicContact CD2-CB 4.36Å; Y307-I325 HydrophobicContact CD2-CD1 3.59Å; Y307-I325 HydrophobicContact CD2-CG1 3.87Å; Y307-I325 HydrophobicContact CE2-CB 4.42Å; Y307-I325 HydrophobicContact CE2-CD1 3.78Å; Y307-I325 HydrophobicContact CE2-CG1 4.28Å; Y307-I325 HydrophobicContact CG-CD1 4.23Å; I325-V327 HydrophobicContact CG2-CG2 4.24Å
326	V	93.1	Very high	92.9	Very high	27 Å²	27	48.9 Å²	48.9	16%	0.164	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	115.4	176.4	-179.3	0	0	0	0	107.6	P250 I251 V252 V253 T324 T364 P365	P250-V326 HydrophobicContact CB-CG2 4.09Å; I251-V326 PolarHBondContact O-N 3.14Å; V252-V326 WeakPolarHBondContact CA-O 3.42Å; V252-V326 HydrophobicContact CG1-CB 4.42Å; V252-V326 HydrophobicContact CG1-CG1 4.26Å; V252-V326 HydrophobicContact CG2-CB 4.31Å; V253-V326 PolarHBondContact N-O 3.03Å; T324-V326 HydrophobicContact CG2-CG2 4.13Å; V326-T364 HydrophobicContact CG1-CG2 3.62Å; V326-P365 HydrophobicContact CG1-CB 4.36Å
327	V	93	Very high	93.1	Very high	3 Å²	3	47.9 Å²	47.9	2%	0.018	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	124	177.4	-178.3	0	0	0	0	108.7	V253 P255 I299 A304 I325 A329	V253-V327 HydrophobicContact CG2-CG2 4.22Å; V253-V327 CarbonylContact O-C 3.58Å; V253-V327 WeakPolarHBondContact O-CA 3.5Å; P255-V327 HydrophobicContact CB-CG1 4.09Å; I299-V327 HydrophobicContact CD1-CG2 3.79Å; I299-V327 HydrophobicContact CG1-CG2 4.01Å; I299-V327 HydrophobicContact CG2-CG2 4.07Å; A304-V327 HydrophobicContact CB-CB 4.27Å; A304-V327 HydrophobicContact CB-CG2 3.99Å; I325-V327 HydrophobicContact CG2-CG2 4.24Å; V327-A329 PolarHBondContact O-N 3.03Å
328	R	91.9	Very high	93.3	Very high	35 Å²	35	43.4 Å²	43.4	13%	0.132	22%	0.223	C	C	.	.			trans	-61.6	133.9	-177.6	-71.1	-162.3	-177.7	67.8	11	111.4	V252 V253 N254 T364 E368 L421 I426	V252-R328 HydrophobicContact CG1-CG 3.97Å; V252-R328 PolarHBondContact O-NH1 2.99Å; V253-R328 PolarHBondContact O-N 2.81Å; N254-R328 VanDerWaalsContact OD1-CD 3.27Å; N254-R328 WeakPolarHBondContact OD1-CD 3.4Å; N254-R328 PolarHBondContact OD1-NH1 2.82Å; R328-T364 VanDerWaalsContact CA-O 3.24Å; R328-T364 WeakPolarHBondContact CA-O 3.47Å; R328-E368 IonicContact CZ-OE1 3.08Å; R328-E368 VanDerWaalsContact CZ-OE1 3.29Å; R328-E368 IonicContact CZ-OE2 3.26Å; R328-E368 VanDerWaalsContact NE-CD 3.32Å; R328-E368 IonicContact NE-OE1 2.66Å; R328-E368 PolarHBondContact NE-OE1 3.23Å; R328-E368 IonicContact NE-OE2 3.35Å; R328-E368 PolarHBondContact NE-OE2 2.92Å; R328-E368 IonicContact NH2-OE1 3.72Å; R328-E368 PolarHBondContact NH2-OE1 3.5Å; R328-E368 IonicContact NH2-OE2 2.76Å; R328-L421 HydrophobicContact CB-CD1 3.98Å; R328-L421 HydrophobicContact CG-CD1 4.29Å; R328-I426 HydrophobicContact CB-CD1 3.85Å; R328-I426 HydrophobicContact CB-CG1 3.66Å; R328-I426 VanDerWaalsContact O-CD1 3.3Å; R328-I426 WeakPolarHBondContact O-CD1 3.37Å
329	A	90.9	Very high	93.2	Very high	13 Å²	13	40.1 Å²	40.1	11%	0.107	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	143	179.7	0	0	0	0	0	112	V327 T364	V327-A329 PolarHBondContact O-N 3.03Å; A329-T364 PolarHBondContact N-O 2.74Å; A329-T364 PolarHBondContact O-N 2.95Å
330	L	89.9	Confident	92.9	Very high	21 Å²	21	40 Å²	40	11%	0.11	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	118	162.7	-69.1	175.9	0	0	0	107.1	V360 E362 A363 L369 L421 I426 I429	L330-V360 HydrophobicContact CD2-CG1 4.09Å; L330-E362 CarbonylContact C-O 3.54Å; L330-E362 WeakPolarHBondContact CA-O 3.18Å; L330-A363 HydrophobicContact CD2-CB 4.04Å; L330-L369 HydrophobicContact CD2-CD1 3.73Å; L330-L421 HydrophobicContact CD1-CG 4.08Å; L330-L421 HydrophobicContact CD2-CD1 4.3Å; L330-L421 HydrophobicContact CD2-CD2 3.82Å; L330-L421 HydrophobicContact CD2-CG 3.81Å; L330-L421 HydrophobicContact CG-CD1 4.05Å; L330-L421 HydrophobicContact CG-CD2 4.4Å; L330-L421 HydrophobicContact CG-CG 3.83Å; L330-I426 HydrophobicContact CB-CG2 4.04Å; L330-I426 HydrophobicContact CD1-CG2 4.15Å; L330-I426 HydrophobicContact CG-CG2 4.06Å; L330-I429 HydrophobicContact CB-CD1 3.8Å; L330-I429 HydrophobicContact CB-CG1 4.1Å
331	K	88.6	Confident	92	Very high	85 Å²	85	38 Å²	38	37%	0.37	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	159	178.8	-63.9	174.4	-174.1	173.4	0	109.8	S301 V360 E362	S301-K331 PolarHBondContact OG-NZ 3.24Å; K331-V360 WeakPolarHBondContact O-CG1 3.43Å; K331-E362 HydrophobicContact CB-CB 3.76Å; K331-E362 VanDerWaalsContact CB-OE2 3.28Å; K331-E362 WeakPolarHBondContact CB-OE2 3.46Å; K331-E362 VanDerWaalsContact CD-OE2 3.3Å; K331-E362 WeakPolarHBondContact CD-OE2 3.23Å; K331-E362 PolarHBondContact N-O 2.88Å; K331-E362 PolarHBondContact O-N 2.87Å
332	K	87.5	Confident	91.4	Very high	119 Å²	119	41.8 Å²	41.8	52%	0.517	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	51.6	65.5	174.7	-61.7	177.5	-172.1	163.3	0	113.9	V361 E362	K332-V361 HydrophobicContact CB-CB 4.03Å; K332-V361 HydrophobicContact CB-CG2 4.43Å; K332-V361 WeakPolarHBondContact O-CG2 3.34Å; K332-V361 PolarHBondContact O-N 2.97Å; K332-V361 VanDerWaalsContact O-N 3.09Å; K332-E362 WeakPolarHBondContact CD-OE1 3.47Å; K332-E362 WeakPolarHBondContact CE-OE1 3.35Å; K332-E362 IonicContact NZ-OE1 2.62Å; K332-E362 PolarHBondContact NZ-OE1 2.88Å
333	G	91.3	Very high	90.7	Very high	25 Å²	25	44.5 Å²	44.5	26%	0.258	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	135.1	163.2	0	0	0	0	0	111.1	Q359	G333-Q359 CarbonylContact C-O 3.59Å; G333-Q359 WeakPolarHBondContact CA-O 3.35Å
334	R	92.8	Very high	89.9	Confident	48 Å²	48	52.1 Å²	52.1	18%	0.181	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	151.9	176.4	-71.8	-179.1	175.1	161.3	-5.3	110.2	C358 Q359 V361 E494 Y520 N521	R334-C358 CarbonylContact O-C 3.54Å; R334-C358 WeakPolarHBondContact O-CA 2.94Å; R334-Q359 PolarHBondContact N-O 2.94Å; R334-Q359 PolarHBondContact O-N 2.83Å; R334-V361 HydrophobicContact CG-CG2 4.23Å; R334-E494 IonicContact CZ-OE1 2.67Å; R334-E494 IonicContact NH2-OE1 3.76Å; R334-E494 PolarHBondContact NH2-OE1 3.22Å; R334-Y520 HydrophobicContact CG-CD2 3.91Å; R334-Y520 HydrophobicContact CG-CG 4.34Å; R334-Y520 PolarHBondContact NH2-OH 2.87Å; R334-N521 VanDerWaalsContact CA-OD1 3.26Å; R334-N521 WeakPolarHBondContact CA-OD1 3.39Å
335	F	94.9	Very high	89.3	Confident	20 Å²	20	51.1 Å²	51.1	9%	0.088	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	164.7	168.8	75.5	-86.3	0	0	0	111.5	S357 I431 V433 P471 Y520 N521	F335-S357 CarbonylContact C-O 3.57Å; F335-S357 WeakPolarHBondContact CA-O 2.97Å; F335-S357 WeakPolarHBondContact CB-O 3.43Å; F335-I431 HydrophobicContact CB-CG2 4.11Å; F335-I431 HydrophobicContact CD1-CG2 3.55Å; F335-I431 HydrophobicContact CE1-CG2 4.36Å; F335-I431 HydrophobicContact CG-CG2 4.14Å; F335-V433 HydrophobicContact CB-CG2 3.98Å; F335-V433 HydrophobicContact CD1-CG2 4.39Å; F335-V433 HydrophobicContact CD2-CB 4.44Å; F335-V433 HydrophobicContact CD2-CG1 4.04Å; F335-V433 HydrophobicContact CD2-CG2 3.54Å; F335-V433 HydrophobicContact CE2-CG1 4.07Å; F335-V433 HydrophobicContact CE2-CG2 4.12Å; F335-V433 HydrophobicContact CG-CG2 3.7Å; F335-P471 HydrophobicContact CE2-CG 3.69Å; F335-P471 HydrophobicContact CZ-CB 3.98Å; F335-P471 HydrophobicContact CZ-CG 3.59Å; F335-Y520 CarbonylContact O-C 3.48Å; F335-Y520 WeakPolarHBondContact O-CA 3.49Å; F335-N521 HydrophobicContact CD1-CB 4.39Å; F335-N521 WeakPolarHBondContact CD1-OD1 3.39Å; F335-N521 HydrophobicContact CE1-CB 4.02Å; F335-N521 VanDerWaalsContact CZ-C 3.41Å; F335-N521 PolarHBondContact N-OD1 2.76Å; F335-N521 WeakPolarHBondContact O-CA 3.31Å; F335-N521 PolarHBondContact O-N 3.1Å
336	W	95	Very high	88.9	Confident	45 Å²	45	53.3 Å²	53.3	17%	0.17	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	147.9	164.6	53.2	92.8	0	0	0	112.9	S357 Q359 T399 Q519 G522 N524	W336-S357 PolarHBondContact N-O 2.84Å; W336-S357 PolarHBondContact NE1-OG 3.17Å; W336-S357 PolarHBondContact O-N 2.93Å; W336-Q359 HydrophobicContact CH2-CB 3.84Å; W336-Q359 HydrophobicContact CZ3-CB 3.75Å; W336-T399 HydrophobicContact CH2-CG2 4.06Å; W336-T399 HydrophobicContact CZ2-CG2 4.11Å; W336-Q519 WeakPolarHBondContact CB-O 3.4Å; W336-G522 WeakPolarHBondContact CA-O 3.5Å; W336-N524 HydrophobicContact CB-CB 3.91Å; W336-N524 HydrophobicContact CG-CB 3.94Å
337	I	95.5	Very high	88.8	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	118.7	172.1	-56.7	169.2	0	0	0	107.4	I348 V354 V433 I435 T439 P471 G522 F523 N524	I337-I348 HydrophobicContact CG2-CG2 4.09Å; I337-V354 HydrophobicContact CG2-CG1 3.85Å; I337-V433 HydrophobicContact CD1-CG1 3.92Å; I337-V433 HydrophobicContact CG1-CG1 3.88Å; I337-I435 HydrophobicContact CD1-CD1 3.75Å; I337-I435 HydrophobicContact CG1-CD1 4.15Å; I337-I435 HydrophobicContact CG2-CD1 4.48Å; I337-T439 HydrophobicContact CD1-CG2 3.79Å; I337-P471 HydrophobicContact CD1-CG 4.24Å; I337-G522 PolarHBondContact N-O 3.07Å; I337-F523 HydrophobicContact CD1-CE2 4.24Å; I337-F523 HydrophobicContact CG2-CE1 4.45Å; I337-F523 CarbonylContact O-C 3.52Å; I337-F523 WeakPolarHBondContact O-CA 3.27Å; I337-N524 PolarHBondContact O-N 2.83Å
338	T	94.3	Very high	88.7	Confident	27 Å²	27	56.5 Å²	56.5	17%	0.166	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	115.8	172.2	-44.1	0	0	0	0	108.2	K355	T338-K355 PolarHBondContact N-O 3.46Å; T338-K355 PolarHBondContact O-N 2.83Å
339	P	92.3	Very high	88.6	Confident	10 Å²	10	58.8 Å²	58.8	7%	0.065	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	171.2	169.2	-19.5	32.8	0	0	0	112.4	P341 D345 D346 F523 V525	P339-P341 WeakPolarHBondContact O-CD 3.37Å; P339-D345 WeakPolarHBondContact CB-O 3.37Å; P339-D346 WeakPolarHBondContact CG-O 3.26Å; P339-F523 HydrophobicContact CG-CD1 3.89Å; P339-F523 HydrophobicContact CG-CE1 4.16Å; P339-V525 HydrophobicContact CG-CG1 4.01Å
340	D	88.3	Confident	88.6	Confident	16 Å²	16	63.5 Å²	63.5	9%	0.086	31%	0.313	C	S	.	.			trans	-54.3	113.2	175	-178.4	-29.2	0	0	0	112.2	Y342 H343 R352 E353	D340-Y342 VanDerWaalsContact C-N 3.28Å; D340-Y342 PolarHBondContact O-N 2.82Å; D340-Y342 WeakPolarHBondContact OD1-CB 3.37Å; D340-Y342 PolarHBondContact OD1-N 3.2Å; D340-H343 IonicContact OD1-ND1 3.98Å; D340-H343 PolarHBondContact OD1-ND1 3.46Å; D340-H343 VanDerWaalsContact OD1-ND1 3.17Å; D340-H343 IonicContact OD2-CE1 2.96Å; D340-H343 IonicContact OD2-CG 3.83Å; D340-H343 IonicContact OD2-ND1 2.76Å; D340-H343 PolarHBondContact OD2-ND1 2.96Å; D340-R352 HydrophobicContact CB-CB 3.99Å; D340-R352 HydrophobicContact CB-CG 4.41Å; D340-R352 WeakPolarHBondContact OD2-CB 3.27Å; D340-R352 WeakPolarHBondContact OD2-CD 3.39Å; D340-R352 WeakPolarHBondContact OD2-CG 3.49Å; D340-E353 PolarHBondContact N-O 3.23Å
341	P	77.6	Confident	88.6	Confident	88 Å²	88	64.6 Å²	64.6	57%	0.571	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-14.7	-174	31.8	-36.3	0	0	0	113.4	P339	P339-P341 WeakPolarHBondContact O-CD 3.37Å
342	Y	82.2	Confident	88.8	Confident	190 Å²	190	63 Å²	63	75%	0.745	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-16.7	-177.1	-59.8	-76.7	0	0	0	112.8	D340	D340-Y342 VanDerWaalsContact C-N 3.28Å; D340-Y342 PolarHBondContact O-N 2.82Å; D340-Y342 WeakPolarHBondContact OD1-CB 3.37Å; D340-Y342 PolarHBondContact OD1-N 3.2Å
343	H	81.3	Confident	89	Confident	106 Å²	106	60.5 Å²	60.5	49%	0.491	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	0.8	-171.5	-71.1	98.6	0	0	0	115.2	D340 D345	D340-H343 IonicContact OD1-ND1 3.98Å; D340-H343 PolarHBondContact OD1-ND1 3.46Å; D340-H343 VanDerWaalsContact OD1-ND1 3.17Å; D340-H343 IonicContact OD2-CE1 2.96Å; D340-H343 IonicContact OD2-CG 3.83Å; D340-H343 IonicContact OD2-ND1 2.76Å; D340-H343 PolarHBondContact OD2-ND1 2.96Å; H343-D345 VanDerWaalsContact C-N 3.27Å; H343-D345 PolarHBondContact O-N 2.78Å
344	N	77.6	Confident	89.1	Confident	161 Å²	161	59.3 Å²	59.3	86%	0.861	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	41.5	177.9	-71.7	-42.4	0	0	0	114.2
345	D	82.7	Confident	89.2	Confident	34 Å²	34	59.9 Å²	59.9	18%	0.182	30%	0.304	C	S	.	.			trans	-125.6	123.8	-177.5	-175.6	1	0	0	0	110.1	P339 H343 N347 Q349 R352	P339-D345 WeakPolarHBondContact CB-O 3.37Å; H343-D345 VanDerWaalsContact C-N 3.27Å; H343-D345 PolarHBondContact O-N 2.78Å; D345-N347 PolarHBondContact O-N 2.92Å; D345-N347 WeakPolarHBondContact OD1-CB 3.27Å; D345-N347 PolarHBondContact OD1-N 2.7Å; D345-N347 PolarHBondContact OD1-ND2 2.74Å; D345-Q349 PolarHBondContact OD2-NE2 3.46Å; D345-R352 IonicContact OD2-CZ 3.3Å; D345-R352 IonicContact OD2-NH1 3.68Å; D345-R352 PolarHBondContact OD2-NH1 3.15Å; D345-R352 IonicContact OD2-NH2 3.47Å
346	D	87.1	Confident	89.2	Confident	47 Å²	47	59 Å²	59	25%	0.251	30%	0.3	S	S	.	.	S	Bend	trans	-71.4	-8.7	178.7	-67.1	-33.6	0	0	0	112.5	P339 P441 F523 V525 R528	P339-D346 WeakPolarHBondContact CG-O 3.26Å; D346-P441 HydrophobicContact CB-CB 3.99Å; D346-P441 HydrophobicContact CB-CG 4.04Å; D346-P441 WeakPolarHBondContact O-CB 3.37Å; D346-P441 WeakPolarHBondContact O-CG 3.31Å; D346-F523 WeakPolarHBondContact O-CD1 3.49Å; D346-F523 VanDerWaalsContact O-CE1 3.29Å; D346-F523 WeakPolarHBondContact O-CE1 3.34Å; D346-V525 HydrophobicContact CB-CB 4.37Å; D346-V525 HydrophobicContact CB-CG1 3.91Å; D346-V525 WeakPolarHBondContact OD1-CB 3.49Å; D346-V525 WeakPolarHBondContact OD1-CG1 3.16Å; D346-R528 IonicContact OD2-CZ 3.4Å; D346-R528 IonicContact OD2-NH1 3.87Å; D346-R528 PolarHBondContact OD2-NH1 2.83Å; D346-R528 IonicContact OD2-NH2 2.7Å; D346-R528 PolarHBondContact OD2-NH2 3.49Å
347	N	89.4	Confident	89.2	Confident	71 Å²	71	56.9 Å²	56.9	38%	0.38	29%	0.292	S	S	.	.	S	Bend	trans	-96.5	141.7	-178.5	-56.1	-87.1	0	0	0	112.5	D345 P441	D345-N347 PolarHBondContact O-N 2.92Å; D345-N347 WeakPolarHBondContact OD1-CB 3.27Å; D345-N347 PolarHBondContact OD1-N 2.7Å; D345-N347 PolarHBondContact OD1-ND2 2.74Å; N347-P441 VanDerWaalsContact OD1-CD 3.25Å; N347-P441 WeakPolarHBondContact OD1-CD 3.47Å; N347-P441 WeakPolarHBondContact OD1-CG 3.09Å
348	I	90.9	Very high	89.1	Confident	26 Å²	26	56.9 Å²	56.9	13%	0.133	29%	0.292	C	S	.	.			trans	-71.8	137.7	166.2	63.7	171.8	0	0	0	110.2	I337 V354 I435 T439 F523	I337-I348 HydrophobicContact CG2-CG2 4.09Å; I348-V354 HydrophobicContact CB-CG2 3.86Å; I348-V354 HydrophobicContact CG2-CB 4.5Å; I348-V354 HydrophobicContact CG2-CG1 3.97Å; I348-V354 HydrophobicContact CG2-CG2 3.62Å; I348-I435 HydrophobicContact CD1-CG2 3.93Å; I348-T439 HydrophobicContact CD1-CG2 4.16Å; I348-F523 HydrophobicContact CG2-CE1 4.16Å; I348-F523 HydrophobicContact CG2-CZ 4.5Å
349	Q	90	Very high	89	Confident	82 Å²	82	57.1 Å²	57.1	38%	0.383	29%	0.291	S	S	.	.			trans	-131.5	150.1	178.1	-60.3	-160.3	7.4	0	0	111.5	D345 R352	D345-Q349 PolarHBondContact OD2-NE2 3.46Å; Q349-R352 HydrophobicContact CB-CG 4.23Å; Q349-R352 VanDerWaalsContact CD-CZ 3.44Å; Q349-R352 VanDerWaalsContact CD-NH1 3.29Å; Q349-R352 PolarHBondContact O-N 3.13Å
350	I	91.8	Very high	89	Confident	112 Å²	112	56.7 Å²	56.7	57%	0.574	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	138.2	173.2	-68.5	175.6	0	0	0	109.2	R352 L407 F412	I350-R352 VanDerWaalsContact C-N 3.29Å; I350-R352 PolarHBondContact O-N 2.96Å; I350-L407 CarbonylContact C-O 3.56Å; I350-L407 WeakPolarHBondContact CA-O 3.22Å; I350-L407 WeakPolarHBondContact CG2-O 3.3Å; I350-F412 HydrophobicContact CD1-CZ 4.4Å; I350-F412 HydrophobicContact CG1-CZ 4.44Å
351	G	90.4	Very high	88.9	Confident	45 Å²	45	58.4 Å²	58.4	46%	0.464	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.6	-3.4	-176.7	0	0	0	0	0	115.2	L407	G351-L407 PolarHBondContact N-O 2.66Å
352	R	91.8	Very high	89.4	Confident	50 Å²	50	57.4 Å²	57.4	19%	0.189	29%	0.287	C	S	.	.	S	Bend	trans	-99.4	169.7	171.9	-69.2	-166.3	-172.9	152.6	2.3	111.9	D340 D345 Q349 I350 L407	D340-R352 HydrophobicContact CB-CB 3.99Å; D340-R352 HydrophobicContact CB-CG 4.41Å; D340-R352 WeakPolarHBondContact OD2-CB 3.27Å; D340-R352 WeakPolarHBondContact OD2-CD 3.39Å; D340-R352 WeakPolarHBondContact OD2-CG 3.49Å; D345-R352 IonicContact OD2-CZ 3.3Å; D345-R352 IonicContact OD2-NH1 3.68Å; D345-R352 PolarHBondContact OD2-NH1 3.15Å; D345-R352 IonicContact OD2-NH2 3.47Å; Q349-R352 HydrophobicContact CB-CG 4.23Å; Q349-R352 VanDerWaalsContact CD-CZ 3.44Å; Q349-R352 VanDerWaalsContact CD-NH1 3.29Å; Q349-R352 PolarHBondContact O-N 3.13Å; I350-R352 VanDerWaalsContact C-N 3.29Å; I350-R352 PolarHBondContact O-N 2.96Å; R352-L407 VanDerWaalsContact O-CB 3.29Å; R352-L407 WeakPolarHBondContact O-CB 3.29Å; R352-L407 PolarHBondContact O-N 3Å
353	E	91.4	Very high	89.8	Confident	68 Å²	68	49.2 Å²	49.2	32%	0.318	26%	0.258	S	S	.	.			trans	-79	144.9	170.7	-171.1	174	-176.6	0	0	111.4	D340 I404	D340-E353 PolarHBondContact N-O 3.23Å; E353-I404 WeakPolarHBondContact CA-O 3.45Å
354	V	93.9	Very high	90.2	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	126.6	168.1	177.5	0	0	0	0	109.9	I337 I348 I404 L407	I337-V354 HydrophobicContact CG2-CG1 3.85Å; I348-V354 HydrophobicContact CB-CG2 3.86Å; I348-V354 HydrophobicContact CG2-CB 4.5Å; I348-V354 HydrophobicContact CG2-CG1 3.97Å; I348-V354 HydrophobicContact CG2-CG2 3.62Å; V354-I404 PolarHBondContact N-O 3.07Å; V354-I404 WeakPolarHBondContact O-CB 3.46Å; V354-I404 PolarHBondContact O-N 3.15Å; V354-L407 HydrophobicContact CG2-CD2 3.89Å
355	K	94.7	Very high	90.7	Very high	60 Å²	60	39.4 Å²	39.4	26%	0.261	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	125.2	176.9	172.4	177.2	-152	83.6	0	110.5	T338 N401 D403	T338-K355 PolarHBondContact N-O 3.46Å; T338-K355 PolarHBondContact O-N 2.83Å; K355-N401 VanDerWaalsContact CE-CG 3.47Å; K355-N401 WeakPolarHBondContact CE-OD1 3.23Å; K355-N401 HydrophobicContact CG-CB 4.38Å; K355-D403 VanDerWaalsContact CB-OD1 3.3Å; K355-D403 WeakPolarHBondContact CB-OD1 3.42Å; K355-D403 WeakPolarHBondContact CD-OD1 3.46Å; K355-D403 WeakPolarHBondContact CE-OD1 3.35Å; K355-D403 WeakPolarHBondContact CG-OD1 3.48Å; K355-D403 IonicContact NZ-OD1 3.4Å; K355-D403 PolarHBondContact NZ-OD1 2.65Å; K355-D403 IonicContact NZ-OD2 2.65Å; K355-D403 PolarHBondContact NZ-OD2 2.97Å
356	I	95.6	Very high	90.9	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	117.5	168.7	-46.9	177.6	0	0	0	108	W373 N401 L402 I404 Y415 V433 I435	I356-W373 HydrophobicContact CB-CH2 4.09Å; I356-W373 HydrophobicContact CB-CZ3 4.47Å; I356-W373 HydrophobicContact CG2-CH2 3.88Å; I356-W373 HydrophobicContact CG2-CZ3 4.19Å; I356-N401 CarbonylContact O-C 3.47Å; I356-N401 VanDerWaalsContact O-CA 3.3Å; I356-N401 WeakPolarHBondContact O-CA 3.44Å; I356-L402 HydrophobicContact CD1-CD2 4.47Å; I356-L402 PolarHBondContact N-O 2.77Å; I356-L402 PolarHBondContact O-N 3.09Å; I356-I404 HydrophobicContact CD1-CD1 4.25Å; I356-Y415 HydrophobicContact CD1-CD2 3.77Å; I356-Y415 HydrophobicContact CD1-CE2 4.47Å; I356-Y415 HydrophobicContact CD1-CG 3.81Å; I356-V433 HydrophobicContact CD1-CG1 4.45Å; I356-V433 HydrophobicContact CG2-CB 4.03Å; I356-V433 HydrophobicContact CG2-CG1 3.89Å; I356-V433 HydrophobicContact CG2-CG2 3.91Å; I356-I435 HydrophobicContact CD1-CD1 4Å; I356-I435 HydrophobicContact CD1-CG1 3.67Å; I356-I435 HydrophobicContact CG1-CD1 4.33Å; I356-I435 HydrophobicContact CG1-CG1 4.46Å
357	S	94.7	Very high	90.8	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.014	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	144.1	174.3	-63.4	0	0	0	0	110.6	F335 W336 T400 N401	F335-S357 CarbonylContact C-O 3.57Å; F335-S357 WeakPolarHBondContact CA-O 2.97Å; F335-S357 WeakPolarHBondContact CB-O 3.43Å; W336-S357 PolarHBondContact N-O 2.84Å; W336-S357 PolarHBondContact NE1-OG 3.17Å; W336-S357 PolarHBondContact O-N 2.93Å; S357-T400 CarbonylContact C-O 3.54Å; S357-T400 WeakPolarHBondContact CA-O 3.45Å; S357-N401 WeakPolarHBondContact CB-OD1 3.31Å; S357-N401 PolarHBondContact OG-OD1 2.02Å
358	C	94.3	Very high	90.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	137.7	171	-64.8	0	0	0	0	110.3	R334 T399 T400 C417	R334-C358 CarbonylContact O-C 3.54Å; R334-C358 WeakPolarHBondContact O-CA 2.94Å; C358-T399 CarbonylContact O-C 3.57Å; C358-T399 VanDerWaalsContact O-CA 3.29Å; C358-T399 WeakPolarHBondContact O-CA 3.49Å; C358-T399 WeakPolarHBondContact O-CG2 3.39Å; C358-T400 HydrophobicContact CB-CG2 4.02Å; C358-T400 PolarHBondContact N-O 2.85Å; C358-T400 PolarHBondContact O-N 2.98Å; C358-C417 HydrophobicContact CB-CB 3.69Å; C358-C417 WeakPolarHBondContact CB-SG 3.29Å; C358-C417 WeakPolarHBondContact SG-CB 3.15Å; C358-C417 CovalentContact SG-SG 2.02Å; C358-C417 PolarHBondContact SG-SG 2.94Å
359	Q	92.1	Very high	90.7	Very high	31 Å²	31	42.7 Å²	42.7	15%	0.145	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	143.2	-179.6	-178.7	173.3	46.5	0	0	111.3	G333 R334 W336 V361 P397 G398 T399	G333-Q359 CarbonylContact C-O 3.59Å; G333-Q359 WeakPolarHBondContact CA-O 3.35Å; R334-Q359 PolarHBondContact N-O 2.94Å; R334-Q359 PolarHBondContact O-N 2.83Å; W336-Q359 HydrophobicContact CH2-CB 3.84Å; W336-Q359 HydrophobicContact CZ3-CB 3.75Å; Q359-V361 HydrophobicContact CG-CG2 4.28Å; Q359-P397 PolarHBondContact NE2-O 2.8Å; Q359-G398 CarbonylContact C-O 3.6Å; Q359-G398 VanDerWaalsContact CA-O 3.25Å; Q359-G398 WeakPolarHBondContact CA-O 3.01Å; Q359-T399 HydrophobicContact CB-CG2 4.46Å; Q359-T399 WeakPolarHBondContact CG-OG1 3.4Å; Q359-T399 PolarHBondContact NE2-OG1 2.8Å
360	V	91.6	Very high	90.7	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.012	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	113.5	158.9	179.8	0	0	0	0	107.8	L330 K331 A363 L369 F371 G398 A419 I429	L330-V360 HydrophobicContact CD2-CG1 4.09Å; K331-V360 WeakPolarHBondContact O-CG1 3.43Å; V360-A363 HydrophobicContact CG1-CB 4.03Å; V360-L369 HydrophobicContact CB-CD2 4.4Å; V360-L369 HydrophobicContact CG2-CD1 4.47Å; V360-F371 HydrophobicContact CG2-CE1 4.24Å; V360-F371 HydrophobicContact CG2-CZ 4.14Å; V360-G398 PolarHBondContact N-O 2.92Å; V360-A419 HydrophobicContact CG2-CB 3.54Å; V360-I429 HydrophobicContact CG1-CD1 4.19Å; V360-I429 HydrophobicContact CG2-CD1 4.36Å
361	V	86.6	Confident	90.8	Very high	51 Å²	51	37.5 Å²	37.5	31%	0.309	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	-34.4	-174.7	-178.8	0	0	0	0	111.6	K332 R334 Q359	K332-V361 HydrophobicContact CB-CB 4.03Å; K332-V361 HydrophobicContact CB-CG2 4.43Å; K332-V361 WeakPolarHBondContact O-CG2 3.34Å; K332-V361 PolarHBondContact O-N 2.97Å; K332-V361 VanDerWaalsContact O-N 3.09Å; R334-V361 HydrophobicContact CG-CG2 4.23Å; Q359-V361 HydrophobicContact CG-CG2 4.28Å
362	E	88.4	Confident	90.9	Very high	68 Å²	68	38.3 Å²	38.3	32%	0.318	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	86	-179.4	-79.4	169.2	-155.5	0	0	109.2	L330 K331 K332	L330-E362 CarbonylContact C-O 3.54Å; L330-E362 WeakPolarHBondContact CA-O 3.18Å; K331-E362 HydrophobicContact CB-CB 3.76Å; K331-E362 VanDerWaalsContact CB-OE2 3.28Å; K331-E362 WeakPolarHBondContact CB-OE2 3.46Å; K331-E362 VanDerWaalsContact CD-OE2 3.3Å; K331-E362 WeakPolarHBondContact CD-OE2 3.23Å; K331-E362 PolarHBondContact N-O 2.88Å; K331-E362 PolarHBondContact O-N 2.87Å; K332-E362 WeakPolarHBondContact CD-OE1 3.47Å; K332-E362 WeakPolarHBondContact CE-OE1 3.35Å; K332-E362 IonicContact NZ-OE1 2.62Å; K332-E362 PolarHBondContact NZ-OE1 2.88Å
363	A	88.9	Confident	91.2	Very high	17 Å²	17	36.3 Å²	36.3	14%	0.14	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	133.3	169.8	0	0	0	0	0	109.6	L330 V360 L369	L330-A363 HydrophobicContact CD2-CB 4.04Å; V360-A363 HydrophobicContact CG1-CB 4.03Å; A363-L369 HydrophobicContact CB-CB 4.49Å; A363-L369 HydrophobicContact CB-CD1 4.21Å; A363-L369 HydrophobicContact CB-CD2 3.91Å; A363-L369 HydrophobicContact CB-CG 4.45Å
364	T	90.3	Very high	91.4	Very high	54 Å²	54	35.1 Å²	35.1	33%	0.331	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	123.9	-177.9	-57.8	0	0	0	0	110.1	V326 R328 A329 L421	V326-T364 HydrophobicContact CG1-CG2 3.62Å; R328-T364 VanDerWaalsContact CA-O 3.24Å; R328-T364 WeakPolarHBondContact CA-O 3.47Å; A329-T364 PolarHBondContact N-O 2.74Å; A329-T364 PolarHBondContact O-N 2.95Å; T364-L421 WeakPolarHBondContact O-CD1 3.42Å
365	P	88.9	Confident	91.5	Very high	7 Å²	7	37.1 Å²	37.1	5%	0.045	20%	0.201	C	C	.	.	S	Bend	cis	-69	145.1	-15.6	32.2	-34.5	0	0	0	111.3	V252 V326 E367 E368	V252-P365 HydrophobicContact CG1-CG 4.07Å; V326-P365 HydrophobicContact CG1-CB 4.36Å; P365-E367 VanDerWaalsContact C-N 3.35Å; P365-E367 PolarHBondContact O-N 3.02Å; P365-E368 HydrophobicContact CG-CB 4.06Å; P365-E368 HydrophobicContact CG-CG 3.87Å; P365-E368 PolarHBondContact O-N 2.92Å
366	P	86.7	Confident	91.5	Very high	69 Å²	69	38.8 Å²	38.8	45%	0.448	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-66.9	-30.1	-173.1	27	-35.2	0	0	0	113.9	E368 L369	P366-E368 VanDerWaalsContact C-N 3.26Å; P366-E368 PolarHBondContact O-N 2.95Å; P366-L369 WeakPolarHBondContact O-CB 3.46Å; P366-L369 PolarHBondContact O-N 2.8Å
367	E	85.1	Confident	91.4	Very high	127 Å²	127	41.6 Å²	41.6	59%	0.593	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-72.4	-15.3	179.3	69.6	-81	-170.8	0	0	113.9	P365 L369 K422	P365-E367 VanDerWaalsContact C-N 3.35Å; P365-E367 PolarHBondContact O-N 3.02Å; E367-L369 VanDerWaalsContact C-N 3.32Å; E367-K422 PolarHBondContact O-NZ 2.82Å
368	E	87.8	Confident	91.4	Very high	29 Å²	29	51.3 Å²	51.3	14%	0.136	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-78.7	-14.8	168.1	-84.4	-168.9	-141.9	0	0	113.1	R328 P365 P366 L421 K422 G423	R328-E368 IonicContact CZ-OE1 3.08Å; R328-E368 VanDerWaalsContact CZ-OE1 3.29Å; R328-E368 IonicContact CZ-OE2 3.26Å; R328-E368 VanDerWaalsContact NE-CD 3.32Å; R328-E368 IonicContact NE-OE1 2.66Å; R328-E368 PolarHBondContact NE-OE1 3.23Å; R328-E368 IonicContact NE-OE2 3.35Å; R328-E368 PolarHBondContact NE-OE2 2.92Å; R328-E368 IonicContact NH2-OE1 3.72Å; R328-E368 PolarHBondContact NH2-OE1 3.5Å; R328-E368 IonicContact NH2-OE2 2.76Å; P365-E368 HydrophobicContact CG-CB 4.06Å; P365-E368 HydrophobicContact CG-CG 3.87Å; P365-E368 PolarHBondContact O-N 2.92Å; P366-E368 VanDerWaalsContact C-N 3.26Å; P366-E368 PolarHBondContact O-N 2.95Å; E368-L421 HydrophobicContact CB-CB 4.23Å; E368-L421 HydrophobicContact CB-CD2 3.91Å; E368-L421 WeakPolarHBondContact O-CA 3.49Å; E368-K422 HydrophobicContact CG-CB 4.4Å; E368-K422 WeakPolarHBondContact O-CG 3.33Å; E368-K422 PolarHBondContact O-N 2.88Å; E368-G423 VanDerWaalsContact OE2-CA 3.31Å; E368-G423 WeakPolarHBondContact OE2-CA 3.35Å; E368-G423 PolarHBondContact OE2-N 3.32Å
369	L	89.9	Confident	91.4	Very high	23 Å²	23	55.4 Å²	55.4	12%	0.12	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	138.6	-176.7	-171	64.8	0	0	0	111.8	L330 V360 A363 P366 E367 F371 G398 A419 A420 L421	L330-L369 HydrophobicContact CD2-CD1 3.73Å; V360-L369 HydrophobicContact CB-CD2 4.4Å; V360-L369 HydrophobicContact CG2-CD1 4.47Å; A363-L369 HydrophobicContact CB-CB 4.49Å; A363-L369 HydrophobicContact CB-CD1 4.21Å; A363-L369 HydrophobicContact CB-CD2 3.91Å; A363-L369 HydrophobicContact CB-CG 4.45Å; P366-L369 WeakPolarHBondContact O-CB 3.46Å; P366-L369 PolarHBondContact O-N 2.8Å; E367-L369 VanDerWaalsContact C-N 3.32Å; L369-F371 HydrophobicContact CD2-CE2 3.63Å; L369-F371 HydrophobicContact CD2-CZ 3.89Å; L369-F371 HydrophobicContact CG-CE2 3.9Å; L369-F371 HydrophobicContact CG-CZ 4.29Å; L369-G398 VanDerWaalsContact CD2-CA 3.43Å; L369-A419 HydrophobicContact CD1-CB 4.28Å; L369-A420 CarbonylContact C-O 3.57Å; L369-A420 WeakPolarHBondContact CA-O 3.47Å; L369-L421 HydrophobicContact CB-CD2 4.37Å; L369-L421 HydrophobicContact CD1-CD2 4.42Å
370	T	90.5	Very high	91.6	Very high	56 Å²	56	55.6 Å²	55.6	34%	0.344	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	150.8	173.8	56.2	0	0	0	0	110.1	A419 A420 K422	T370-A419 WeakPolarHBondContact O-CA 3.39Å; T370-A420 PolarHBondContact N-O 2.84Å; T370-A420 PolarHBondContact O-N 2.89Å; T370-A420 PolarHBondContact OG1-O 2.88Å; T370-A420 VanDerWaalsContact OG1-O 3.06Å; T370-K422 HydrophobicContact CG2-CD 4.2Å; T370-K422 HydrophobicContact CG2-CG 3.8Å
371	F	92.4	Very high	91.6	Very high	28 Å²	28	65.6 Å²	65.6	12%	0.123	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	138.9	174.6	-71.6	-83.5	0	0	0	111.1	V360 L369 Q390 G398 T400 V418 A419	V360-F371 HydrophobicContact CG2-CE1 4.24Å; V360-F371 HydrophobicContact CG2-CZ 4.14Å; L369-F371 HydrophobicContact CD2-CE2 3.63Å; L369-F371 HydrophobicContact CD2-CZ 3.89Å; L369-F371 HydrophobicContact CG-CE2 3.9Å; L369-F371 HydrophobicContact CG-CZ 4.29Å; F371-Q390 PolarHBondContact O-NE2 3.39Å; F371-G398 WeakPolarHBondContact CZ-O 3.4Å; F371-T400 HydrophobicContact CB-CG2 3.77Å; F371-T400 HydrophobicContact CD1-CG2 3.38Å; F371-T400 HydrophobicContact CD2-CG2 4.07Å; F371-T400 HydrophobicContact CE1-CG2 3.92Å; F371-T400 HydrophobicContact CG-CG2 3.46Å; F371-T400 VanDerWaalsContact CG-CG2 3.46Å; F371-T400 HydrophobicContact CZ-CG2 4.48Å; F371-V418 WeakPolarHBondContact CA-O 3.34Å; F371-A419 HydrophobicContact CD1-CB 3.79Å; F371-A419 HydrophobicContact CE1-CB 3.47Å; F371-A419 VanDerWaalsContact CE1-CB 3.47Å; F371-A419 HydrophobicContact CZ-CB 4.16Å
372	S	93.9	Very high	91.9	Very high	63 Å²	63	66.5 Å²	66.5	44%	0.441	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	154.3	163.5	71.1	0	0	0	0	110.4	V418	S372-V418 PolarHBondContact N-O 2.89Å; S372-V418 PolarHBondContact O-N 2.81Å
373	W	96.8	Very high	92.1	Very high	7 Å²	7	66.1 Å²	66.1	3%	0.027	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	140.5	-179.5	-76.6	90	0	0	0	110.8	I356 L380 I388 T400 L402 T416 C417	I356-W373 HydrophobicContact CB-CH2 4.09Å; I356-W373 HydrophobicContact CB-CZ3 4.47Å; I356-W373 HydrophobicContact CG2-CH2 3.88Å; I356-W373 HydrophobicContact CG2-CZ3 4.19Å; W373-L380 HydrophobicContact CB-CB 4.13Å; W373-L380 HydrophobicContact CB-CD2 4.43Å; W373-L380 PolarHBondContact O-N 2.94Å; W373-I388 HydrophobicContact CB-CD1 3.97Å; W373-I388 HydrophobicContact CG-CD1 4.11Å; W373-T400 HydrophobicContact CZ2-CG2 3.82Å; W373-T400 PolarHBondContact NE1-OG1 3.25Å; W373-L402 HydrophobicContact CD2-CB 4.19Å; W373-L402 HydrophobicContact CE3-CB 4.2Å; W373-L402 HydrophobicContact CE3-CD2 4.01Å; W373-L402 HydrophobicContact CH2-CB 3.8Å; W373-L402 HydrophobicContact CZ2-CB 3.8Å; W373-L402 HydrophobicContact CZ3-CB 4.02Å; W373-L402 HydrophobicContact CZ3-CD2 4.13Å; W373-T416 CarbonylContact C-O 3.59Å; W373-T416 WeakPolarHBondContact CA-O 3.25Å; W373-C417 HydrophobicContact CD2-CB 4.06Å; W373-C417 HydrophobicContact CE3-CB 3.92Å; W373-C417 HydrophobicContact CH2-CB 3.97Å; W373-C417 HydrophobicContact CZ2-CB 4.08Å; W373-C417 HydrophobicContact CZ3-CB 3.88Å
374	L	97.1	Very high	92.1	Very high	44 Å²	44	74.4 Å²	74.4	23%	0.23	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	144.9	171.6	-45.7	176.4	0	0	0	109.3	R378 A379 Y415 T416 V418	L374-R378 CarbonylContact C-O 3.59Å; L374-R378 WeakPolarHBondContact CA-O 3.32Å; L374-A379 HydrophobicContact CD2-CB 4.41Å; L374-Y415 CarbonylContact O-C 3.51Å; L374-Y415 WeakPolarHBondContact O-CA 3.37Å; L374-T416 HydrophobicContact CD1-CG2 4.42Å; L374-T416 PolarHBondContact N-O 3.05Å; L374-T416 PolarHBondContact O-N 3.27Å; L374-V418 HydrophobicContact CD1-CG2 4.27Å; L374-V418 HydrophobicContact CG-CG2 4.49Å
375	K	95.9	Very high	92.2	Very high	42 Å²	42	74.9 Å²	74.9	18%	0.183	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	121	162.3	-177	-179.6	177.5	179.4	0	108.3	G377 R378 L380 T410 D411 T414 Y415	K375-G377 VanDerWaalsContact C-N 3.27Å; K375-G377 PolarHBondContact O-N 2.98Å; K375-R378 PolarHBondContact N-O 3.06Å; K375-R378 PolarHBondContact O-N 2.8Å; K375-L380 HydrophobicContact CB-CD1 4.36Å; K375-T410 PolarHBondContact NZ-O 2.82Å; K375-D411 IonicContact NZ-OD1 2.75Å; K375-T414 WeakPolarHBondContact CA-O 3.47Å; K375-Y415 HydrophobicContact CB-CD1 4.2Å; K375-Y415 HydrophobicContact CB-CE1 4.05Å; K375-Y415 HydrophobicContact CD-CE1 3.7Å; K375-Y415 WeakPolarHBondContact CE-OH 3.45Å; K375-Y415 HydrophobicContact CG-CD1 4.22Å; K375-Y415 HydrophobicContact CG-CE1 3.74Å; K375-Y415 PolarHBondContact NZ-OH 2.91Å
376	N	94.4	Very high	92.5	Very high	94 Å²	94	75.2 Å²	75.2	50%	0.503	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	49	46.8	-176.4	-58.6	-25.5	0	0	0	112.3	R378 G413 T414	N376-R378 VanDerWaalsContact C-N 3.27Å; N376-R378 PolarHBondContact O-N 2.83Å; N376-G413 VanDerWaalsContact OD1-CA 3.29Å; N376-G413 WeakPolarHBondContact OD1-CA 3.4Å; N376-T414 PolarHBondContact N-O 3.22Å; N376-T414 PolarHBondContact OD1-N 2.85Å
377	G	93	Very high	92.8	Very high	60 Å²	60	74 Å²	74	62%	0.619	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	3.7	-179.4	0	0	0	0	0	116.3	K375	K375-G377 VanDerWaalsContact C-N 3.27Å; K375-G377 PolarHBondContact O-N 2.98Å
378	R	94.9	Very high	93.3	Very high	206 Å²	206	69.7 Å²	69.7	78%	0.777	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.6	138.1	177.5	-61.3	-175.7	179.8	-164.9	-0.8	111.1	L374 K375 N376 L380	L374-R378 CarbonylContact C-O 3.59Å; L374-R378 WeakPolarHBondContact CA-O 3.32Å; K375-R378 PolarHBondContact N-O 3.06Å; K375-R378 PolarHBondContact O-N 2.8Å; N376-R378 VanDerWaalsContact C-N 3.27Å; N376-R378 PolarHBondContact O-N 2.83Å; R378-L380 PolarHBondContact O-N 2.89Å
379	A	94.8	Very high	93.4	Very high	85 Å²	85	70.8 Å²	70.8	70%	0.702	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.1	123	179.9	0	0	0	0	0	112.4	L374	L374-A379 HydrophobicContact CD2-CB 4.41Å
380	L	94.9	Very high	93.1	Very high	35 Å²	35	75.4 Å²	75.4	18%	0.183	40%	0.399	C	S	.	.			trans	-93.5	141.8	177.1	-173.1	64.5	0	0	0	109.5	W373 K375 R378 M386 I388 L402 Y415	W373-L380 HydrophobicContact CB-CB 4.13Å; W373-L380 HydrophobicContact CB-CD2 4.43Å; W373-L380 PolarHBondContact O-N 2.94Å; K375-L380 HydrophobicContact CB-CD1 4.36Å; R378-L380 PolarHBondContact O-N 2.89Å; L380-M386 HydrophobicContact CD1-SD 4.1Å; L380-I388 HydrophobicContact CD2-CD1 4.44Å; L380-I388 HydrophobicContact CG-CD1 4.27Å; L380-L402 HydrophobicContact CD2-CD1 3.91Å; L380-L402 HydrophobicContact CD2-CD2 3.58Å; L380-L402 HydrophobicContact CD2-CG 4.42Å; L380-Y415 HydrophobicContact CD2-CD1 4.19Å; L380-Y415 HydrophobicContact CD2-CE1 4.23Å
381	R	92.3	Very high	92.3	Very high	212 Å²	212	74.8 Å²	74.8	80%	0.8	40%	0.395	S	S	*	.			trans	-120	149.6	175.1	-66.1	-176.1	178.2	-174.4	-1.2	109.5
382	S	93	Very high	91	Very high	70 Å²	70	77.4 Å²	77.4	49%	0.49	41%	0.41	S	S	.	.			trans	-60.5	142.7	174.5	-158.8	0	0	0	0	110.7	M386 I388	S382-M386 CarbonylContact C-O 3.59Å; S382-M386 WeakPolarHBondContact CA-O 3.24Å; S382-I388 PolarHBondContact OG-N 2.82Å
383	S	93.4	Very high	89.4	Confident	60 Å²	60	77.8 Å²	77.8	42%	0.42	41%	0.411	S	S	.	.	B	Isolated β-bridge	trans	-155.6	167.2	-177.5	62.7	0	0	0	0	110.3	R385 M386 V387	S383-R385 PolarHBondContact O-N 3.42Å; S383-M386 PolarHBondContact N-O 2.83Å; S383-M386 CarbonylContact O-C 3.55Å; S383-M386 VanDerWaalsContact O-C 3.29Å; S383-M386 PolarHBondContact O-N 2.04Å; S383-M386 PolarHBondContact OG-N 2.81Å; S383-M386 PolarHBondContact OG-O 3.37Å; S383-V387 WeakPolarHBondContact O-CG2 3.29Å
384	E	88.9	Confident	87.5	Confident	191 Å²	191	84.9 Å²	84.9	89%	0.893	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-20.6	-178	-62.1	178.5	167.2	0	0	115.1
385	R	92.5	Very high	85.8	Confident	64 Å²	64	89.3 Å²	89.3	24%	0.242	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.4	-10.3	-177.7	-154	-162.8	60.4	92.1	1.4	114.6	S383 I405 D406 D411	S383-R385 PolarHBondContact O-N 3.42Å; R385-I405 WeakPolarHBondContact CD-O 3.08Å; R385-I405 HydrophobicContact CG-CB 4.03Å; R385-I405 WeakPolarHBondContact CG-O 3.25Å; R385-I405 PolarHBondContact NH1-O 3.21Å; R385-I405 PolarHBondContact O-N 3.18Å; R385-D406 PolarHBondContact NH1-O 3.01Å; R385-D411 IonicContact CZ-OD1 3.76Å; R385-D411 IonicContact CZ-OD2 2.82Å; R385-D411 VanDerWaalsContact CZ-OD2 3.27Å; R385-D411 IonicContact NH1-OD2 3.65Å; R385-D411 PolarHBondContact NH1-OD2 2.81Å; R385-D411 IonicContact NH2-OD1 2.64Å; R385-D411 PolarHBondContact NH2-OD1 3.44Å; R385-D411 IonicContact NH2-OD2 2.6Å; R385-D411 PolarHBondContact NH2-OD2 2.92Å
386	M	93.6	Very high	84.1	Confident	14 Å²	14	89.5 Å²	89.5	7%	0.069	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	86.1	171.7	-79.5	-177.5	167	0	0	106.5	L380 S382 S383 L402 D403 I404 D411 Y415	L380-M386 HydrophobicContact CD1-SD 4.1Å; S382-M386 CarbonylContact C-O 3.59Å; S382-M386 WeakPolarHBondContact CA-O 3.24Å; S383-M386 PolarHBondContact N-O 2.83Å; S383-M386 CarbonylContact O-C 3.55Å; S383-M386 VanDerWaalsContact O-C 3.29Å; S383-M386 PolarHBondContact O-N 2.04Å; S383-M386 PolarHBondContact OG-N 2.81Å; S383-M386 PolarHBondContact OG-O 3.37Å; M386-L402 HydrophobicContact CB-CD1 4.05Å; M386-D403 WeakPolarHBondContact CA-O 3.35Å; M386-I404 HydrophobicContact CE-CD1 4.33Å; M386-I404 HydrophobicContact CE-CG1 4.45Å; M386-I404 HydrophobicContact CE-CG2 4.06Å; M386-I404 HydrophobicContact CG-CG1 4.46Å; M386-I404 HydrophobicContact CG-CG2 4.44Å; M386-D411 HydrophobicContact CE-CB 4.05Å; M386-D411 VanDerWaalsContact CE-OD1 3.24Å; M386-D411 WeakPolarHBondContact CE-OD1 3.05Å; M386-Y415 HydrophobicContact CE-CE1 4.24Å; M386-Y415 VanDerWaalsContact CE-OH 3.25Å; M386-Y415 WeakPolarHBondContact CE-OH 3.36Å
387	V	94.5	Very high	82.6	Confident	45 Å²	45	88.6 Å²	88.6	27%	0.273	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	118.7	-173	-174.9	0	0	0	0	108.1	S383 T389 L402 D403 I405	S383-V387 WeakPolarHBondContact O-CG2 3.29Å; V387-T389 HydrophobicContact CG1-CG2 4.12Å; V387-L402 WeakPolarHBondContact O-CA 3.06Å; V387-D403 HydrophobicContact CB-CB 4.31Å; V387-D403 PolarHBondContact N-O 2.86Å; V387-D403 PolarHBondContact O-N 2.96Å; V387-I405 HydrophobicContact CG2-CD1 4.24Å
388	I	94.2	Very high	81.8	Confident	36 Å²	36	86.3 Å²	86.3	19%	0.185	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	124.9	171.8	-61.7	172.2	0	0	0	108.3	W373 L380 S382 N401 L402	W373-I388 HydrophobicContact CB-CD1 3.97Å; W373-I388 HydrophobicContact CG-CD1 4.11Å; L380-I388 HydrophobicContact CD2-CD1 4.44Å; L380-I388 HydrophobicContact CG-CD1 4.27Å; S382-I388 PolarHBondContact OG-N 2.82Å; I388-N401 CarbonylContact C-O 3.56Å; I388-N401 WeakPolarHBondContact CA-O 3.14Å; I388-L402 HydrophobicContact CG1-CD1 3.9Å
389	T	90.2	Very high	81.6	Confident	51 Å²	51	76.8 Å²	76.8	31%	0.313	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	156.4	172	58	0	0	0	0	111	V387 T400 N401	V387-T389 HydrophobicContact CG1-CG2 4.12Å; T389-T400 CarbonylContact O-C 3.57Å; T389-T400 WeakPolarHBondContact O-CA 3.32Å; T389-T400 PolarHBondContact O-OG1 3.13Å; T389-N401 PolarHBondContact N-O 3.3Å; T389-N401 PolarHBondContact O-N 2.9Å; T389-N401 WeakPolarHBondContact OG1-CB 3.43Å; T389-N401 PolarHBondContact OG1-ND2 3.47Å
390	Q	82.9	Confident	81.5	Confident	121 Å²	121	72.8 Å²	72.8	57%	0.565	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.5	133.5	169.1	-69.6	173.3	-3	0	0	106.1	F371	F371-Q390 PolarHBondContact O-NE2 3.39Å
391	T	74.4	Confident	81.4	Confident	42 Å²	42	71.7 Å²	71.7	26%	0.258	38%	0.381	S	S	.	.			trans	-75.2	151.2	175.1	58.9	0	0	0	0	109.5	S396 T399	T391-S396 PolarHBondContact OG1-O 2.93Å; T391-S396 VanDerWaalsContact OG1-O 3.05Å; T391-T399 HydrophobicContact CG2-CG2 4.45Å; T391-T399 PolarHBondContact N-O 2.82Å; T391-T399 WeakPolarHBondContact OG1-CB 3.28Å; T391-T399 PolarHBondContact OG1-O 2.98Å; T391-T399 VanDerWaalsContact OG1-O 3.13Å
392	D	65.7	Low	81.6	Confident	84 Å²	84	61.6 Å²	61.6	45%	0.449	34%	0.343	S	S	.	.			trans	-57.3	125.6	169.7	-164.9	-45.1	0	0	0	109.6	D394 I395 S396	D392-D394 PolarHBondContact O-N 3.44Å; D392-D394 PolarHBondContact OD1-N 2.59Å; D392-I395 HydrophobicContact CB-CB 4.14Å; D392-I395 HydrophobicContact CB-CD1 3.88Å; D392-I395 HydrophobicContact CB-CG1 3.92Å; D392-I395 PolarHBondContact O-N 3.29Å; D392-S396 PolarHBondContact O-N 2.83Å
393	P	59.4	Low	81.6	Confident	71 Å²	71	59 Å²	59	46%	0.461	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-32	177.7	-27.4	35.7	0	0	0	113.8	I395	P393-I395 VanDerWaalsContact C-N 3.33Å
394	D	58.3	Low	81.7	Confident	156 Å²	156	56.2 Å²	56.2	83%	0.834	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-16.4	-177.5	-67.5	-16.4	0	0	0	112.8	D392	D392-D394 PolarHBondContact O-N 3.44Å; D392-D394 PolarHBondContact OD1-N 2.59Å
395	I	61	Low	81.9	Confident	136 Å²	136	50.4 Å²	50.4	70%	0.697	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-38.7	-178.9	-58.1	178.8	0	0	0	111.5	D392 P393	D392-I395 HydrophobicContact CB-CB 4.14Å; D392-I395 HydrophobicContact CB-CD1 3.88Å; D392-I395 HydrophobicContact CB-CG1 3.92Å; D392-I395 PolarHBondContact O-N 3.29Å; P393-I395 VanDerWaalsContact C-N 3.33Å
396	S	59.9	Low	81.9	Confident	47 Å²	47	50.5 Å²	50.5	33%	0.329	28%	0.283	S	S	.	.	S	Bend	trans	-147.3	109.1	178.9	-71.9	0	0	0	0	109.3	T391 D392 G398	T391-S396 PolarHBondContact OG1-O 2.93Å; T391-S396 VanDerWaalsContact OG1-O 3.05Å; D392-S396 PolarHBondContact O-N 2.83Å; S396-G398 PolarHBondContact O-N 3.03Å; S396-G398 VanDerWaalsContact O-N 3.15Å
397	P	63.6	Low	81.9	Confident	74 Å²	74	50 Å²	50	48%	0.481	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	123.5	-171.6	22.1	-32.6	0	0	0	110.8	Q359 T399	Q359-P397 PolarHBondContact NE2-O 2.8Å; P397-T399 PolarHBondContact O-N 2.02Å; P397-T399 PolarHBondContact O-OG1 3.09Å
398	G	76.1	Confident	81.9	Confident	12 Å²	12	51.7 Å²	51.7	12%	0.124	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	53.2	167.8	0	0	0	0	0	115.6	Q359 V360 L369 F371 S396	Q359-G398 CarbonylContact C-O 3.6Å; Q359-G398 VanDerWaalsContact CA-O 3.25Å; Q359-G398 WeakPolarHBondContact CA-O 3.01Å; V360-G398 PolarHBondContact N-O 2.92Å; L369-G398 VanDerWaalsContact CD2-CA 3.43Å; F371-G398 WeakPolarHBondContact CZ-O 3.4Å; S396-G398 PolarHBondContact O-N 3.03Å; S396-G398 VanDerWaalsContact O-N 3.15Å
399	T	89.2	Confident	81.8	Confident	7 Å²	7	57.1 Å²	57.1	4%	0.043	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	136.8	176.7	-53.8	0	0	0	0	112.5	W336 C358 Q359 T391 P397	W336-T399 HydrophobicContact CH2-CG2 4.06Å; W336-T399 HydrophobicContact CZ2-CG2 4.11Å; C358-T399 CarbonylContact O-C 3.57Å; C358-T399 VanDerWaalsContact O-CA 3.29Å; C358-T399 WeakPolarHBondContact O-CA 3.49Å; C358-T399 WeakPolarHBondContact O-CG2 3.39Å; Q359-T399 HydrophobicContact CB-CG2 4.46Å; Q359-T399 WeakPolarHBondContact CG-OG1 3.4Å; Q359-T399 PolarHBondContact NE2-OG1 2.8Å; T391-T399 HydrophobicContact CG2-CG2 4.45Å; T391-T399 PolarHBondContact N-O 2.82Å; T391-T399 WeakPolarHBondContact OG1-CB 3.28Å; T391-T399 PolarHBondContact OG1-O 2.98Å; T391-T399 VanDerWaalsContact OG1-O 3.13Å; P397-T399 PolarHBondContact O-N 2.02Å; P397-T399 PolarHBondContact O-OG1 3.09Å
400	T	92.6	Very high	81.9	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	148.2	169.5	-176.7	0	0	0	0	110.1	S357 C358 F371 W373 T389	S357-T400 CarbonylContact C-O 3.54Å; S357-T400 WeakPolarHBondContact CA-O 3.45Å; C358-T400 HydrophobicContact CB-CG2 4.02Å; C358-T400 PolarHBondContact N-O 2.85Å; C358-T400 PolarHBondContact O-N 2.98Å; F371-T400 HydrophobicContact CB-CG2 3.77Å; F371-T400 HydrophobicContact CD1-CG2 3.38Å; F371-T400 HydrophobicContact CD2-CG2 4.07Å; F371-T400 HydrophobicContact CE1-CG2 3.92Å; F371-T400 HydrophobicContact CG-CG2 3.46Å; F371-T400 VanDerWaalsContact CG-CG2 3.46Å; F371-T400 HydrophobicContact CZ-CG2 4.48Å; W373-T400 HydrophobicContact CZ2-CG2 3.82Å; W373-T400 PolarHBondContact NE1-OG1 3.25Å; T389-T400 CarbonylContact O-C 3.57Å; T389-T400 WeakPolarHBondContact O-CA 3.32Å; T389-T400 PolarHBondContact O-OG1 3.13Å
401	N	93.7	Very high	82.4	Confident	13 Å²	13	54.2 Å²	54.2	7%	0.07	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	148.9	175.4	-35.5	-81.7	0	0	0	110.8	K355 I356 S357 I388 T389	K355-N401 VanDerWaalsContact CE-CG 3.47Å; K355-N401 WeakPolarHBondContact CE-OD1 3.23Å; K355-N401 HydrophobicContact CG-CB 4.38Å; I356-N401 CarbonylContact O-C 3.47Å; I356-N401 VanDerWaalsContact O-CA 3.3Å; I356-N401 WeakPolarHBondContact O-CA 3.44Å; S357-N401 WeakPolarHBondContact CB-OD1 3.31Å; S357-N401 PolarHBondContact OG-OD1 2.02Å; I388-N401 CarbonylContact C-O 3.56Å; I388-N401 WeakPolarHBondContact CA-O 3.14Å; T389-N401 PolarHBondContact N-O 3.3Å; T389-N401 PolarHBondContact O-N 2.9Å; T389-N401 WeakPolarHBondContact OG1-CB 3.43Å; T389-N401 PolarHBondContact OG1-ND2 3.47Å
402	L	95.9	Very high	83.4	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	109.6	164.5	169.8	61	0	0	0	107.7	I356 W373 L380 M386 V387 I388 I404 Y415	I356-L402 HydrophobicContact CD1-CD2 4.47Å; I356-L402 PolarHBondContact N-O 2.77Å; I356-L402 PolarHBondContact O-N 3.09Å; W373-L402 HydrophobicContact CD2-CB 4.19Å; W373-L402 HydrophobicContact CE3-CB 4.2Å; W373-L402 HydrophobicContact CE3-CD2 4.01Å; W373-L402 HydrophobicContact CH2-CB 3.8Å; W373-L402 HydrophobicContact CZ2-CB 3.8Å; W373-L402 HydrophobicContact CZ3-CB 4.02Å; W373-L402 HydrophobicContact CZ3-CD2 4.13Å; L380-L402 HydrophobicContact CD2-CD1 3.91Å; L380-L402 HydrophobicContact CD2-CD2 3.58Å; L380-L402 HydrophobicContact CD2-CG 4.42Å; M386-L402 HydrophobicContact CB-CD1 4.05Å; V387-L402 WeakPolarHBondContact O-CA 3.06Å; I388-L402 HydrophobicContact CG1-CD1 3.9Å; L402-I404 HydrophobicContact CD1-CG1 4.47Å; L402-I404 HydrophobicContact CD2-CD1 4.42Å; L402-I404 HydrophobicContact CD2-CG1 4.47Å; L402-I404 HydrophobicContact CG-CG1 4.06Å; L402-Y415 HydrophobicContact CD2-CD1 3.3Å; L402-Y415 HydrophobicContact CD2-CE1 3.71Å; L402-Y415 HydrophobicContact CD2-CG 4.09Å
403	D	94.6	Very high	84.8	Confident	16 Å²	16	51 Å²	51	9%	0.086	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	112.9	-179.9	-62.3	-61.5	0	0	0	108.8	K355 M386 V387	K355-D403 VanDerWaalsContact CB-OD1 3.3Å; K355-D403 WeakPolarHBondContact CB-OD1 3.42Å; K355-D403 WeakPolarHBondContact CD-OD1 3.46Å; K355-D403 WeakPolarHBondContact CE-OD1 3.35Å; K355-D403 WeakPolarHBondContact CG-OD1 3.48Å; K355-D403 IonicContact NZ-OD1 3.4Å; K355-D403 PolarHBondContact NZ-OD1 2.65Å; K355-D403 IonicContact NZ-OD2 2.65Å; K355-D403 PolarHBondContact NZ-OD2 2.97Å; M386-D403 WeakPolarHBondContact CA-O 3.35Å; V387-D403 HydrophobicContact CB-CB 4.31Å; V387-D403 PolarHBondContact N-O 2.86Å; V387-D403 PolarHBondContact O-N 2.96Å
404	I	95.2	Very high	86.5	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	104.6	-177.3	-52.3	177.8	0	0	0	108.7	E353 V354 I356 M386 L402 L407 D411 Y415	E353-I404 WeakPolarHBondContact CA-O 3.45Å; V354-I404 PolarHBondContact N-O 3.07Å; V354-I404 WeakPolarHBondContact O-CB 3.46Å; V354-I404 PolarHBondContact O-N 3.15Å; I356-I404 HydrophobicContact CD1-CD1 4.25Å; M386-I404 HydrophobicContact CE-CD1 4.33Å; M386-I404 HydrophobicContact CE-CG1 4.45Å; M386-I404 HydrophobicContact CE-CG2 4.06Å; M386-I404 HydrophobicContact CG-CG1 4.46Å; M386-I404 HydrophobicContact CG-CG2 4.44Å; L402-I404 HydrophobicContact CD1-CG1 4.47Å; L402-I404 HydrophobicContact CD2-CD1 4.42Å; L402-I404 HydrophobicContact CD2-CG1 4.47Å; L402-I404 HydrophobicContact CG-CG1 4.06Å; I404-L407 HydrophobicContact CG2-CD1 3.97Å; I404-D411 HydrophobicContact CG2-CB 4.47Å; I404-Y415 HydrophobicContact CD1-CE1 4.19Å; I404-Y415 HydrophobicContact CD1-CE2 4.2Å
405	I	93.3	Very high	88.4	Confident	70 Å²	70	42.2 Å²	42.2	36%	0.359	23%	0.232	S	C	.	.	S	Bend	trans	-84.3	139.2	-178.5	-57.2	172.1	0	0	0	109.2	R385 V387	R385-I405 WeakPolarHBondContact CD-O 3.08Å; R385-I405 HydrophobicContact CG-CB 4.03Å; R385-I405 WeakPolarHBondContact CG-O 3.25Å; R385-I405 PolarHBondContact NH1-O 3.21Å; R385-I405 PolarHBondContact O-N 3.18Å; V387-I405 HydrophobicContact CG2-CD1 4.24Å
406	D	92.1	Very high	90.1	Very high	66 Å²	66	36.3 Å²	36.3	35%	0.353	20%	0.202	S	C	.	.	S	Bend	trans	51.7	65.2	176.6	175.6	18.1	0	0	0	111.5	R385 K408	R385-D406 PolarHBondContact NH1-O 3.01Å; D406-K408 PolarHBondContact O-N 3.02Å; D406-K408 VanDerWaalsContact OD1-CE 3.28Å; D406-K408 WeakPolarHBondContact OD1-CE 3.48Å; D406-K408 IonicContact OD1-NZ 3.81Å; D406-K408 WeakPolarHBondContact OD2-CE 3.35Å; D406-K408 IonicContact OD2-NZ 2.7Å; D406-K408 PolarHBondContact OD2-NZ 2.9Å
407	L	93.5	Very high	91.8	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	19%	0.187	C	C	.	.			trans	-57.3	125.4	-173.2	-179.7	73.2	0	0	0	111.9	I350 G351 R352 V354 I404 D411 F412 I435	I350-L407 CarbonylContact C-O 3.56Å; I350-L407 WeakPolarHBondContact CA-O 3.22Å; I350-L407 WeakPolarHBondContact CG2-O 3.3Å; G351-L407 PolarHBondContact N-O 2.66Å; R352-L407 VanDerWaalsContact O-CB 3.29Å; R352-L407 WeakPolarHBondContact O-CB 3.29Å; R352-L407 PolarHBondContact O-N 3Å; V354-L407 HydrophobicContact CG2-CD2 3.89Å; I404-L407 HydrophobicContact CG2-CD1 3.97Å; L407-D411 HydrophobicContact CD1-CB 3.79Å; L407-F412 HydrophobicContact CD2-CE1 4.38Å; L407-I435 HydrophobicContact CD1-CG2 4.48Å
408	K	93.3	Very high	93.3	Very high	81 Å²	81	31.3 Å²	31.3	35%	0.352	17%	0.168	S	C	.	.			trans	-117.8	161.6	-179.4	-76.2	152.8	-171	167.6	0	112.2	D406 T410 D411	D406-K408 PolarHBondContact O-N 3.02Å; D406-K408 VanDerWaalsContact OD1-CE 3.28Å; D406-K408 WeakPolarHBondContact OD1-CE 3.48Å; D406-K408 IonicContact OD1-NZ 3.81Å; D406-K408 WeakPolarHBondContact OD2-CE 3.35Å; D406-K408 IonicContact OD2-NZ 2.7Å; D406-K408 PolarHBondContact OD2-NZ 2.9Å; K408-T410 PolarHBondContact O-N 3.14Å; K408-T410 VanDerWaalsContact O-N 3.16Å; K408-D411 PolarHBondContact N-OD2 2.81Å; K408-D411 WeakPolarHBondContact O-CA 3.45Å; K408-D411 VanDerWaalsContact O-CB 3.23Å; K408-D411 WeakPolarHBondContact O-CB 3.34Å; K408-D411 PolarHBondContact O-N 3.45Å
409	F	92.8	Very high	94.1	Very high	151 Å²	151	30.9 Å²	30.9	66%	0.662	16%	0.164	S	C	*	.	G	3₁₀ helix	trans	-56.8	-30.9	174.8	-174.2	-92.8	0	0	0	112.8	D411 F412	F409-D411 PolarHBondContact O-N 2.82Å; F409-F412 AromaticContact CD2-CD2 3.62Å; F409-F412 HydrophobicContact CD2-CD2 3.62Å; F409-F412 AromaticContact CD2-CE2 3.49Å; F409-F412 HydrophobicContact CD2-CE2 3.49Å; F409-F412 VanDerWaalsContact CD2-CE2 3.49Å; F409-F412 AromaticContact CE2-CD2 3.84Å; F409-F412 HydrophobicContact CE2-CD2 3.84Å; F409-F412 AromaticContact CE2-CE2 3.92Å; F409-F412 HydrophobicContact CE2-CE2 3.92Å; F409-F412 HydrophobicContact CG-CD2 4.25Å; F409-F412 HydrophobicContact CG-CE2 4.35Å; F409-F412 PolarHBondContact O-N 2.83Å
410	T	92	Very high	94.3	Very high	106 Å²	106	31.2 Å²	31.2	65%	0.65	17%	0.168	S	C	*	.	G	3₁₀ helix	trans	-66.2	-8.9	172.6	51.3	0	0	0	0	114.4	K375 K408	K375-T410 PolarHBondContact NZ-O 2.82Å; K408-T410 PolarHBondContact O-N 3.14Å; K408-T410 VanDerWaalsContact O-N 3.16Å
411	D	93.9	Very high	94.2	Very high	4 Å²	4	31.8 Å²	31.8	2%	0.021	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-96.6	-7.3	178.3	-55.7	-35.5	0	0	0	113.1	K375 R385 M386 I404 L407 K408 F409 Y415	K375-D411 IonicContact NZ-OD1 2.75Å; R385-D411 IonicContact CZ-OD1 3.76Å; R385-D411 IonicContact CZ-OD2 2.82Å; R385-D411 VanDerWaalsContact CZ-OD2 3.27Å; R385-D411 IonicContact NH1-OD2 3.65Å; R385-D411 PolarHBondContact NH1-OD2 2.81Å; R385-D411 IonicContact NH2-OD1 2.64Å; R385-D411 PolarHBondContact NH2-OD1 3.44Å; R385-D411 IonicContact NH2-OD2 2.6Å; R385-D411 PolarHBondContact NH2-OD2 2.92Å; M386-D411 HydrophobicContact CE-CB 4.05Å; M386-D411 VanDerWaalsContact CE-OD1 3.24Å; M386-D411 WeakPolarHBondContact CE-OD1 3.05Å; I404-D411 HydrophobicContact CG2-CB 4.47Å; L407-D411 HydrophobicContact CD1-CB 3.79Å; K408-D411 PolarHBondContact N-OD2 2.81Å; K408-D411 WeakPolarHBondContact O-CA 3.45Å; K408-D411 VanDerWaalsContact O-CB 3.23Å; K408-D411 WeakPolarHBondContact O-CB 3.34Å; K408-D411 PolarHBondContact O-N 3.45Å; F409-D411 PolarHBondContact O-N 2.82Å; D411-Y415 VanDerWaalsContact O-CE2 3.24Å; D411-Y415 WeakPolarHBondContact O-CE2 2.95Å; D411-Y415 PolarHBondContact O-OH 2.82Å
412	F	95.3	Very high	93.8	Very high	39 Å²	39	37.9 Å²	37.9	17%	0.171	20%	0.196	C	C	.	.			trans	-67.2	141.1	171.6	-61.5	-14.2	0	0	0	110.8	I350 L407 F409 I435	I350-F412 HydrophobicContact CD1-CZ 4.4Å; I350-F412 HydrophobicContact CG1-CZ 4.44Å; L407-F412 HydrophobicContact CD2-CE1 4.38Å; F409-F412 AromaticContact CD2-CD2 3.62Å; F409-F412 HydrophobicContact CD2-CD2 3.62Å; F409-F412 AromaticContact CD2-CE2 3.49Å; F409-F412 HydrophobicContact CD2-CE2 3.49Å; F409-F412 VanDerWaalsContact CD2-CE2 3.49Å; F409-F412 AromaticContact CE2-CD2 3.84Å; F409-F412 HydrophobicContact CE2-CD2 3.84Å; F409-F412 AromaticContact CE2-CE2 3.92Å; F409-F412 HydrophobicContact CE2-CE2 3.92Å; F409-F412 HydrophobicContact CG-CD2 4.25Å; F409-F412 HydrophobicContact CG-CE2 4.35Å; F409-F412 PolarHBondContact O-N 2.83Å; F412-I435 CarbonylContact C-O 3.53Å; F412-I435 WeakPolarHBondContact CA-O 3.46Å; F412-I435 WeakPolarHBondContact CB-O 3.17Å; F412-I435 HydrophobicContact CD1-CG2 4.16Å
413	G	94.9	Very high	93	Very high	20 Å²	20	40 Å²	40	21%	0.206	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	150.8	-176.2	-171.9	0	0	0	0	0	113	N376 I435	N376-G413 VanDerWaalsContact OD1-CA 3.29Å; N376-G413 WeakPolarHBondContact OD1-CA 3.4Å; G413-I435 PolarHBondContact N-O 3.23Å; G413-I435 PolarHBondContact O-N 3.03Å
414	T	96.6	Very high	92.1	Very high	42 Å²	42	40.7 Å²	40.7	26%	0.258	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	123.1	175.4	-54.1	0	0	0	0	109.3	K375 N376 D432 N434	K375-T414 WeakPolarHBondContact CA-O 3.47Å; N376-T414 PolarHBondContact N-O 3.22Å; N376-T414 PolarHBondContact OD1-N 2.85Å; T414-D432 HydrophobicContact CG2-CB 3.88Å; T414-D432 WeakPolarHBondContact CG2-OD1 3.36Å; T414-N434 WeakPolarHBondContact CA-OD1 3.46Å; T414-N434 VanDerWaalsContact CB-OD1 3.29Å; T414-N434 WeakPolarHBondContact CB-OD1 3.44Å; T414-N434 WeakPolarHBondContact CG2-OD1 3.02Å; T414-N434 PolarHBondContact OG1-OD1 3.4Å
415	Y	97	Very high	91.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	112.5	169.2	-65.8	-90.4	0	0	0	108.3	I356 L374 K375 L380 M386 L402 I404 D411 V433 I435	I356-Y415 HydrophobicContact CD1-CD2 3.77Å; I356-Y415 HydrophobicContact CD1-CE2 4.47Å; I356-Y415 HydrophobicContact CD1-CG 3.81Å; L374-Y415 CarbonylContact O-C 3.51Å; L374-Y415 WeakPolarHBondContact O-CA 3.37Å; K375-Y415 HydrophobicContact CB-CD1 4.2Å; K375-Y415 HydrophobicContact CB-CE1 4.05Å; K375-Y415 HydrophobicContact CD-CE1 3.7Å; K375-Y415 WeakPolarHBondContact CE-OH 3.45Å; K375-Y415 HydrophobicContact CG-CD1 4.22Å; K375-Y415 HydrophobicContact CG-CE1 3.74Å; K375-Y415 PolarHBondContact NZ-OH 2.91Å; L380-Y415 HydrophobicContact CD2-CD1 4.19Å; L380-Y415 HydrophobicContact CD2-CE1 4.23Å; M386-Y415 HydrophobicContact CE-CE1 4.24Å; M386-Y415 VanDerWaalsContact CE-OH 3.25Å; M386-Y415 WeakPolarHBondContact CE-OH 3.36Å; L402-Y415 HydrophobicContact CD2-CD1 3.3Å; L402-Y415 HydrophobicContact CD2-CE1 3.71Å; L402-Y415 HydrophobicContact CD2-CG 4.09Å; I404-Y415 HydrophobicContact CD1-CE1 4.19Å; I404-Y415 HydrophobicContact CD1-CE2 4.2Å; D411-Y415 VanDerWaalsContact O-CE2 3.24Å; D411-Y415 WeakPolarHBondContact O-CE2 2.95Å; D411-Y415 PolarHBondContact O-OH 2.82Å; Y415-V433 PolarHBondContact N-O 2.7Å; Y415-V433 PolarHBondContact O-N 3.24Å; Y415-I435 HydrophobicContact CD2-CB 4.39Å; Y415-I435 HydrophobicContact CD2-CG1 3.92Å; Y415-I435 HydrophobicContact CE2-CB 4.18Å; Y415-I435 HydrophobicContact CE2-CG1 4.08Å
416	T	97.3	Very high	91.2	Very high	12 Å²	12	42.1 Å²	42.1	7%	0.074	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	125.2	176.8	-41.8	0	0	0	0	108.5	W373 L374 V418 I431 D432	W373-T416 CarbonylContact C-O 3.59Å; W373-T416 WeakPolarHBondContact CA-O 3.25Å; L374-T416 HydrophobicContact CD1-CG2 4.42Å; L374-T416 PolarHBondContact N-O 3.05Å; L374-T416 PolarHBondContact O-N 3.27Å; T416-V418 HydrophobicContact CG2-CG2 3.92Å; T416-I431 WeakPolarHBondContact CA-O 3.48Å; T416-D432 VanDerWaalsContact CB-OD1 3.3Å; T416-D432 WeakPolarHBondContact CB-OD1 3.23Å; T416-D432 WeakPolarHBondContact CG2-OD1 3.4Å; T416-D432 PolarHBondContact OG1-OD1 3.23Å
417	C	95.3	Very high	91.1	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.014	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	127.3	164.3	53.4	0	0	0	0	108.3	C358 W373 S430 I431	C358-C417 HydrophobicContact CB-CB 3.69Å; C358-C417 WeakPolarHBondContact CB-SG 3.29Å; C358-C417 WeakPolarHBondContact SG-CB 3.15Å; C358-C417 CovalentContact SG-SG 2.02Å; C358-C417 PolarHBondContact SG-SG 2.94Å; W373-C417 HydrophobicContact CD2-CB 4.06Å; W373-C417 HydrophobicContact CE3-CB 3.92Å; W373-C417 HydrophobicContact CH2-CB 3.97Å; W373-C417 HydrophobicContact CZ2-CB 4.08Å; W373-C417 HydrophobicContact CZ3-CB 3.88Å; C417-S430 WeakPolarHBondContact O-CA 3.45Å; C417-I431 PolarHBondContact N-O 3.39Å; C417-I431 PolarHBondContact O-N 3.5Å
418	V	94.9	Very high	91	Very high	14 Å²	14	50 Å²	50	9%	0.085	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	123.4	-178.2	-174.6	0	0	0	0	108.6	F371 S372 L374 T416 E428 I429	F371-V418 WeakPolarHBondContact CA-O 3.34Å; S372-V418 PolarHBondContact N-O 2.89Å; S372-V418 PolarHBondContact O-N 2.81Å; L374-V418 HydrophobicContact CD1-CG2 4.27Å; L374-V418 HydrophobicContact CG-CG2 4.49Å; T416-V418 HydrophobicContact CG2-CG2 3.92Å; V418-E428 HydrophobicContact CG1-CB 4.17Å; V418-E428 WeakPolarHBondContact CG1-OE2 3.33Å; V418-I429 WeakPolarHBondContact CA-O 3.2Å
419	A	93.4	Very high	91.1	Very high	3 Å²	3	47.6 Å²	47.6	3%	0.025	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	125.4	-176.2	0	0	0	0	0	111.2	V360 L369 T370 F371 E428 I429	V360-A419 HydrophobicContact CG2-CB 3.54Å; L369-A419 HydrophobicContact CD1-CB 4.28Å; T370-A419 WeakPolarHBondContact O-CA 3.39Å; F371-A419 HydrophobicContact CD1-CB 3.79Å; F371-A419 HydrophobicContact CE1-CB 3.47Å; F371-A419 VanDerWaalsContact CE1-CB 3.47Å; F371-A419 HydrophobicContact CZ-CB 4.16Å; A419-E428 WeakPolarHBondContact O-CA 3.26Å; A419-I429 HydrophobicContact CB-CB 4.38Å; A419-I429 PolarHBondContact N-O 3.47Å; A419-I429 PolarHBondContact O-N 3.3Å
420	A	92.6	Very high	91.2	Very high	15 Å²	15	43.9 Å²	43.9	12%	0.124	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	153.5	-173.4	0	0	0	0	0	112	L369 T370 E428	L369-A420 CarbonylContact C-O 3.57Å; L369-A420 WeakPolarHBondContact CA-O 3.47Å; T370-A420 PolarHBondContact N-O 2.84Å; T370-A420 PolarHBondContact O-N 2.89Å; T370-A420 PolarHBondContact OG1-O 2.88Å; T370-A420 VanDerWaalsContact OG1-O 3.06Å; A420-E428 HydrophobicContact CB-CG 3.84Å
421	L	91	Very high	91.3	Very high	12 Å²	12	40 Å²	40	6%	0.063	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	131.3	170	-63.1	177.4	0	0	0	110.3	R328 L330 T364 E368 L369 G423 G424 I426	R328-L421 HydrophobicContact CB-CD1 3.98Å; R328-L421 HydrophobicContact CG-CD1 4.29Å; L330-L421 HydrophobicContact CD1-CG 4.08Å; L330-L421 HydrophobicContact CD2-CD1 4.3Å; L330-L421 HydrophobicContact CD2-CD2 3.82Å; L330-L421 HydrophobicContact CD2-CG 3.81Å; L330-L421 HydrophobicContact CG-CD1 4.05Å; L330-L421 HydrophobicContact CG-CD2 4.4Å; L330-L421 HydrophobicContact CG-CG 3.83Å; T364-L421 WeakPolarHBondContact O-CD1 3.42Å; E368-L421 HydrophobicContact CB-CB 4.23Å; E368-L421 HydrophobicContact CB-CD2 3.91Å; E368-L421 WeakPolarHBondContact O-CA 3.49Å; L369-L421 HydrophobicContact CB-CD2 4.37Å; L369-L421 HydrophobicContact CD1-CD2 4.42Å; L421-G423 PolarHBondContact O-N 2.86Å; L421-G423 VanDerWaalsContact O-N 3.16Å; L421-G424 PolarHBondContact O-N 2.89Å; L421-I426 HydrophobicContact CD1-CG1 4.18Å
422	K	85.8	Confident	91.4	Very high	141 Å²	141	44.5 Å²	44.5	61%	0.613	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-33.9	-178.9	-68.4	160.2	-160.3	160.3	0	114	E367 E368 T370 G424	E367-K422 PolarHBondContact O-NZ 2.82Å; E368-K422 HydrophobicContact CG-CB 4.4Å; E368-K422 WeakPolarHBondContact O-CG 3.33Å; E368-K422 PolarHBondContact O-N 2.88Å; T370-K422 HydrophobicContact CG2-CD 4.2Å; T370-K422 HydrophobicContact CG2-CG 3.8Å; K422-G424 VanDerWaalsContact C-N 3.28Å; K422-G424 PolarHBondContact O-N 2.98Å
423	G	77.6	Confident	91.4	Very high	44 Å²	44	42.7 Å²	42.7	45%	0.454	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-12.9	179.1	0	0	0	0	0	114.9	E368 L421	E368-G423 VanDerWaalsContact OE2-CA 3.31Å; E368-G423 WeakPolarHBondContact OE2-CA 3.35Å; E368-G423 PolarHBondContact OE2-N 3.32Å; L421-G423 PolarHBondContact O-N 2.86Å; L421-G423 VanDerWaalsContact O-N 3.16Å
424	G	77.4	Confident	91.4	Very high	30 Å²	30	46 Å²	46	31%	0.309	29%	0.286	S	S	.	.			trans	66	-175.6	176.1	0	0	0	0	0	115.3	N254 L421 K422 I426	N254-G424 PolarHBondContact ND2-O 3.06Å; L421-G424 PolarHBondContact O-N 2.89Å; K422-G424 VanDerWaalsContact C-N 3.28Å; K422-G424 PolarHBondContact O-N 2.98Å; G424-I426 PolarHBondContact O-N 2.89Å
425	G	78.5	Confident	91.4	Very high	72 Å²	72	44.1 Å²	44.1	74%	0.742	27%	0.274	S	S	*	.			trans	73	6.2	179.9	0	0	0	0	0	115.7
426	I	89.4	Confident	91.2	Very high	28 Å²	28	45.5 Å²	45.5	14%	0.144	28%	0.284	C	S	.	.	S	Bend	trans	-110.1	140.1	163.2	-56.1	-58	0	0	0	107	P255 R328 L330 L421 G424	P255-I426 HydrophobicContact CG-CD1 3.81Å; R328-I426 HydrophobicContact CB-CD1 3.85Å; R328-I426 HydrophobicContact CB-CG1 3.66Å; R328-I426 VanDerWaalsContact O-CD1 3.3Å; R328-I426 WeakPolarHBondContact O-CD1 3.37Å; L330-I426 HydrophobicContact CB-CG2 4.04Å; L330-I426 HydrophobicContact CD1-CG2 4.15Å; L330-I426 HydrophobicContact CG-CG2 4.06Å; L421-I426 HydrophobicContact CD1-CG1 4.18Å; G424-I426 PolarHBondContact O-N 2.89Å
427	P	89.8	Confident	90.8	Very high	109 Å²	109	49.6 Å²	49.6	71%	0.708	31%	0.313	S	S	*	.			trans	-63.4	139	172.5	26.9	-35.1	0	0	0	111.5
428	E	93.3	Very high	90.7	Very high	124 Å²	124	52.7 Å²	52.7	58%	0.579	33%	0.332	S	S	*	.			trans	-69.4	148.1	177.3	-54.9	-177	157.6	0	0	111.4	V418 A419 A420	V418-E428 HydrophobicContact CG1-CB 4.17Å; V418-E428 WeakPolarHBondContact CG1-OE2 3.33Å; A419-E428 WeakPolarHBondContact O-CA 3.26Å; A420-E428 HydrophobicContact CB-CG 3.84Å
429	I	93.8	Very high	90.6	Very high	32 Å²	32	52.5 Å²	52.5	16%	0.164	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	110.9	171.4	-65	-179.1	0	0	0	108.4	L330 V360 V418 A419 I431	L330-I429 HydrophobicContact CB-CD1 3.8Å; L330-I429 HydrophobicContact CB-CG1 4.1Å; V360-I429 HydrophobicContact CG1-CD1 4.19Å; V360-I429 HydrophobicContact CG2-CD1 4.36Å; V418-I429 WeakPolarHBondContact CA-O 3.2Å; A419-I429 HydrophobicContact CB-CB 4.38Å; A419-I429 PolarHBondContact N-O 3.47Å; A419-I429 PolarHBondContact O-N 3.3Å; I429-I431 HydrophobicContact CG2-CD1 4.21Å; I429-I431 HydrophobicContact CG2-CG1 3.86Å
430	S	94.8	Very high	90.6	Very high	73 Å²	73	55.2 Å²	55.2	51%	0.51	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	132	169.7	-63.4	0	0	0	0	110.2	C417	C417-S430 WeakPolarHBondContact O-CA 3.45Å
431	I	95.4	Very high	90.7	Very high	24 Å²	24	55.4 Å²	55.4	12%	0.123	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	119.5	177.3	-41.3	175.9	0	0	0	109.2	F335 T416 C417 I429	F335-I431 HydrophobicContact CB-CG2 4.11Å; F335-I431 HydrophobicContact CD1-CG2 3.55Å; F335-I431 HydrophobicContact CE1-CG2 4.36Å; F335-I431 HydrophobicContact CG-CG2 4.14Å; T416-I431 WeakPolarHBondContact CA-O 3.48Å; C417-I431 PolarHBondContact N-O 3.39Å; C417-I431 PolarHBondContact O-N 3.5Å; I429-I431 HydrophobicContact CG2-CD1 4.21Å; I429-I431 HydrophobicContact CG2-CG1 3.86Å
432	D	95.5	Very high	90.8	Very high	98 Å²	98	55 Å²	55	52%	0.524	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	123.6	-180	-75.1	-39.9	0	0	0	112	T414 T416	T414-D432 HydrophobicContact CG2-CB 3.88Å; T414-D432 WeakPolarHBondContact CG2-OD1 3.36Å; T416-D432 VanDerWaalsContact CB-OD1 3.3Å; T416-D432 WeakPolarHBondContact CB-OD1 3.23Å; T416-D432 WeakPolarHBondContact CG2-OD1 3.4Å; T416-D432 PolarHBondContact OG1-OD1 3.23Å
433	V	96.1	Very high	91.2	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.006	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	112.8	177.4	-170.6	0	0	0	0	110.2	F335 I337 I356 Y415 I435	F335-V433 HydrophobicContact CB-CG2 3.98Å; F335-V433 HydrophobicContact CD1-CG2 4.39Å; F335-V433 HydrophobicContact CD2-CB 4.44Å; F335-V433 HydrophobicContact CD2-CG1 4.04Å; F335-V433 HydrophobicContact CD2-CG2 3.54Å; F335-V433 HydrophobicContact CE2-CG1 4.07Å; F335-V433 HydrophobicContact CE2-CG2 4.12Å; F335-V433 HydrophobicContact CG-CG2 3.7Å; I337-V433 HydrophobicContact CD1-CG1 3.92Å; I337-V433 HydrophobicContact CG1-CG1 3.88Å; I356-V433 HydrophobicContact CD1-CG1 4.45Å; I356-V433 HydrophobicContact CG2-CB 4.03Å; I356-V433 HydrophobicContact CG2-CG1 3.89Å; I356-V433 HydrophobicContact CG2-CG2 3.91Å; Y415-V433 PolarHBondContact N-O 2.7Å; Y415-V433 PolarHBondContact O-N 3.24Å; V433-I435 HydrophobicContact CG1-CD1 4.14Å
434	N	95.2	Very high	92.1	Very high	91 Å²	91	49.8 Å²	49.8	49%	0.487	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	111.4	-178.4	-72.5	-23.3	0	0	0	111.7	T414 T439	T414-N434 WeakPolarHBondContact CA-OD1 3.46Å; T414-N434 VanDerWaalsContact CB-OD1 3.29Å; T414-N434 WeakPolarHBondContact CB-OD1 3.44Å; T414-N434 WeakPolarHBondContact CG2-OD1 3.02Å; T414-N434 PolarHBondContact OG1-OD1 3.4Å; N434-T439 PolarHBondContact O-OG1 3.43Å
435	I	95.3	Very high	92.9	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.01	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	125.1	172.8	-54.5	-55.7	0	0	0	109.1	I337 I348 I356 L407 F412 G413 Y415 V433 T439	I337-I435 HydrophobicContact CD1-CD1 3.75Å; I337-I435 HydrophobicContact CG1-CD1 4.15Å; I337-I435 HydrophobicContact CG2-CD1 4.48Å; I348-I435 HydrophobicContact CD1-CG2 3.93Å; I356-I435 HydrophobicContact CD1-CD1 4Å; I356-I435 HydrophobicContact CD1-CG1 3.67Å; I356-I435 HydrophobicContact CG1-CD1 4.33Å; I356-I435 HydrophobicContact CG1-CG1 4.46Å; L407-I435 HydrophobicContact CD1-CG2 4.48Å; F412-I435 CarbonylContact C-O 3.53Å; F412-I435 WeakPolarHBondContact CA-O 3.46Å; F412-I435 WeakPolarHBondContact CB-O 3.17Å; F412-I435 HydrophobicContact CD1-CG2 4.16Å; G413-I435 PolarHBondContact N-O 3.23Å; G413-I435 PolarHBondContact O-N 3.03Å; Y415-I435 HydrophobicContact CD2-CB 4.39Å; Y415-I435 HydrophobicContact CD2-CG1 3.92Å; Y415-I435 HydrophobicContact CE2-CB 4.18Å; Y415-I435 HydrophobicContact CE2-CG1 4.08Å; V433-I435 HydrophobicContact CG1-CD1 4.14Å; I435-T439 HydrophobicContact CD1-CG2 4.42Å
436	S	93.6	Very high	93.7	Very high	29 Å²	29	50.7 Å²	50.7	20%	0.203	30%	0.302	C	S	.	.	S	Bend	trans	-159.3	167.6	-174.5	72.1	0	0	0	0	110.9	T438 T439	S436-T438 PolarHBondContact O-N 3Å; S436-T438 PolarHBondContact OG-N 3.35Å; S436-T438 PolarHBondContact OG-OG1 3.09Å; S436-T439 PolarHBondContact N-OG1 2.7Å; S436-T439 WeakPolarHBondContact O-CB 3.09Å; S436-T439 PolarHBondContact O-N 3.18Å; S436-T439 PolarHBondContact O-OG1 2.72Å; S436-T439 PolarHBondContact OG-N 2.92Å; S436-T439 PolarHBondContact OG-OG1 3.08Å
437	S	89.4	Confident	93.9	Very high	97 Å²	97	50.3 Å²	50.3	68%	0.678	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-5.7	166.9	54.2	0	0	0	0	114.7
438	T	91.3	Very high	94	Very high	68 Å²	68	57.3 Å²	57.3	42%	0.417	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	2.3	172.8	78.8	0	0	0	0	113.4	S436 V440 K470	S436-T438 PolarHBondContact O-N 3Å; S436-T438 PolarHBondContact OG-N 3.35Å; S436-T438 PolarHBondContact OG-OG1 3.09Å; T438-V440 PolarHBondContact O-N 3.07Å; T438-K470 VanDerWaalsContact O-CB 3.27Å; T438-K470 WeakPolarHBondContact O-CB 3.42Å; T438-K470 WeakPolarHBondContact O-CD 3.34Å; T438-K470 PolarHBondContact OG1-NZ 2.98Å
439	T	93.8	Very high	93.8	Very high	9 Å²	9	55 Å²	55	6%	0.055	32%	0.323	C	S	.	.			trans	-80.3	108.8	177.6	-56.6	0	0	0	0	107.9	I337 I348 N434 I435 S436 K470 F523	I337-T439 HydrophobicContact CD1-CG2 3.79Å; I348-T439 HydrophobicContact CD1-CG2 4.16Å; N434-T439 PolarHBondContact O-OG1 3.43Å; I435-T439 HydrophobicContact CD1-CG2 4.42Å; S436-T439 PolarHBondContact N-OG1 2.7Å; S436-T439 WeakPolarHBondContact O-CB 3.09Å; S436-T439 PolarHBondContact O-N 3.18Å; S436-T439 PolarHBondContact O-OG1 2.72Å; S436-T439 PolarHBondContact OG-N 2.92Å; S436-T439 PolarHBondContact OG-OG1 3.08Å; T439-K470 CarbonylContact C-O 3.57Å; T439-K470 VanDerWaalsContact CA-O 3.26Å; T439-K470 WeakPolarHBondContact CA-O 3.32Å; T439-K470 VanDerWaalsContact CG2-O 3.27Å; T439-K470 WeakPolarHBondContact CG2-O 3.11Å; T439-F523 HydrophobicContact CG2-CE2 4.04Å; T439-F523 HydrophobicContact CG2-CZ 4.07Å
440	V	94.1	Very high	93.7	Very high	60 Å²	60	56.9 Å²	56.9	36%	0.364	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	144.3	-167.1	-67.1	0	0	0	0	111.6	T438 K470 F523	T438-V440 PolarHBondContact O-N 3.07Å; V440-K470 HydrophobicContact CG2-CB 4.23Å; V440-K470 PolarHBondContact N-O 3.28Å; V440-K470 PolarHBondContact O-N 3.47Å; V440-F523 VanDerWaalsContact C-CZ 3.49Å; V440-F523 WeakPolarHBondContact O-CE2 3.38Å
441	P	93.1	Very high	93.6	Very high	20 Å²	20	55.4 Å²	55.4	13%	0.13	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	158.6	-177.5	26.1	-35.8	0	0	0	112.4	D346 N347 F523	D346-P441 HydrophobicContact CB-CB 3.99Å; D346-P441 HydrophobicContact CB-CG 4.04Å; D346-P441 WeakPolarHBondContact O-CB 3.37Å; D346-P441 WeakPolarHBondContact O-CG 3.31Å; N347-P441 VanDerWaalsContact OD1-CD 3.25Å; N347-P441 WeakPolarHBondContact OD1-CD 3.47Å; N347-P441 WeakPolarHBondContact OD1-CG 3.09Å; P441-F523 HydrophobicContact CB-CD1 3.94Å; P441-F523 HydrophobicContact CB-CE1 4.13Å; P441-F523 HydrophobicContact CB-CG 4.18Å
442	P	94.7	Very high	93.5	Very high	4 Å²	4	57.2 Å²	57.2	3%	0.026	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	150.8	-173.8	31.4	-36.7	0	0	0	113.5	S468 P473 T517 V525 R528	P442-S468 CarbonylContact C-O 3.52Å; P442-S468 VanDerWaalsContact CA-O 3.26Å; P442-S468 WeakPolarHBondContact CA-O 3.4Å; P442-P473 HydrophobicContact CB-CG 3.67Å; P442-P473 HydrophobicContact CG-CG 4.08Å; P442-T517 HydrophobicContact CB-CG2 4.04Å; P442-T517 HydrophobicContact CG-CG2 4.29Å; P442-V525 HydrophobicContact CG-CG2 4.47Å; P442-R528 VanDerWaalsContact O-CG 3.31Å; P442-R528 WeakPolarHBondContact O-CG 3.32Å; P442-R528 PolarHBondContact O-NE 2.95Å
443	S	93.6	Very high	93.5	Very high	53 Å²	53	54.4 Å²	54.4	37%	0.371	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	144.2	164.4	60.5	0	0	0	0	109.8	S468	S443-S468 PolarHBondContact N-O 3.35Å; S443-S468 PolarHBondContact O-N 2.79Å; S443-S468 PolarHBondContact OG-OG 3.48Å
444	L	95.5	Very high	93.4	Very high	21 Å²	21	58 Å²	58	11%	0.11	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	135	-176.8	-170.3	62.1	0	0	0	109.7	C465 V467 I475 C515 T517 R528 A530	L444-C465 HydrophobicContact CD1-CB 3.8Å; L444-C465 HydrophobicContact CG-CB 4.42Å; L444-V467 HydrophobicContact CD1-CB 4.17Å; L444-I475 HydrophobicContact CD1-CD1 3.6Å; L444-I475 HydrophobicContact CD1-CG1 4.34Å; L444-I475 HydrophobicContact CD2-CD1 4.41Å; L444-C515 WeakPolarHBondContact CD2-O 3.39Å; L444-T517 HydrophobicContact CB-CG2 4.2Å; L444-T517 HydrophobicContact CD2-CG2 4.39Å; L444-R528 HydrophobicContact CB-CB 3.78Å; L444-R528 VanDerWaalsContact CD2-O 3.3Å; L444-R528 WeakPolarHBondContact CD2-O 3.41Å; L444-A530 HydrophobicContact CD2-CB 4.47Å; L444-A530 HydrophobicContact CG-CB 4.5Å
445	T	94.7	Very high	93.4	Very high	79 Å²	79	54.1 Å²	54.1	49%	0.485	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	153	178.2	55.3	0	0	0	0	110.7	C465 L466	T445-C465 CarbonylContact O-C 3.59Å; T445-L466 PolarHBondContact N-O 2.57Å; T445-L466 PolarHBondContact O-N 2.7Å; T445-L466 PolarHBondContact OG1-O 2.8Å
446	V	95.1	Very high	93.3	Very high	42 Å²	42	60 Å²	60	26%	0.255	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-91.1	135.5	169.9	-178.2	0	0	0	0	108.5	K450 A530 V532	V446-K450 HydrophobicContact CG1-CB 4.42Å; V446-A530 HydrophobicContact CG2-CB 3.83Å; V446-V532 HydrophobicContact CG1-CG2 3.92Å; V446-V532 HydrophobicContact CG2-CG2 3.82Å
447	P	94.1	Very high	93.2	Very high	21 Å²	21	62 Å²	62	14%	0.136	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-58.1	142.1	173.9	-10.6	17.1	0	0	0	111.8	G449 K450 E464 L466	P447-G449 PolarHBondContact O-N 2.84Å; P447-K450 HydrophobicContact CB-CB 4.06Å; P447-K450 HydrophobicContact CB-CG 3.74Å; P447-K450 HydrophobicContact CG-CB 4.04Å; P447-K450 HydrophobicContact CG-CG 3.86Å; P447-K450 PolarHBondContact O-N 2.85Å; P447-E464 WeakPolarHBondContact CD-O 3.4Å; P447-E464 HydrophobicContact CG-CB 4.11Å; P447-E464 HydrophobicContact CG-CG 3.7Å; P447-L466 HydrophobicContact CB-CD1 4.07Å; P447-L466 HydrophobicContact CG-CD1 3.93Å; P447-L466 HydrophobicContact CG-CD2 4.48Å; P447-L466 HydrophobicContact CG-CG 3.85Å
448	R	92.2	Very high	93.4	Very high	256 Å²	256	59.2 Å²	59.2	97%	0.966	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	123.9	176.9	-67.4	-175.7	178.4	-172.3	-0.5	110
449	G	87.8	Confident	93.5	Very high	75 Å²	75	59.3 Å²	59.3	77%	0.773	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	4.8	-178.8	0	0	0	0	0	115.8	P447	P447-G449 PolarHBondContact O-N 2.84Å
450	K	91.8	Very high	93.6	Very high	71 Å²	71	63.2 Å²	63.2	31%	0.309	36%	0.357	S	S	.	.			trans	-95.9	4.4	172.3	-70.3	-61	-163.7	80.5	0	114.5	V446 P447 E464	V446-K450 HydrophobicContact CG1-CB 4.42Å; P447-K450 HydrophobicContact CB-CB 4.06Å; P447-K450 HydrophobicContact CB-CG 3.74Å; P447-K450 HydrophobicContact CG-CB 4.04Å; P447-K450 HydrophobicContact CG-CG 3.86Å; P447-K450 PolarHBondContact O-N 2.85Å; K450-E464 IonicContact NZ-OE2 2.74Å; K450-E464 PolarHBondContact NZ-OE2 2.81Å
451	S	93.6	Very high	93.6	Very high	42 Å²	42	60.8 Å²	60.8	29%	0.294	34%	0.342	S	S	.	.	S	Bend	trans	-145.4	133.2	170.6	-171.7	0	0	0	0	110.1	E533	S451-E533 PolarHBondContact OG-N 2.69Å; S451-E533 VanDerWaalsContact OG-N 3.09Å
452	P	93.9	Very high	93.8	Very high	63 Å²	63	64.1 Å²	64.1	41%	0.409	36%	0.356	S	S	.	.	S	Bend	cis	-65.1	140.6	-11.4	29.1	-35.2	0	0	0	111.4	E533 I535	P452-E533 CarbonylContact C-O 3.58Å; P452-E533 WeakPolarHBondContact CA-O 3.12Å; P452-E533 HydrophobicContact CB-CB 3.91Å; P452-I535 HydrophobicContact CB-CD1 3.6Å; P452-I535 HydrophobicContact CB-CG1 4.04Å; P452-I535 HydrophobicContact CG-CD1 4.07Å
453	L	94.9	Very high	93.8	Very high	38 Å²	38	64 Å²	64	20%	0.199	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	127.9	167.5	-174.5	67	0	0	0	109	V461 L463 E533 L534 I535	L453-V461 HydrophobicContact CD2-CB 3.91Å; L453-V461 HydrophobicContact CD2-CG1 4.34Å; L453-L463 HydrophobicContact CB-CD2 4.19Å; L453-L463 HydrophobicContact CD2-CD2 3.59Å; L453-E533 PolarHBondContact N-O 3.08Å; L453-L534 HydrophobicContact CD2-CD1 4.47Å; L453-I535 PolarHBondContact O-N 3.22Å
454	V	94	Very high	93.9	Very high	76 Å²	76	63.7 Å²	63.7	46%	0.461	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	127.2	177.3	-173.2	0	0	0	0	108.8	I535 Q537	V454-I535 WeakPolarHBondContact CA-O 3.47Å; V454-I535 HydrophobicContact CG2-CB 4.29Å; V454-Q537 HydrophobicContact CG1-CG 3.63Å
455	A	94.1	Very high	93.9	Very high	10 Å²	10	62.8 Å²	62.8	8%	0.083	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	166	179.9	0	0	0	0	0	110.7	D459 V461 I535 V536 Q537	A455-D459 HydrophobicContact CB-CB 4.32Å; A455-V461 HydrophobicContact CB-CG1 3.36Å; A455-I535 PolarHBondContact N-O 2.97Å; A455-V536 CarbonylContact O-C 3.55Å; A455-V536 WeakPolarHBondContact O-CA 3.5Å; A455-Q537 PolarHBondContact O-N 2.81Å
456	R	93.5	Very high	93.9	Very high	125 Å²	125	62.9 Å²	62.9	47%	0.472	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	155.4	175.8	-66.6	175.2	172.4	175.1	-6.9	111.5	G458 D459 Q537 E617 A618	R456-G458 PolarHBondContact O-N 3.4Å; R456-D459 WeakPolarHBondContact CB-OD2 3.03Å; R456-D459 PolarHBondContact N-OD2 2.88Å; R456-D459 VanDerWaalsContact O-CB 3.28Å; R456-D459 WeakPolarHBondContact O-CB 3.43Å; R456-D459 PolarHBondContact O-N 2.86Å; R456-D459 VanDerWaalsContact O-N 3.07Å; R456-Q537 CarbonylContact C-O 3.56Å; R456-Q537 WeakPolarHBondContact CA-O 3.41Å; R456-E617 PolarHBondContact NH2-O 3.04Å; R456-A618 HydrophobicContact CG-CB 4.49Å
457	E	92.6	Very high	93.9	Very high	72 Å²	72	61.6 Å²	61.6	34%	0.336	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	126	172.1	-172.7	167	-115.3	0	0	110.8	V505 R507 V536 Q537	E457-V505 CarbonylContact C-O 3.56Å; E457-V505 WeakPolarHBondContact CA-O 3.44Å; E457-R507 WeakPolarHBondContact OE1-CB 3.24Å; E457-R507 WeakPolarHBondContact OE1-CG 3.25Å; E457-R507 IonicContact OE1-CZ 3.47Å; E457-R507 PolarHBondContact OE1-N 3.27Å; E457-R507 IonicContact OE1-NE 3.68Å; E457-R507 PolarHBondContact OE1-NE 2.62Å; E457-R507 IonicContact OE1-NH2 3.94Å; E457-R507 IonicContact OE2-CZ 3.86Å; E457-R507 IonicContact OE2-NE 2.73Å; E457-R507 PolarHBondContact OE2-NE 2.9Å; E457-R507 IonicContact OE2-NH2 3.51Å; E457-R507 PolarHBondContact OE2-NH2 3.44Å; E457-V536 HydrophobicContact CB-CG1 4.14Å; E457-Q537 PolarHBondContact N-O 2.56Å
458	G	92.3	Very high	93.8	Very high	38 Å²	38	63.5 Å²	63.5	39%	0.392	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.9	-13.5	-172	0	0	0	0	0	115.3	R456 V505	R456-G458 PolarHBondContact O-N 3.4Å; G458-V505 PolarHBondContact N-O 2.91Å
459	D	94.7	Very high	93.7	Very high	70 Å²	70	52 Å²	52	37%	0.374	31%	0.308	S	S	.	.			trans	-65	164.4	177.7	-74.5	-14.3	0	0	0	112.2	A455 R456 V461 N504 V505	A455-D459 HydrophobicContact CB-CB 4.32Å; R456-D459 WeakPolarHBondContact CB-OD2 3.03Å; R456-D459 PolarHBondContact N-OD2 2.88Å; R456-D459 VanDerWaalsContact O-CB 3.28Å; R456-D459 WeakPolarHBondContact O-CB 3.43Å; R456-D459 PolarHBondContact O-N 2.86Å; R456-D459 VanDerWaalsContact O-N 3.07Å; D459-V461 HydrophobicContact CB-CG1 4.44Å; D459-N504 WeakPolarHBondContact O-CA 3.37Å; D459-N504 PolarHBondContact O-N 2.74Å; D459-N504 VanDerWaalsContact O-N 3.13Å; D459-V505 WeakPolarHBondContact O-CG2 3.46Å; D459-V505 PolarHBondContact O-N 3.1Å
460	T	95.4	Very high	94	Very high	91 Å²	91	53.6 Å²	53.6	56%	0.558	29%	0.293	S	S	*	.			trans	-106.6	128.7	163.4	-62.7	0	0	0	0	108.9	I502 V503	T460-I502 CarbonylContact C-O 3.55Å; T460-I502 WeakPolarHBondContact CA-O 3.48Å; T460-V503 HydrophobicContact CG2-CB 4.46Å; T460-V503 HydrophobicContact CG2-CG2 3.9Å
461	V	94.9	Very high	94.1	Very high	9 Å²	9	51.9 Å²	51.9	6%	0.055	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	152.8	-173.9	-57	0	0	0	0	112.6	L453 A455 D459 R501 I502 V505 L534	L453-V461 HydrophobicContact CD2-CB 3.91Å; L453-V461 HydrophobicContact CD2-CG1 4.34Å; A455-V461 HydrophobicContact CB-CG1 3.36Å; D459-V461 HydrophobicContact CB-CG1 4.44Å; V461-R501 WeakPolarHBondContact O-CA 3.47Å; V461-I502 HydrophobicContact CG2-CB 3.89Å; V461-I502 HydrophobicContact CG2-CD1 4.33Å; V461-I502 HydrophobicContact CG2-CG1 4.43Å; V461-I502 PolarHBondContact N-O 2.96Å; V461-I502 PolarHBondContact O-N 2.86Å; V461-V505 HydrophobicContact CB-CG2 4.29Å; V461-V505 HydrophobicContact CG1-CG2 3.91Å; V461-V505 HydrophobicContact CG2-CG2 3.54Å; V461-L534 HydrophobicContact CG1-CD1 4.48Å; V461-L534 HydrophobicContact CG2-CD1 4.26Å; V461-L534 HydrophobicContact CG2-CD2 4.23Å
462	E	95.4	Very high	94.1	Very high	90 Å²	90	56.6 Å²	56.6	42%	0.421	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	108.6	175.4	-64.9	-160.6	131.7	0	0	109.5	V499 L500 R501	E462-V499 HydrophobicContact CB-CG1 3.67Å; E462-V499 HydrophobicContact CG-CG1 4.01Å; E462-L500 WeakPolarHBondContact CA-O 3.42Å; E462-R501 HydrophobicContact CG-CG 4.25Å; E462-R501 IonicContact OE1-CZ 2.77Å; E462-R501 VanDerWaalsContact OE1-CZ 3.26Å; E462-R501 IonicContact OE1-NE 3.71Å; E462-R501 PolarHBondContact OE1-NE 2.84Å; E462-R501 IonicContact OE1-NH2 3.39Å; E462-R501 PolarHBondContact OE1-NH2 2.98Å
463	L	95.8	Very high	94	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.005	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	134.2	168.9	-49.1	-170.1	0	0	0	108.3	L453 W477 V499 L500 Y513 V532 L534	L453-L463 HydrophobicContact CB-CD2 4.19Å; L453-L463 HydrophobicContact CD2-CD2 3.59Å; L463-W477 HydrophobicContact CB-CH2 3.56Å; L463-W477 HydrophobicContact CB-CZ2 4.21Å; L463-W477 HydrophobicContact CB-CZ3 3.88Å; L463-W477 HydrophobicContact CD1-CZ3 4.28Å; L463-W477 WeakPolarHBondContact O-CZ2 3.2Å; L463-V499 CarbonylContact O-C 3.44Å; L463-V499 VanDerWaalsContact O-CA 3.29Å; L463-V499 WeakPolarHBondContact O-CA 3.43Å; L463-L500 HydrophobicContact CB-CB 4.32Å; L463-L500 HydrophobicContact CD1-CD2 4.17Å; L463-L500 PolarHBondContact N-O 2.79Å; L463-L500 PolarHBondContact O-N 2.87Å; L463-Y513 HydrophobicContact CD1-CD1 4.03Å; L463-Y513 HydrophobicContact CD1-CD2 3.5Å; L463-Y513 HydrophobicContact CD1-CE2 4.06Å; L463-Y513 HydrophobicContact CD1-CG 3.48Å; L463-Y513 VanDerWaalsContact CD1-CG 3.48Å; L463-V532 HydrophobicContact CB-CG1 4.17Å; L463-V532 HydrophobicContact CD1-CG1 4.36Å; L463-V532 HydrophobicContact CD2-CG1 4.05Å; L463-V532 HydrophobicContact CG-CG1 4.42Å; L463-L534 HydrophobicContact CD2-CB 4.39Å; L463-L534 HydrophobicContact CD2-CD1 4.38Å
464	E	95.6	Very high	94	Very high	48 Å²	48	52.3 Å²	52.3	22%	0.224	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	130.9	-166.4	-176.2	-172.9	170.1	0	0	111.7	P447 K450 L466 V499	P447-E464 WeakPolarHBondContact CD-O 3.4Å; P447-E464 HydrophobicContact CG-CB 4.11Å; P447-E464 HydrophobicContact CG-CG 3.7Å; K450-E464 IonicContact NZ-OE2 2.74Å; K450-E464 PolarHBondContact NZ-OE2 2.81Å; E464-L466 WeakPolarHBondContact OE1-CD2 3.25Å; E464-V499 HydrophobicContact CG-CG2 4.42Å
465	C	95.7	Very high	94.1	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.014	26%	0.257	C	S	.	.			trans	-128.7	123.7	168.9	-66.4	0	0	0	0	111.2	L444 T445 V467 W477 G498 C515	L444-C465 HydrophobicContact CD1-CB 3.8Å; L444-C465 HydrophobicContact CG-CB 4.42Å; T445-C465 CarbonylContact O-C 3.59Å; C465-V467 PolarHBondContact O-N 2.63Å; C465-W477 HydrophobicContact CB-CZ2 4.2Å; C465-W477 WeakPolarHBondContact SG-CH2 3.46Å; C465-G498 PolarHBondContact N-O 2.73Å; C465-C515 HydrophobicContact CB-CB 3.73Å; C465-C515 WeakPolarHBondContact CB-SG 3.45Å; C465-C515 WeakPolarHBondContact SG-CB 3.25Å; C465-C515 CovalentContact SG-SG 2.03Å; C465-C515 PolarHBondContact SG-SG 2.91Å
466	L	94.8	Very high	94.2	Very high	80 Å²	80	49 Å²	49	42%	0.419	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	112.5	-178.7	-63.5	173.3	0	0	0	110.5	T445 P447 E464	T445-L466 PolarHBondContact N-O 2.57Å; T445-L466 PolarHBondContact O-N 2.7Å; T445-L466 PolarHBondContact OG1-O 2.8Å; P447-L466 HydrophobicContact CB-CD1 4.07Å; P447-L466 HydrophobicContact CG-CD1 3.93Å; P447-L466 HydrophobicContact CG-CD2 4.48Å; P447-L466 HydrophobicContact CG-CG 3.85Å; E464-L466 WeakPolarHBondContact OE1-CD2 3.25Å
467	V	94.8	Very high	94.4	Very high	15 Å²	15	43.1 Å²	43.1	9%	0.091	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	128.5	172.3	71.1	0	0	0	0	111.7	L444 C465 K472 P473 I475 T517	L444-V467 HydrophobicContact CD1-CB 4.17Å; C465-V467 PolarHBondContact O-N 2.63Å; V467-K472 HydrophobicContact CG1-CD 4.32Å; V467-K472 WeakPolarHBondContact O-CE 3.31Å; V467-K472 PolarHBondContact O-NZ 2.59Å; V467-K472 VanDerWaalsContact O-NZ 3.07Å; V467-P473 HydrophobicContact CG2-CG 3.93Å; V467-I475 HydrophobicContact CB-CD1 3.95Å; V467-I475 HydrophobicContact CB-CG1 4.26Å; V467-I475 HydrophobicContact CG1-CD1 4.47Å; V467-I475 HydrophobicContact CG1-CG1 4.35Å; V467-I475 HydrophobicContact CG2-CD1 4.02Å; V467-T517 HydrophobicContact CG2-CG2 4.29Å
468	S	92	Very high	94.6	Very high	61 Å²	61	40.3 Å²	40.3	43%	0.427	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	157.6	165.5	60.4	0	0	0	0	110.5	P442 S443	P442-S468 CarbonylContact C-O 3.52Å; P442-S468 VanDerWaalsContact CA-O 3.26Å; P442-S468 WeakPolarHBondContact CA-O 3.4Å; S443-S468 PolarHBondContact N-O 3.35Å; S443-S468 PolarHBondContact O-N 2.79Å; S443-S468 PolarHBondContact OG-OG 3.48Å
469	G	91.1	Very high	94.7	Very high	14 Å²	14	39.7 Å²	39.7	14%	0.144	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	144.9	165.6	-166.9	0	0	0	0	0	109.2	P471	G469-P471 CarbonylContact C-O 3.58Å
470	K	93.1	Very high	94.7	Very high	109 Å²	109	38 Å²	38	47%	0.474	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	109.9	176.1	-83.3	179.1	163.6	-174.1	0	109.3	T438 T439 V440	T438-K470 VanDerWaalsContact O-CB 3.27Å; T438-K470 WeakPolarHBondContact O-CB 3.42Å; T438-K470 WeakPolarHBondContact O-CD 3.34Å; T438-K470 PolarHBondContact OG1-NZ 2.98Å; T439-K470 CarbonylContact C-O 3.57Å; T439-K470 VanDerWaalsContact CA-O 3.26Å; T439-K470 WeakPolarHBondContact CA-O 3.32Å; T439-K470 VanDerWaalsContact CG2-O 3.27Å; T439-K470 WeakPolarHBondContact CG2-O 3.11Å; V440-K470 HydrophobicContact CG2-CB 4.23Å; V440-K470 PolarHBondContact N-O 3.28Å; V440-K470 PolarHBondContact O-N 3.47Å
471	P	93.6	Very high	94.4	Very high	36 Å²	36	37.2 Å²	37.2	23%	0.234	20%	0.197	C	C	.	.	S	Bend	cis	-63.9	162.3	-6.3	23.6	-29.1	0	0	0	113.2	F335 I337 G469	F335-P471 HydrophobicContact CE2-CG 3.69Å; F335-P471 HydrophobicContact CZ-CB 3.98Å; F335-P471 HydrophobicContact CZ-CG 3.59Å; I337-P471 HydrophobicContact CD1-CG 4.24Å; G469-P471 CarbonylContact C-O 3.58Å
472	K	92.8	Very high	94.2	Very high	140 Å²	140	40.9 Å²	40.9	61%	0.609	21%	0.213	S	C	*	.	P	Polyproline II helix	trans	-81.7	121.3	171.8	-74.7	-169.3	172.8	-152.5	0	109.4	V467	V467-K472 HydrophobicContact CG1-CD 4.32Å; V467-K472 WeakPolarHBondContact O-CE 3.31Å; V467-K472 PolarHBondContact O-NZ 2.59Å; V467-K472 VanDerWaalsContact O-NZ 3.07Å
473	P	93.4	Very high	93.9	Very high	6 Å²	6	45.6 Å²	45.6	4%	0.039	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-72.7	165.7	172.7	32.3	-35.9	0	0	0	111.7	P442 V467 T517 N521	P442-P473 HydrophobicContact CB-CG 3.67Å; P442-P473 HydrophobicContact CG-CG 4.08Å; V467-P473 HydrophobicContact CG2-CG 3.93Å; P473-T517 HydrophobicContact CG-CG2 4.08Å; P473-N521 WeakPolarHBondContact CA-O 3.48Å
474	I	94.3	Very high	93.6	Very high	6 Å²	6	46.7 Å²	46.7	3%	0.031	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-70.9	151	168	-67.8	160.2	0	0	0	108.6	L476 E494 S495 Y496 S518 Y520 N521	I474-L476 HydrophobicContact CG2-CD2 4.17Å; I474-E494 HydrophobicContact CG2-CB 3.96Å; I474-E494 HydrophobicContact CG2-CG 4.14Å; I474-S495 WeakPolarHBondContact CG2-O 3.29Å; I474-Y496 HydrophobicContact CD1-CD1 4.19Å; I474-Y496 HydrophobicContact CD1-CE1 3.5Å; I474-Y496 VanDerWaalsContact CD1-CE1 3.5Å; I474-Y496 HydrophobicContact CD1-CE2 4.2Å; I474-Y496 VanDerWaalsContact CD1-CZ 3.47Å; I474-Y496 WeakPolarHBondContact CD1-OH 3.48Å; I474-Y496 HydrophobicContact CG1-CD1 3.97Å; I474-Y496 HydrophobicContact CG1-CE1 3.82Å; I474-Y496 HydrophobicContact CG1-CE2 4.45Å; I474-Y496 HydrophobicContact CG1-CG 4.37Å; I474-S518 WeakPolarHBondContact CB-OG 3.48Å; I474-S518 PolarHBondContact N-OG 2.83Å; I474-S518 WeakPolarHBondContact O-CB 3.15Å; I474-S518 PolarHBondContact O-N 3.47Å; I474-S518 PolarHBondContact O-OG 2.79Å; I474-Y520 HydrophobicContact CD1-CD2 4.35Å; I474-Y520 HydrophobicContact CD1-CE2 3.91Å; I474-N521 HydrophobicContact CD1-CB 4.15Å; I474-N521 WeakPolarHBondContact CD1-ND2 3.22Å
475	I	96.2	Very high	93.4	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	131.2	170.9	-63	-51.7	0	0	0	109.6	L444 V467 S495 C515 Q516 T517	L444-I475 HydrophobicContact CD1-CD1 3.6Å; L444-I475 HydrophobicContact CD1-CG1 4.34Å; L444-I475 HydrophobicContact CD2-CD1 4.41Å; V467-I475 HydrophobicContact CB-CD1 3.95Å; V467-I475 HydrophobicContact CB-CG1 4.26Å; V467-I475 HydrophobicContact CG1-CD1 4.47Å; V467-I475 HydrophobicContact CG1-CG1 4.35Å; V467-I475 HydrophobicContact CG2-CD1 4.02Å; I475-S495 PolarHBondContact N-O 2.85Å; I475-S495 WeakPolarHBondContact O-CB 3.37Å; I475-S495 PolarHBondContact O-N 3.36Å; I475-C515 HydrophobicContact CG2-CB 3.76Å; I475-Q516 CarbonylContact C-O 3.55Å; I475-Q516 WeakPolarHBondContact CA-O 3.38Å; I475-T517 HydrophobicContact CD1-CG2 4.03Å
476	L	96.1	Very high	93.2	Very high	16 Å²	16	48.6 Å²	48.6	8%	0.084	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	125.5	175	-49.4	178	0	0	0	108	I474 M493 E494 C515 Q516 Y520	I474-L476 HydrophobicContact CG2-CD2 4.17Å; L476-M493 WeakPolarHBondContact CA-O 3.43Å; L476-E494 HydrophobicContact CD2-CG 3.9Å; L476-C515 WeakPolarHBondContact O-CA 3.12Å; L476-Q516 HydrophobicContact CB-CG 3.82Å; L476-Q516 PolarHBondContact N-O 2.94Å; L476-Q516 PolarHBondContact O-N 2.86Å; L476-Y520 WeakPolarHBondContact CD2-OH 3.48Å
477	W	97.3	Very high	92.8	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	132.9	179.2	-76.6	96	0	0	0	111.4	L463 C465 M486 Q492 M493 G498 L500 R514 C515 V532	L463-W477 HydrophobicContact CB-CH2 3.56Å; L463-W477 HydrophobicContact CB-CZ2 4.21Å; L463-W477 HydrophobicContact CB-CZ3 3.88Å; L463-W477 HydrophobicContact CD1-CZ3 4.28Å; L463-W477 WeakPolarHBondContact O-CZ2 3.2Å; C465-W477 HydrophobicContact CB-CZ2 4.2Å; C465-W477 WeakPolarHBondContact SG-CH2 3.46Å; W477-M486 HydrophobicContact CB-CE 3.73Å; W477-Q492 CarbonylContact O-C 3.58Å; W477-Q492 WeakPolarHBondContact O-CA 3.49Å; W477-M493 PolarHBondContact N-O 2.83Å; W477-M493 PolarHBondContact O-N 2.86Å; W477-G498 WeakPolarHBondContact CZ2-O 3.25Å; W477-L500 HydrophobicContact CB-CB 4.39Å; W477-L500 HydrophobicContact CB-CD1 4.24Å; W477-L500 HydrophobicContact CB-CD2 4.26Å; W477-L500 HydrophobicContact CD2-CB 3.61Å; W477-L500 HydrophobicContact CD2-CD2 4.19Å; W477-L500 HydrophobicContact CD2-CG 4.45Å; W477-L500 HydrophobicContact CE3-CB 4.14Å; W477-L500 HydrophobicContact CE3-CD2 4.07Å; W477-L500 HydrophobicContact CG-CB 3.74Å; W477-L500 HydrophobicContact CG-CD1 4.42Å; W477-L500 HydrophobicContact CG-CD2 4.32Å; W477-L500 HydrophobicContact CG-CG 4.38Å; W477-L500 HydrophobicContact CZ2-CB 4.18Å; W477-R514 WeakPolarHBondContact CA-O 3.42Å; W477-C515 HydrophobicContact CD2-CB 3.85Å; W477-C515 HydrophobicContact CE3-CB 3.8Å; W477-C515 HydrophobicContact CH2-CB 3.79Å; W477-C515 HydrophobicContact CZ2-CB 3.82Å; W477-C515 HydrophobicContact CZ3-CB 3.77Å; W477-V532 HydrophobicContact CH2-CB 4.38Å; W477-V532 HydrophobicContact CH2-CG2 3.95Å; W477-V532 HydrophobicContact CZ3-CB 4.32Å; W477-V532 HydrophobicContact CZ3-CG2 4.26Å
478	S	96.6	Very high	92.4	Very high	14 Å²	14	52.1 Å²	52.1	10%	0.098	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	165.9	175.7	63.1	0	0	0	0	112.1	M486 M491 Y513 R514	S478-M486 VanDerWaalsContact CA-SD 3.59Å; S478-M491 WeakPolarHBondContact CB-O 3.47Å; S478-Y513 CarbonylContact O-C 3.55Å; S478-Y513 WeakPolarHBondContact O-CA 3.42Å; S478-R514 PolarHBondContact N-O 3.42Å; S478-R514 PolarHBondContact O-N 2.87Å
479	R	94.9	Very high	92.2	Very high	24 Å²	24	52 Å²	52	9%	0.091	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	133.8	167	-67.8	-63.2	-62.6	-147.6	-0.8	109.7	D481 K482 A484 M486 M509 T510 Y513	R479-D481 IonicContact CZ-OD1 2.81Å; R479-D481 VanDerWaalsContact CZ-OD1 3.24Å; R479-D481 IonicContact CZ-OD2 2.8Å; R479-D481 IonicContact NE-OD1 2.67Å; R479-D481 PolarHBondContact NE-OD1 2.99Å; R479-D481 IonicContact NE-OD2 3.19Å; R479-D481 IonicContact NH2-OD1 3.57Å; R479-D481 PolarHBondContact NH2-OD1 2.81Å; R479-D481 IonicContact NH2-OD2 2.67Å; R479-D481 PolarHBondContact NH2-OD2 3.1Å; R479-K482 HydrophobicContact CB-CG 4.4Å; R479-K482 WeakPolarHBondContact CB-O 3.49Å; R479-K482 VanDerWaalsContact NH2-NZ 3.19Å; R479-A484 HydrophobicContact CG-CB 4.4Å; R479-M486 HydrophobicContact CG-SD 4.37Å; R479-M509 PolarHBondContact NH1-O 2.82Å; R479-T510 PolarHBondContact NH2-O 3.04Å; R479-Y513 VanDerWaalsContact NH1-CE2 3.25Å; R479-Y513 PolarHBondContact NH1-OH 2.91Å
480	A	94.3	Very high	92.2	Very high	34 Å²	34	53 Å²	53	28%	0.281	30%	0.296	S	S	.	.	S	Bend	trans	-101.4	-19.5	179.3	0	0	0	0	0	112.9	S512 R514	A480-S512 WeakPolarHBondContact CB-O 3.36Å; A480-S512 PolarHBondContact N-O 2.8Å; A480-R514 HydrophobicContact CB-CB 4.01Å
481	D	90.1	Very high	92.1	Very high	75 Å²	75	52.8 Å²	52.8	40%	0.401	30%	0.298	S	S	.	.	S	Bend	trans	-90.8	-25.3	-178	66.9	-50.3	0	0	0	113.9	R479	R479-D481 IonicContact CZ-OD1 2.81Å; R479-D481 VanDerWaalsContact CZ-OD1 3.24Å; R479-D481 IonicContact CZ-OD2 2.8Å; R479-D481 IonicContact NE-OD1 2.67Å; R479-D481 PolarHBondContact NE-OD1 2.99Å; R479-D481 IonicContact NE-OD2 3.19Å; R479-D481 IonicContact NH2-OD1 3.57Å; R479-D481 PolarHBondContact NH2-OD1 2.81Å; R479-D481 IonicContact NH2-OD2 2.67Å; R479-D481 PolarHBondContact NH2-OD2 3.1Å
482	K	89.8	Confident	92.1	Very high	86 Å²	86	55.7 Å²	55.7	37%	0.374	31%	0.309	S	S	.	.	S	Bend	trans	-156.5	151.2	-175.3	66.7	-161.7	177.4	-156.5	0	111	R479 A484 E508	R479-K482 HydrophobicContact CB-CG 4.4Å; R479-K482 WeakPolarHBondContact CB-O 3.49Å; R479-K482 VanDerWaalsContact NH2-NZ 3.19Å; K482-A484 HydrophobicContact CD-CB 4.31Å; K482-A484 HydrophobicContact CG-CB 3.88Å; K482-A484 PolarHBondContact O-N 3.16Å; K482-A484 VanDerWaalsContact O-N 3.15Å; K482-E508 PolarHBondContact NZ-O 3.05Å
483	E	90.3	Very high	92.2	Very high	189 Å²	189	51.5 Å²	51.5	88%	0.883	29%	0.292	S	S	*	.	S	Bend	trans	-74.8	100.8	165.6	-68.7	-178.7	-178.7	0	0	108.8	M491	E483-M491 HydrophobicContact CB-CE 4.15Å
484	A	89.3	Confident	92.2	Very high	24 Å²	24	54.2 Å²	54.2	20%	0.198	30%	0.304	C	S	.	.			trans	-149.2	151.1	175.7	0	0	0	0	0	110.3	R479 K482	R479-A484 HydrophobicContact CG-CB 4.4Å; K482-A484 HydrophobicContact CD-CB 4.31Å; K482-A484 HydrophobicContact CG-CB 3.88Å; K482-A484 PolarHBondContact O-N 3.16Å; K482-A484 VanDerWaalsContact O-N 3.15Å
485	P	91.8	Very high	92.2	Very high	81 Å²	81	54.3 Å²	54.3	53%	0.526	31%	0.305	S	S	.	.			trans	-68.2	156	179.3	28.5	-35.5	0	0	0	112.8	S490 M491	P485-S490 CarbonylContact C-O 3.43Å; P485-S490 VanDerWaalsContact CA-O 3.23Å; P485-S490 WeakPolarHBondContact CA-O 3.33Å; P485-M491 HydrophobicContact CB-SD 4.5Å
486	M	91.5	Very high	92	Very high	9 Å²	9	62.1 Å²	62.1	4%	0.044	34%	0.336	C	S	.	.			trans	-80.6	171.8	171.9	-62.1	-59.4	-70.5	0	0	110.6	W477 S478 R479 D488 G489 S490 M493 L500 Y513	W477-M486 HydrophobicContact CB-CE 3.73Å; S478-M486 VanDerWaalsContact CA-SD 3.59Å; R479-M486 HydrophobicContact CG-SD 4.37Å; M486-D488 WeakPolarHBondContact CB-OD1 3.49Å; M486-D488 PolarHBondContact O-N 3.05Å; M486-G489 PolarHBondContact O-N 2.88Å; M486-S490 PolarHBondContact N-O 2.92Å; M486-M493 HydrophobicContact CB-CB 4.03Å; M486-M493 HydrophobicContact CE-CB 4.39Å; M486-M493 HydrophobicContact CG-CB 4.19Å; M486-L500 HydrophobicContact CE-CD1 3.65Å; M486-L500 HydrophobicContact CE-CD2 3.49Å; M486-L500 VanDerWaalsContact CE-CD2 3.49Å; M486-L500 HydrophobicContact CE-CG 4.23Å; M486-Y513 HydrophobicContact CE-CD1 4.17Å; M486-Y513 HydrophobicContact CE-CE1 4.16Å; M486-Y513 HydrophobicContact SD-CE1 4.42Å
487	P	85.1	Confident	91.8	Very high	82 Å²	82	65.4 Å²	65.4	53%	0.532	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-16.3	-176.2	-26.2	36.3	0	0	0	115.9	I502	P487-I502 HydrophobicContact CG-CG1 4.33Å
488	D	86.9	Confident	91.6	Very high	88 Å²	88	65.4 Å²	65.4	47%	0.471	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	0.1	174	66.9	-10.7	0	0	0	113.7	M486 S490	M486-D488 WeakPolarHBondContact CB-OD1 3.49Å; M486-D488 PolarHBondContact O-N 3.05Å; D488-S490 VanDerWaalsContact C-N 3.29Å; D488-S490 VanDerWaalsContact CG-OG 3.24Å; D488-S490 VanDerWaalsContact OD1-CB 3.26Å; D488-S490 WeakPolarHBondContact OD1-CB 3.32Å; D488-S490 PolarHBondContact OD1-N 2.97Å; D488-S490 PolarHBondContact OD1-OG 3.22Å; D488-S490 PolarHBondContact OD2-OG 2.66Å; D488-S490 VanDerWaalsContact OD2-OG 3.07Å
489	G	87.6	Confident	91.6	Very high	58 Å²	58	65.8 Å²	65.8	60%	0.598	36%	0.355	S	S	*	.	S	Bend	trans	82.7	-4.2	-174.9	0	0	0	0	0	114.8	M486	M486-G489 PolarHBondContact O-N 2.88Å
490	S	91.4	Very high	91.6	Very high	36 Å²	36	64.8 Å²	64.8	25%	0.252	35%	0.352	S	S	.	.	S	Bend	trans	-81.1	163.5	177.2	79.6	0	0	0	0	112	P485 M486 D488 Q492	P485-S490 CarbonylContact C-O 3.43Å; P485-S490 VanDerWaalsContact CA-O 3.23Å; P485-S490 WeakPolarHBondContact CA-O 3.33Å; M486-S490 PolarHBondContact N-O 2.92Å; D488-S490 VanDerWaalsContact C-N 3.29Å; D488-S490 VanDerWaalsContact CG-OG 3.24Å; D488-S490 VanDerWaalsContact OD1-CB 3.26Å; D488-S490 WeakPolarHBondContact OD1-CB 3.32Å; D488-S490 PolarHBondContact OD1-N 2.97Å; D488-S490 PolarHBondContact OD1-OG 3.22Å; D488-S490 PolarHBondContact OD2-OG 2.66Å; D488-S490 VanDerWaalsContact OD2-OG 3.07Å; S490-Q492 VanDerWaalsContact OG-C 3.22Å; S490-Q492 PolarHBondContact OG-N 2.86Å; S490-Q492 PolarHBondContact OG-O 3.37Å
491	M	92	Very high	91.6	Very high	103 Å²	103	68.8 Å²	68.8	51%	0.507	36%	0.36	S	S	.	.	S	Bend	trans	-83.7	-14.3	169.4	-66.3	-61.3	-66.5	0	0	113.3	S478 E483 P485	S478-M491 WeakPolarHBondContact CB-O 3.47Å; E483-M491 HydrophobicContact CB-CE 4.15Å; P485-M491 HydrophobicContact CB-SD 4.5Å
492	Q	93.6	Very high	91.7	Very high	98 Å²	98	65.4 Å²	65.4	46%	0.458	34%	0.341	S	S	.	.	S	Bend	trans	-149.3	113.1	178.2	-63.9	-169	17.1	0	0	110.1	W477 S490	W477-Q492 CarbonylContact O-C 3.58Å; W477-Q492 WeakPolarHBondContact O-CA 3.49Å; S490-Q492 VanDerWaalsContact OG-C 3.22Å; S490-Q492 PolarHBondContact OG-N 2.86Å; S490-Q492 PolarHBondContact OG-O 3.37Å
493	M	94	Very high	91.9	Very high	52 Å²	52	66.3 Å²	66.3	26%	0.256	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	129.8	-177	-172.9	178.8	-175.8	0	0	111.1	L476 W477 M486 L500	L476-M493 WeakPolarHBondContact CA-O 3.43Å; W477-M493 PolarHBondContact N-O 2.83Å; W477-M493 PolarHBondContact O-N 2.86Å; M486-M493 HydrophobicContact CB-CB 4.03Å; M486-M493 HydrophobicContact CE-CB 4.39Å; M486-M493 HydrophobicContact CG-CB 4.19Å; M493-L500 HydrophobicContact SD-CD1 3.53Å; M493-L500 VanDerWaalsContact SD-CD1 3.53Å
494	E	93.3	Very high	92	Very high	62 Å²	62	62.5 Å²	62.5	29%	0.29	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	134.5	174.7	-72.8	-173.7	-162.5	0	0	111.9	R334 I474 L476 Y496 Y520	R334-E494 IonicContact CZ-OE1 2.67Å; R334-E494 IonicContact NH2-OE1 3.76Å; R334-E494 PolarHBondContact NH2-OE1 3.22Å; I474-E494 HydrophobicContact CG2-CB 3.96Å; I474-E494 HydrophobicContact CG2-CG 4.14Å; L476-E494 HydrophobicContact CD2-CG 3.9Å; E494-Y496 HydrophobicContact CB-CE2 4.14Å; E494-Y496 PolarHBondContact OE2-OH 2.95Å; E494-Y520 PolarHBondContact OE1-OH 3.22Å; E494-Y520 VanDerWaalsContact OE1-OH 3.1Å
495	S	94.9	Very high	92.2	Very high	8 Å²	8	61.4 Å²	61.4	6%	0.056	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	121.4	176.7	171.6	0	0	0	0	111.1	I474 I475 D497 G498 V499	I474-S495 WeakPolarHBondContact CG2-O 3.29Å; I475-S495 PolarHBondContact N-O 2.85Å; I475-S495 WeakPolarHBondContact O-CB 3.37Å; I475-S495 PolarHBondContact O-N 3.36Å; S495-D497 PolarHBondContact OG-OD1 2.92Å; S495-D497 VanDerWaalsContact OG-OD1 3.07Å; S495-G498 WeakPolarHBondContact OG-CA 3.21Å; S495-G498 PolarHBondContact OG-N 2.88Å; S495-G498 VanDerWaalsContact OG-N 3.16Å; S495-V499 WeakPolarHBondContact CB-O 3.49Å; S495-V499 PolarHBondContact OG-N 2.69Å; S495-V499 PolarHBondContact OG-O 2.85Å
496	Y	91.3	Very high	92.3	Very high	166 Å²	166	58.5 Å²	58.5	65%	0.651	31%	0.312	S	S	*	.	S	Bend	trans	-90.6	-21.8	-173.7	-70.9	-107.9	0	0	0	112.8	I474 E494	I474-Y496 HydrophobicContact CD1-CD1 4.19Å; I474-Y496 HydrophobicContact CD1-CE1 3.5Å; I474-Y496 VanDerWaalsContact CD1-CE1 3.5Å; I474-Y496 HydrophobicContact CD1-CE2 4.2Å; I474-Y496 VanDerWaalsContact CD1-CZ 3.47Å; I474-Y496 WeakPolarHBondContact CD1-OH 3.48Å; I474-Y496 HydrophobicContact CG1-CD1 3.97Å; I474-Y496 HydrophobicContact CG1-CE1 3.82Å; I474-Y496 HydrophobicContact CG1-CE2 4.45Å; I474-Y496 HydrophobicContact CG1-CG 4.37Å; E494-Y496 HydrophobicContact CB-CE2 4.14Å; E494-Y496 PolarHBondContact OE2-OH 2.95Å
497	D	92.5	Very high	92.3	Very high	84 Å²	84	61.7 Å²	61.7	45%	0.449	32%	0.324	S	S	.	.	S	Bend	trans	-99.1	-9.2	176.1	61.2	-8.9	0	0	0	113.2	S495 V499 R501	S495-D497 PolarHBondContact OG-OD1 2.92Å; S495-D497 VanDerWaalsContact OG-OD1 3.07Å; D497-V499 WeakPolarHBondContact OD1-CB 3.47Å; D497-V499 PolarHBondContact OD1-N 3.06Å; D497-R501 IonicContact OD1-NH1 3.99Å; D497-R501 IonicContact OD2-CZ 3.2Å; D497-R501 VanDerWaalsContact OD2-CZ 3.22Å; D497-R501 IonicContact OD2-NH1 2.69Å; D497-R501 PolarHBondContact OD2-NH1 2.79Å; D497-R501 IonicContact OD2-NH2 3.14Å; D497-R501 PolarHBondContact OD2-NH2 2.88Å
498	G	93.5	Very high	92.6	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.01	33%	0.326	C	S	.	.	S	Bend	trans	85.9	7.3	-174.2	0	0	0	0	0	113.8	C465 W477 S495	C465-G498 PolarHBondContact N-O 2.73Å; W477-G498 WeakPolarHBondContact CZ2-O 3.25Å; S495-G498 WeakPolarHBondContact OG-CA 3.21Å; S495-G498 PolarHBondContact OG-N 2.88Å; S495-G498 VanDerWaalsContact OG-N 3.16Å
499	V	95.1	Very high	92.8	Very high	21 Å²	21	62.1 Å²	62.1	13%	0.127	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	133	-179.9	-175	0	0	0	0	111.4	E462 L463 E464 S495 D497 R501	E462-V499 HydrophobicContact CB-CG1 3.67Å; E462-V499 HydrophobicContact CG-CG1 4.01Å; L463-V499 CarbonylContact O-C 3.44Å; L463-V499 VanDerWaalsContact O-CA 3.29Å; L463-V499 WeakPolarHBondContact O-CA 3.43Å; E464-V499 HydrophobicContact CG-CG2 4.42Å; S495-V499 WeakPolarHBondContact CB-O 3.49Å; S495-V499 PolarHBondContact OG-N 2.69Å; S495-V499 PolarHBondContact OG-O 2.85Å; D497-V499 WeakPolarHBondContact OD1-CB 3.47Å; D497-V499 PolarHBondContact OD1-N 3.06Å; V499-R501 HydrophobicContact CG1-CG 3.99Å
500	L	95.1	Very high	93.1	Very high	4 Å²	4	62 Å²	62	2%	0.021	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	124	163.3	174.6	69.8	0	0	0	109.1	E462 L463 W477 M486 M493 I502 Y513	E462-L500 WeakPolarHBondContact CA-O 3.42Å; L463-L500 HydrophobicContact CB-CB 4.32Å; L463-L500 HydrophobicContact CD1-CD2 4.17Å; L463-L500 PolarHBondContact N-O 2.79Å; L463-L500 PolarHBondContact O-N 2.87Å; W477-L500 HydrophobicContact CB-CB 4.39Å; W477-L500 HydrophobicContact CB-CD1 4.24Å; W477-L500 HydrophobicContact CB-CD2 4.26Å; W477-L500 HydrophobicContact CD2-CB 3.61Å; W477-L500 HydrophobicContact CD2-CD2 4.19Å; W477-L500 HydrophobicContact CD2-CG 4.45Å; W477-L500 HydrophobicContact CE3-CB 4.14Å; W477-L500 HydrophobicContact CE3-CD2 4.07Å; W477-L500 HydrophobicContact CG-CB 3.74Å; W477-L500 HydrophobicContact CG-CD1 4.42Å; W477-L500 HydrophobicContact CG-CD2 4.32Å; W477-L500 HydrophobicContact CG-CG 4.38Å; W477-L500 HydrophobicContact CZ2-CB 4.18Å; M486-L500 HydrophobicContact CE-CD1 3.65Å; M486-L500 HydrophobicContact CE-CD2 3.49Å; M486-L500 VanDerWaalsContact CE-CD2 3.49Å; M486-L500 HydrophobicContact CE-CG 4.23Å; M493-L500 HydrophobicContact SD-CD1 3.53Å; M493-L500 VanDerWaalsContact SD-CD1 3.53Å; L500-I502 HydrophobicContact CD2-CD1 4.01Å; L500-I502 HydrophobicContact CD2-CG1 4.21Å; L500-I502 HydrophobicContact CG-CD1 4.43Å; L500-I502 HydrophobicContact CG-CG1 4.1Å; L500-Y513 HydrophobicContact CD2-CD1 3.58Å; L500-Y513 HydrophobicContact CD2-CE1 3.72Å; L500-Y513 HydrophobicContact CD2-CG 4.48Å
501	R	94.2	Very high	93.3	Very high	118 Å²	118	61.2 Å²	61.2	45%	0.445	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	125.2	179.4	-59.5	-175	168.5	77.7	14.6	109.9	V461 E462 D497 V499	V461-R501 WeakPolarHBondContact O-CA 3.47Å; E462-R501 HydrophobicContact CG-CG 4.25Å; E462-R501 IonicContact OE1-CZ 2.77Å; E462-R501 VanDerWaalsContact OE1-CZ 3.26Å; E462-R501 IonicContact OE1-NE 3.71Å; E462-R501 PolarHBondContact OE1-NE 2.84Å; E462-R501 IonicContact OE1-NH2 3.39Å; E462-R501 PolarHBondContact OE1-NH2 2.98Å; D497-R501 IonicContact OD1-NH1 3.99Å; D497-R501 IonicContact OD2-CZ 3.2Å; D497-R501 VanDerWaalsContact OD2-CZ 3.22Å; D497-R501 IonicContact OD2-NH1 2.69Å; D497-R501 PolarHBondContact OD2-NH1 2.79Å; D497-R501 IonicContact OD2-NH2 3.14Å; D497-R501 PolarHBondContact OD2-NH2 2.88Å; V499-R501 HydrophobicContact CG1-CG 3.99Å
502	I	93.8	Very high	93.5	Very high	3 Å²	3	57.9 Å²	57.9	2%	0.015	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	116.3	177.1	-51.2	169.2	0	0	0	107.7	T460 V461 P487 L500 V505 M509 Y513 L534	T460-I502 CarbonylContact C-O 3.55Å; T460-I502 WeakPolarHBondContact CA-O 3.48Å; V461-I502 HydrophobicContact CG2-CB 3.89Å; V461-I502 HydrophobicContact CG2-CD1 4.33Å; V461-I502 HydrophobicContact CG2-CG1 4.43Å; V461-I502 PolarHBondContact N-O 2.96Å; V461-I502 PolarHBondContact O-N 2.86Å; P487-I502 HydrophobicContact CG-CG1 4.33Å; L500-I502 HydrophobicContact CD2-CD1 4.01Å; L500-I502 HydrophobicContact CD2-CG1 4.21Å; L500-I502 HydrophobicContact CG-CD1 4.43Å; L500-I502 HydrophobicContact CG-CG1 4.1Å; I502-V505 HydrophobicContact CB-CG2 4.14Å; I502-V505 HydrophobicContact CG2-CG2 3.84Å; I502-M509 HydrophobicContact CG2-CE 4.44Å; I502-M509 HydrophobicContact CG2-SD 3.49Å; I502-M509 WeakPolarHBondContact CG2-SD 3.44Å; I502-Y513 HydrophobicContact CD1-CE1 3.96Å; I502-Y513 HydrophobicContact CD1-CE2 4.45Å; I502-Y513 WeakPolarHBondContact CD1-OH 3.36Å; I502-L534 HydrophobicContact CD1-CD2 4.06Å
503	V	92.9	Very high	93.6	Very high	106 Å²	106	53.6 Å²	53.6	64%	0.642	27%	0.268	S	S	*	.	S	Bend	trans	-95.8	140.4	-179.8	179.2	0	0	0	0	109.2	T460	T460-V503 HydrophobicContact CG2-CB 4.46Å; T460-V503 HydrophobicContact CG2-CG2 3.9Å
504	N	92.4	Very high	93.7	Very high	109 Å²	109	54.6 Å²	54.6	58%	0.583	27%	0.269	S	S	*	.	S	Bend	trans	55.5	58.9	178.8	-175	57.9	0	0	0	112.3	D459 S506	D459-N504 WeakPolarHBondContact O-CA 3.37Å; D459-N504 PolarHBondContact O-N 2.74Å; D459-N504 VanDerWaalsContact O-N 3.13Å; N504-S506 PolarHBondContact O-N 2.71Å
505	V	94	Very high	93.9	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.006	26%	0.255	C	S	.	.			trans	-61.1	124.1	-175.8	176.4	0	0	0	0	111.1	E457 G458 D459 V461 I502 M509 L534 V536	E457-V505 CarbonylContact C-O 3.56Å; E457-V505 WeakPolarHBondContact CA-O 3.44Å; G458-V505 PolarHBondContact N-O 2.91Å; D459-V505 WeakPolarHBondContact O-CG2 3.46Å; D459-V505 PolarHBondContact O-N 3.1Å; V461-V505 HydrophobicContact CB-CG2 4.29Å; V461-V505 HydrophobicContact CG1-CG2 3.91Å; V461-V505 HydrophobicContact CG2-CG2 3.54Å; I502-V505 HydrophobicContact CB-CG2 4.14Å; I502-V505 HydrophobicContact CG2-CG2 3.84Å; V505-M509 HydrophobicContact CG1-CB 4.23Å; V505-M509 HydrophobicContact CG1-SD 4.38Å; V505-L534 HydrophobicContact CG1-CD2 4.2Å; V505-V536 HydrophobicContact CG1-CB 4.48Å; V505-V536 HydrophobicContact CG1-CG1 4.14Å; V505-V536 HydrophobicContact CG1-CG2 3.47Å; V505-V536 VanDerWaalsContact CG1-CG2 3.47Å
506	S	93.9	Very high	94	Very high	20 Å²	20	52.7 Å²	52.7	14%	0.14	26%	0.259	C	S	.	.			trans	-99.9	158.2	174.9	59.8	0	0	0	0	112.5	N504 E508 M509	N504-S506 PolarHBondContact O-N 2.71Å; S506-E508 WeakPolarHBondContact CB-OE1 3.41Å; S506-E508 PolarHBondContact O-N 3.07Å; S506-E508 VanDerWaalsContact O-N 3.15Å; S506-E508 PolarHBondContact OG-OE1 3.36Å; S506-E508 PolarHBondContact OG-OE2 3.4Å; S506-M509 VanDerWaalsContact O-CB 3.3Å; S506-M509 WeakPolarHBondContact O-CB 3.26Å; S506-M509 PolarHBondContact O-N 2.92Å; S506-M509 WeakPolarHBondContact OG-CG 3.45Å
507	R	90.8	Very high	94.2	Very high	75 Å²	75	45 Å²	45	28%	0.283	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-55.1	-32	-177.6	61.6	-171.5	71.7	-170.2	9.1	115	E457 M509 T510 Y538	E457-R507 WeakPolarHBondContact OE1-CB 3.24Å; E457-R507 WeakPolarHBondContact OE1-CG 3.25Å; E457-R507 IonicContact OE1-CZ 3.47Å; E457-R507 PolarHBondContact OE1-N 3.27Å; E457-R507 IonicContact OE1-NE 3.68Å; E457-R507 PolarHBondContact OE1-NE 2.62Å; E457-R507 IonicContact OE1-NH2 3.94Å; E457-R507 IonicContact OE2-CZ 3.86Å; E457-R507 IonicContact OE2-NE 2.73Å; E457-R507 PolarHBondContact OE2-NE 2.9Å; E457-R507 IonicContact OE2-NH2 3.51Å; E457-R507 PolarHBondContact OE2-NH2 3.44Å; R507-M509 VanDerWaalsContact C-N 3.27Å; R507-M509 PolarHBondContact O-N 2.9Å; R507-T510 WeakPolarHBondContact O-CB 3.4Å; R507-T510 VanDerWaalsContact O-CG2 3.25Å; R507-T510 WeakPolarHBondContact O-CG2 3.17Å; R507-T510 PolarHBondContact O-N 2.68Å; R507-Y538 HydrophobicContact CB-CD1 3.99Å; R507-Y538 HydrophobicContact CB-CE1 4.07Å
508	E	90.8	Very high	94.3	Very high	124 Å²	124	41 Å²	41	58%	0.579	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-76.8	-8.6	177	68.9	-76.4	174.4	0	0	114.7	K482 S506 T510	K482-E508 PolarHBondContact NZ-O 3.05Å; S506-E508 WeakPolarHBondContact CB-OE1 3.41Å; S506-E508 PolarHBondContact O-N 3.07Å; S506-E508 VanDerWaalsContact O-N 3.15Å; S506-E508 PolarHBondContact OG-OE1 3.36Å; S506-E508 PolarHBondContact OG-OE2 3.4Å; E508-T510 VanDerWaalsContact C-N 3.3Å
509	M	92.4	Very high	94.3	Very high	55 Å²	55	45.3 Å²	45.3	27%	0.271	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-80	-8.1	167.8	-59.2	179.8	-175.3	0	0	112.6	R479 I502 V505 S506 R507 Y513	R479-M509 PolarHBondContact NH1-O 2.82Å; I502-M509 HydrophobicContact CG2-CE 4.44Å; I502-M509 HydrophobicContact CG2-SD 3.49Å; I502-M509 WeakPolarHBondContact CG2-SD 3.44Å; V505-M509 HydrophobicContact CG1-CB 4.23Å; V505-M509 HydrophobicContact CG1-SD 4.38Å; S506-M509 VanDerWaalsContact O-CB 3.3Å; S506-M509 WeakPolarHBondContact O-CB 3.26Å; S506-M509 PolarHBondContact O-N 2.92Å; S506-M509 WeakPolarHBondContact OG-CG 3.45Å; R507-M509 VanDerWaalsContact C-N 3.27Å; R507-M509 PolarHBondContact O-N 2.9Å; M509-Y513 PolarHBondContact O-OH 2.84Å
510	T	93.3	Very high	94.2	Very high	56 Å²	56	46 Å²	46	34%	0.344	23%	0.229	S	C	.	.			trans	-60.7	149.1	171.5	-155.1	0	0	0	0	111.4	R479 R507 E508 L534 V536	R479-T510 PolarHBondContact NH2-O 3.04Å; R507-T510 WeakPolarHBondContact O-CB 3.4Å; R507-T510 VanDerWaalsContact O-CG2 3.25Å; R507-T510 WeakPolarHBondContact O-CG2 3.17Å; R507-T510 PolarHBondContact O-N 2.68Å; E508-T510 VanDerWaalsContact C-N 3.3Å; T510-L534 CarbonylContact C-O 3.55Å; T510-L534 VanDerWaalsContact CA-O 3.26Å; T510-L534 WeakPolarHBondContact CA-O 3.28Å; T510-L534 PolarHBondContact OG1-O 2.75Å; T510-V536 PolarHBondContact OG1-N 2.82Å
511	G	94.6	Very high	94	Very high	20 Å²	20	47.2 Å²	47.2	21%	0.206	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	132.2	-170.6	-179.8	0	0	0	0	0	113.3	L534	G511-L534 PolarHBondContact N-O 2.9Å; G511-L534 PolarHBondContact O-N 2.98Å
512	S	96.4	Very high	94	Very high	32 Å²	32	41.6 Å²	41.6	22%	0.224	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	132.3	-174.4	-49.6	0	0	0	0	111.7	A480	A480-S512 WeakPolarHBondContact CB-O 3.36Å; A480-S512 PolarHBondContact N-O 2.8Å
513	Y	96.3	Very high	94	Very high	8 Å²	8	41.6 Å²	41.6	3%	0.031	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	133.6	175.3	-74.2	-102.4	0	0	0	109.9	L463 S478 R479 M486 L500 I502 M509 V531 V532 L534	L463-Y513 HydrophobicContact CD1-CD1 4.03Å; L463-Y513 HydrophobicContact CD1-CD2 3.5Å; L463-Y513 HydrophobicContact CD1-CE2 4.06Å; L463-Y513 HydrophobicContact CD1-CG 3.48Å; L463-Y513 VanDerWaalsContact CD1-CG 3.48Å; S478-Y513 CarbonylContact O-C 3.55Å; S478-Y513 WeakPolarHBondContact O-CA 3.42Å; R479-Y513 VanDerWaalsContact NH1-CE2 3.25Å; R479-Y513 PolarHBondContact NH1-OH 2.91Å; M486-Y513 HydrophobicContact CE-CD1 4.17Å; M486-Y513 HydrophobicContact CE-CE1 4.16Å; M486-Y513 HydrophobicContact SD-CE1 4.42Å; L500-Y513 HydrophobicContact CD2-CD1 3.58Å; L500-Y513 HydrophobicContact CD2-CE1 3.72Å; L500-Y513 HydrophobicContact CD2-CG 4.48Å; I502-Y513 HydrophobicContact CD1-CE1 3.96Å; I502-Y513 HydrophobicContact CD1-CE2 4.45Å; I502-Y513 WeakPolarHBondContact CD1-OH 3.36Å; M509-Y513 PolarHBondContact O-OH 2.84Å; Y513-V531 CarbonylContact O-C 3.54Å; Y513-V531 VanDerWaalsContact O-CA 3.3Å; Y513-V531 WeakPolarHBondContact O-CA 3.3Å; Y513-V532 PolarHBondContact N-O 2.73Å; Y513-V532 PolarHBondContact O-N 2.92Å; Y513-L534 HydrophobicContact CD2-CB 4.16Å; Y513-L534 HydrophobicContact CE2-CB 3.93Å; Y513-L534 HydrophobicContact CE2-CD2 3.97Å
514	R	96.9	Very high	94	Very high	74 Å²	74	39.2 Å²	39.2	28%	0.279	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	131.9	173.7	-170.7	-177.6	-52.4	-81.3	-10.7	108.8	W477 S478 A480 E529 A530	W477-R514 WeakPolarHBondContact CA-O 3.42Å; S478-R514 PolarHBondContact N-O 3.42Å; S478-R514 PolarHBondContact O-N 2.87Å; A480-R514 HydrophobicContact CB-CB 4.01Å; R514-E529 WeakPolarHBondContact CD-OE2 3.43Å; R514-E529 IonicContact CZ-OE2 3.13Å; R514-E529 IonicContact NE-OE2 2.89Å; R514-E529 IonicContact NH1-OE2 2.7Å; R514-E529 PolarHBondContact NH1-OE2 2.93Å; R514-A530 WeakPolarHBondContact CA-O 3.34Å
515	C	96.6	Very high	94	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	135.9	163	61.2	0	0	0	0	108.2	L444 C465 I475 L476 W477 E529 A530	L444-C515 WeakPolarHBondContact CD2-O 3.39Å; C465-C515 HydrophobicContact CB-CB 3.73Å; C465-C515 WeakPolarHBondContact CB-SG 3.45Å; C465-C515 WeakPolarHBondContact SG-CB 3.25Å; C465-C515 CovalentContact SG-SG 2.03Å; C465-C515 PolarHBondContact SG-SG 2.91Å; I475-C515 HydrophobicContact CG2-CB 3.76Å; L476-C515 WeakPolarHBondContact O-CA 3.12Å; W477-C515 HydrophobicContact CD2-CB 3.85Å; W477-C515 HydrophobicContact CE3-CB 3.8Å; W477-C515 HydrophobicContact CH2-CB 3.79Å; W477-C515 HydrophobicContact CZ2-CB 3.82Å; W477-C515 HydrophobicContact CZ3-CB 3.77Å; C515-E529 WeakPolarHBondContact O-CA 3.4Å; C515-A530 PolarHBondContact N-O 3.25Å; C515-A530 PolarHBondContact O-N 2.94Å
516	Q	96.4	Very high	94	Very high	30 Å²	30	42 Å²	42	14%	0.14	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	148.2	-179.7	68	-171.7	11.6	0	0	112.5	I475 L476 R528 E529	I475-Q516 CarbonylContact C-O 3.55Å; I475-Q516 WeakPolarHBondContact CA-O 3.38Å; L476-Q516 HydrophobicContact CB-CG 3.82Å; L476-Q516 PolarHBondContact N-O 2.94Å; L476-Q516 PolarHBondContact O-N 2.86Å; Q516-R528 CarbonylContact C-O 3.6Å; Q516-R528 VanDerWaalsContact CA-O 3.22Å; Q516-R528 WeakPolarHBondContact CA-O 3.05Å; Q516-E529 HydrophobicContact CB-CG 3.92Å
517	T	96	Very high	94	Very high	4 Å²	4	42.8 Å²	42.8	3%	0.025	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	130.9	177.6	57.4	0	0	0	0	111.5	P442 L444 V467 P473 I475 R528	P442-T517 HydrophobicContact CB-CG2 4.04Å; P442-T517 HydrophobicContact CG-CG2 4.29Å; L444-T517 HydrophobicContact CB-CG2 4.2Å; L444-T517 HydrophobicContact CD2-CG2 4.39Å; V467-T517 HydrophobicContact CG2-CG2 4.29Å; P473-T517 HydrophobicContact CG-CG2 4.08Å; I475-T517 HydrophobicContact CD1-CG2 4.03Å; T517-R528 HydrophobicContact CG2-CB 3.96Å; T517-R528 HydrophobicContact CG2-CG 4.32Å; T517-R528 PolarHBondContact N-O 2.79Å; T517-R528 PolarHBondContact OG1-N 3.17Å
518	S	94.8	Very high	94.2	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.007	21%	0.209	C	C	.	.			trans	-62.1	144.5	170.5	60	0	0	0	0	111.7	I474 Y520	I474-S518 WeakPolarHBondContact CB-OG 3.48Å; I474-S518 PolarHBondContact N-OG 2.83Å; I474-S518 WeakPolarHBondContact O-CB 3.15Å; I474-S518 PolarHBondContact O-N 3.47Å; I474-S518 PolarHBondContact O-OG 2.79Å; S518-Y520 WeakPolarHBondContact CB-O 3.26Å; S518-Y520 PolarHBondContact O-N 2.97Å; S518-Y520 PolarHBondContact OG-O 2.95Å
519	Q	93.4	Very high	94.5	Very high	90 Å²	90	41.4 Å²	41.4	42%	0.421	20%	0.204	S	C	.	.	S	Bend	trans	-80.9	2.9	171.6	-59.7	-174.2	-73.5	0	0	112.7	W336 V525 P527	W336-Q519 WeakPolarHBondContact CB-O 3.4Å; Q519-V525 PolarHBondContact NE2-O 2.91Å; Q519-P527 HydrophobicContact CG-CG 3.95Å
520	Y	92.9	Very high	94.6	Very high	37 Å²	37	39.7 Å²	39.7	15%	0.145	20%	0.199	C	C	.	.	S	Bend	trans	-125.4	164.8	175.8	57.6	-95.3	0	0	0	110.9	R334 F335 I474 L476 E494 S518 G522	R334-Y520 HydrophobicContact CG-CD2 3.91Å; R334-Y520 HydrophobicContact CG-CG 4.34Å; R334-Y520 PolarHBondContact NH2-OH 2.87Å; F335-Y520 CarbonylContact O-C 3.48Å; F335-Y520 WeakPolarHBondContact O-CA 3.49Å; I474-Y520 HydrophobicContact CD1-CD2 4.35Å; I474-Y520 HydrophobicContact CD1-CE2 3.91Å; L476-Y520 WeakPolarHBondContact CD2-OH 3.48Å; E494-Y520 PolarHBondContact OE1-OH 3.22Å; E494-Y520 VanDerWaalsContact OE1-OH 3.1Å; S518-Y520 WeakPolarHBondContact CB-O 3.26Å; S518-Y520 PolarHBondContact O-N 2.97Å; S518-Y520 PolarHBondContact OG-O 2.95Å; Y520-G522 PolarHBondContact O-N 2.02Å
521	N	91.9	Very high	94.8	Very high	29 Å²	29	40 Å²	40	16%	0.155	20%	0.2	C	C	.	.	S	Bend	trans	51.1	33.4	-165.7	-64	-12.9	0	0	0	113	R334 F335 P473 I474	R334-N521 VanDerWaalsContact CA-OD1 3.26Å; R334-N521 WeakPolarHBondContact CA-OD1 3.39Å; F335-N521 HydrophobicContact CD1-CB 4.39Å; F335-N521 WeakPolarHBondContact CD1-OD1 3.39Å; F335-N521 HydrophobicContact CE1-CB 4.02Å; F335-N521 VanDerWaalsContact CZ-C 3.41Å; F335-N521 PolarHBondContact N-OD1 2.76Å; F335-N521 WeakPolarHBondContact O-CA 3.31Å; F335-N521 PolarHBondContact O-N 3.1Å; P473-N521 WeakPolarHBondContact CA-O 3.48Å; I474-N521 HydrophobicContact CD1-CB 4.15Å; I474-N521 WeakPolarHBondContact CD1-ND2 3.22Å
522	G	92.8	Very high	94.9	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.9	-148.3	-164.8	0	0	0	0	0	112.3	W336 I337 Y520	W336-G522 WeakPolarHBondContact CA-O 3.5Å; I337-G522 PolarHBondContact N-O 3.07Å; Y520-G522 PolarHBondContact O-N 2.02Å
523	F	94.3	Very high	94.9	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.009	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	134.9	170	-81.3	-118.9	0	0	0	110	I337 P339 D346 I348 T439 V440 P441 V525	I337-F523 HydrophobicContact CD1-CE2 4.24Å; I337-F523 HydrophobicContact CG2-CE1 4.45Å; I337-F523 CarbonylContact O-C 3.52Å; I337-F523 WeakPolarHBondContact O-CA 3.27Å; P339-F523 HydrophobicContact CG-CD1 3.89Å; P339-F523 HydrophobicContact CG-CE1 4.16Å; D346-F523 WeakPolarHBondContact O-CD1 3.49Å; D346-F523 VanDerWaalsContact O-CE1 3.29Å; D346-F523 WeakPolarHBondContact O-CE1 3.34Å; I348-F523 HydrophobicContact CG2-CE1 4.16Å; I348-F523 HydrophobicContact CG2-CZ 4.5Å; T439-F523 HydrophobicContact CG2-CE2 4.04Å; T439-F523 HydrophobicContact CG2-CZ 4.07Å; V440-F523 VanDerWaalsContact C-CZ 3.49Å; V440-F523 WeakPolarHBondContact O-CE2 3.38Å; P441-F523 HydrophobicContact CB-CD1 3.94Å; P441-F523 HydrophobicContact CB-CE1 4.13Å; P441-F523 HydrophobicContact CB-CG 4.18Å; F523-V525 VanDerWaalsContact C-N 3.28Å; F523-V525 HydrophobicContact CB-CB 4.46Å; F523-V525 HydrophobicContact CB-CG1 4Å; F523-V525 HydrophobicContact CB-CG2 3.79Å; F523-V525 HydrophobicContact CD1-CG1 4.23Å; F523-V525 PolarHBondContact O-N 2.92Å; F523-V525 VanDerWaalsContact O-N 3.09Å
524	N	93.7	Very high	94.8	Very high	57 Å²	57	41.4 Å²	41.4	31%	0.305	20%	0.198	S	C	.	.			trans	-83.1	76.4	168	179.1	29.8	0	0	0	109.4	W336 I337	W336-N524 HydrophobicContact CB-CB 3.91Å; W336-N524 HydrophobicContact CG-CB 3.94Å; I337-N524 PolarHBondContact O-N 2.83Å
525	V	92.7	Very high	94.7	Very high	13 Å²	13	40.1 Å²	40.1	8%	0.079	20%	0.196	C	C	.	.	S	Bend	trans	-125.4	179.4	-179.9	-69.1	0	0	0	0	109.9	P339 D346 P442 Q519 F523 P527	P339-V525 HydrophobicContact CG-CG1 4.01Å; D346-V525 HydrophobicContact CB-CB 4.37Å; D346-V525 HydrophobicContact CB-CG1 3.91Å; D346-V525 WeakPolarHBondContact OD1-CB 3.49Å; D346-V525 WeakPolarHBondContact OD1-CG1 3.16Å; P442-V525 HydrophobicContact CG-CG2 4.47Å; Q519-V525 PolarHBondContact NE2-O 2.91Å; F523-V525 VanDerWaalsContact C-N 3.28Å; F523-V525 HydrophobicContact CB-CB 4.46Å; F523-V525 HydrophobicContact CB-CG1 4Å; F523-V525 HydrophobicContact CB-CG2 3.79Å; F523-V525 HydrophobicContact CD1-CG1 4.23Å; F523-V525 PolarHBondContact O-N 2.92Å; F523-V525 VanDerWaalsContact O-N 3.09Å; V525-P527 WeakPolarHBondContact O-CD 3.1Å
526	K	92.3	Very high	94.6	Very high	155 Å²	155	40.2 Å²	40.2	67%	0.674	20%	0.197	S	C	*	.	S	Bend	trans	-60.4	123	172.8	-176.8	178	178.6	179.2	0	109.8	R528	K526-R528 PolarHBondContact O-NH1 2.81Å; K526-R528 VanDerWaalsContact O-NH1 3.09Å
527	P	94.8	Very high	94.5	Very high	36 Å²	36	39.9 Å²	39.9	23%	0.234	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-51.5	141.6	179.8	-29.3	36.2	0	0	0	112.7	Q519 V525	Q519-P527 HydrophobicContact CG-CG 3.95Å; V525-P527 WeakPolarHBondContact O-CD 3.1Å
528	R	95.2	Very high	94.3	Very high	72 Å²	72	41.4 Å²	41.4	27%	0.272	20%	0.201	S	C	.	.	P	Polyproline II helix	trans	-90.8	134.4	165.9	-47.3	-47.6	-164.2	-148	12.3	107.4	D346 P442 L444 Q516 T517 K526	D346-R528 IonicContact OD2-CZ 3.4Å; D346-R528 IonicContact OD2-NH1 3.87Å; D346-R528 PolarHBondContact OD2-NH1 2.83Å; D346-R528 IonicContact OD2-NH2 2.7Å; D346-R528 PolarHBondContact OD2-NH2 3.49Å; P442-R528 VanDerWaalsContact O-CG 3.31Å; P442-R528 WeakPolarHBondContact O-CG 3.32Å; P442-R528 PolarHBondContact O-NE 2.95Å; L444-R528 HydrophobicContact CB-CB 3.78Å; L444-R528 VanDerWaalsContact CD2-O 3.3Å; L444-R528 WeakPolarHBondContact CD2-O 3.41Å; Q516-R528 CarbonylContact C-O 3.6Å; Q516-R528 VanDerWaalsContact CA-O 3.22Å; Q516-R528 WeakPolarHBondContact CA-O 3.05Å; T517-R528 HydrophobicContact CG2-CB 3.96Å; T517-R528 HydrophobicContact CG2-CG 4.32Å; T517-R528 PolarHBondContact N-O 2.79Å; T517-R528 PolarHBondContact OG1-N 3.17Å; K526-R528 PolarHBondContact O-NH1 2.81Å; K526-R528 VanDerWaalsContact O-NH1 3.09Å
529	E	96.1	Very high	94.3	Very high	98 Å²	98	44 Å²	44	46%	0.458	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	145.6	-174.9	-62.1	175.9	-136.7	0	0	110.2	R514 C515 Q516	R514-E529 WeakPolarHBondContact CD-OE2 3.43Å; R514-E529 IonicContact CZ-OE2 3.13Å; R514-E529 IonicContact NE-OE2 2.89Å; R514-E529 IonicContact NH1-OE2 2.7Å; R514-E529 PolarHBondContact NH1-OE2 2.93Å; C515-E529 WeakPolarHBondContact O-CA 3.4Å; Q516-E529 HydrophobicContact CB-CG 3.92Å
530	A	96	Very high	94.2	Very high	20 Å²	20	40 Å²	40	17%	0.165	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	166.4	165.5	0	0	0	0	0	110.5	L444 V446 R514 C515	L444-A530 HydrophobicContact CD2-CB 4.47Å; L444-A530 HydrophobicContact CG-CB 4.5Å; V446-A530 HydrophobicContact CG2-CB 3.83Å; R514-A530 WeakPolarHBondContact CA-O 3.34Å; C515-A530 PolarHBondContact N-O 3.25Å; C515-A530 PolarHBondContact O-N 2.94Å
531	V	96.1	Very high	94.3	Very high	62 Å²	62	41 Å²	41	38%	0.376	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	132.9	-175.8	179.2	0	0	0	0	110.5	Y513	Y513-V531 CarbonylContact O-C 3.54Å; Y513-V531 VanDerWaalsContact O-CA 3.3Å; Y513-V531 WeakPolarHBondContact O-CA 3.3Å
532	V	96.6	Very high	94.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	129.4	173.3	-178.7	0	0	0	0	108.5	V446 L463 W477 Y513	V446-V532 HydrophobicContact CG1-CG2 3.92Å; V446-V532 HydrophobicContact CG2-CG2 3.82Å; L463-V532 HydrophobicContact CB-CG1 4.17Å; L463-V532 HydrophobicContact CD1-CG1 4.36Å; L463-V532 HydrophobicContact CD2-CG1 4.05Å; L463-V532 HydrophobicContact CG-CG1 4.42Å; W477-V532 HydrophobicContact CH2-CB 4.38Å; W477-V532 HydrophobicContact CH2-CG2 3.95Å; W477-V532 HydrophobicContact CZ3-CB 4.32Å; W477-V532 HydrophobicContact CZ3-CG2 4.26Å; Y513-V532 PolarHBondContact N-O 2.73Å; Y513-V532 PolarHBondContact O-N 2.92Å
533	E	96.4	Very high	94.5	Very high	89 Å²	89	45.3 Å²	45.3	42%	0.416	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	133.2	176.6	-66.2	-176.8	163.9	0	0	110.6	S451 P452 L453	S451-E533 PolarHBondContact OG-N 2.69Å; S451-E533 VanDerWaalsContact OG-N 3.09Å; P452-E533 CarbonylContact C-O 3.58Å; P452-E533 WeakPolarHBondContact CA-O 3.12Å; P452-E533 HydrophobicContact CB-CB 3.91Å; L453-E533 PolarHBondContact N-O 3.08Å
534	L	95.6	Very high	94.6	Very high	1 Å²	1	47 Å²	47	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	116.6	172.5	177.2	57.9	0	0	0	109.9	L453 V461 L463 I502 V505 T510 G511 Y513 V536	L453-L534 HydrophobicContact CD2-CD1 4.47Å; V461-L534 HydrophobicContact CG1-CD1 4.48Å; V461-L534 HydrophobicContact CG2-CD1 4.26Å; V461-L534 HydrophobicContact CG2-CD2 4.23Å; L463-L534 HydrophobicContact CD2-CB 4.39Å; L463-L534 HydrophobicContact CD2-CD1 4.38Å; I502-L534 HydrophobicContact CD1-CD2 4.06Å; V505-L534 HydrophobicContact CG1-CD2 4.2Å; T510-L534 CarbonylContact C-O 3.55Å; T510-L534 VanDerWaalsContact CA-O 3.26Å; T510-L534 WeakPolarHBondContact CA-O 3.28Å; T510-L534 PolarHBondContact OG1-O 2.75Å; G511-L534 PolarHBondContact N-O 2.9Å; G511-L534 PolarHBondContact O-N 2.98Å; Y513-L534 HydrophobicContact CD2-CB 4.16Å; Y513-L534 HydrophobicContact CE2-CB 3.93Å; Y513-L534 HydrophobicContact CE2-CD2 3.97Å; L534-V536 HydrophobicContact CG-CG2 4.23Å
535	I	94.6	Very high	94.5	Very high	47 Å²	47	49.1 Å²	49.1	24%	0.241	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	110.5	179.2	-59	-176.2	0	0	0	108.9	P452 L453 V454 A455	P452-I535 HydrophobicContact CB-CD1 3.6Å; P452-I535 HydrophobicContact CB-CG1 4.04Å; P452-I535 HydrophobicContact CG-CD1 4.07Å; L453-I535 PolarHBondContact O-N 3.22Å; V454-I535 WeakPolarHBondContact CA-O 3.47Å; V454-I535 HydrophobicContact CG2-CB 4.29Å; A455-I535 PolarHBondContact N-O 2.97Å
536	V	94.6	Very high	94.6	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.012	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	120	178.5	-169.6	0	0	0	0	109.3	A455 E457 V505 T510 L534 H567	A455-V536 CarbonylContact O-C 3.55Å; A455-V536 WeakPolarHBondContact O-CA 3.5Å; E457-V536 HydrophobicContact CB-CG1 4.14Å; V505-V536 HydrophobicContact CG1-CB 4.48Å; V505-V536 HydrophobicContact CG1-CG1 4.14Å; V505-V536 HydrophobicContact CG1-CG2 3.47Å; V505-V536 VanDerWaalsContact CG1-CG2 3.47Å; T510-V536 PolarHBondContact OG1-N 2.82Å; L534-V536 HydrophobicContact CG-CG2 4.23Å; V536-H567 PolarHBondContact O-ND1 3.4Å
537	Q	94.1	Very high	94.7	Very high	22 Å²	22	49.4 Å²	49.4	10%	0.103	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	144.1	172.4	-56.4	-166	-24.7	0	0	110.4	V454 A455 R456 E457 H567 P568 E617 A618	V454-Q537 HydrophobicContact CG1-CG 3.63Å; A455-Q537 PolarHBondContact O-N 2.81Å; R456-Q537 CarbonylContact C-O 3.56Å; R456-Q537 WeakPolarHBondContact CA-O 3.41Å; E457-Q537 PolarHBondContact N-O 2.56Å; Q537-H567 CarbonylContact C-O 3.57Å; Q537-H567 VanDerWaalsContact CA-O 3.23Å; Q537-H567 WeakPolarHBondContact CA-O 3.28Å; Q537-H567 WeakPolarHBondContact CB-O 3.43Å; Q537-P568 HydrophobicContact CG-CG 4.32Å; Q537-P568 VanDerWaalsContact NE2-CG 3.32Å; Q537-E617 PolarHBondContact NE2-OE2 2.64Å; Q537-A618 HydrophobicContact CB-CB 3.93Å
538	Y	92.7	Very high	94.6	Very high	37 Å²	37	51.1 Å²	51.1	15%	0.145	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	147	175.3	57	-95.4	0	0	0	110.8	R507 R565 H567 N616	R507-Y538 HydrophobicContact CB-CD1 3.99Å; R507-Y538 HydrophobicContact CB-CE1 4.07Å; Y538-R565 HydrophobicContact CE2-CB 4Å; Y538-H567 HydrophobicContact CD1-CB 3.78Å; Y538-H567 HydrophobicContact CE1-CB 3.38Å; Y538-H567 HydrophobicContact CE2-CB 4.3Å; Y538-H567 HydrophobicContact CG-CB 4.39Å; Y538-H567 PolarHBondContact N-O 2.75Å; Y538-H567 PolarHBondContact O-N 2.87Å; Y538-N616 PolarHBondContact O-ND2 2.79Å
539	P	93	Very high	94.5	Very high	55 Å²	55	49.4 Å²	49.4	36%	0.357	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	158.3	-177.1	27.3	-35.8	0	0	0	112	T541	P539-T541 PolarHBondContact O-N 2.74Å
540	P	92.9	Very high	94.4	Very high	6 Å²	6	46.6 Å²	46.6	4%	0.039	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	124.3	179.8	-25	37.6	0	0	0	112.1	V542 V563 A566 L572 V614 N616 G619 G621	P540-V542 HydrophobicContact CB-CG1 4.23Å; P540-V563 HydrophobicContact CB-CG1 4.27Å; P540-A566 HydrophobicContact CB-CB 4.04Å; P540-A566 HydrophobicContact CG-CB 4.05Å; P540-L572 HydrophobicContact CG-CD2 4.07Å; P540-V614 HydrophobicContact CB-CB 4.25Å; P540-V614 HydrophobicContact CB-CG1 3.89Å; P540-V614 HydrophobicContact CG-CG1 3.99Å; P540-V614 WeakPolarHBondContact CG-O 3.23Å; P540-N616 HydrophobicContact CG-CB 4.22Å; P540-G619 WeakPolarHBondContact CD-O 3.37Å; P540-G621 WeakPolarHBondContact O-CA 3.37Å
541	T	94.2	Very high	94.2	Very high	59 Å²	59	47.5 Å²	47.5	36%	0.362	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	124.5	167.5	-50.5	0	0	0	0	107.9	P539 L564 R565	P539-T541 PolarHBondContact O-N 2.74Å; T541-L564 PolarHBondContact O-N 3.26Å; T541-R565 PolarHBondContact N-O 2.91Å; T541-R565 PolarHBondContact O-N 2.89Å
542	V	94.8	Very high	93.9	Very high	11 Å²	11	44.5 Å²	44.5	7%	0.067	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	156.8	-168.4	-62.5	0	0	0	0	113.4	P540 R562 V563 V614	P540-V542 HydrophobicContact CB-CG1 4.23Å; V542-R562 CarbonylContact C-O 3.6Å; V542-R562 WeakPolarHBondContact CA-O 3.43Å; V542-R562 WeakPolarHBondContact CB-O 3.37Å; V542-V563 HydrophobicContact CG1-CG2 4.42Å; V542-V614 HydrophobicContact CG1-CB 4.05Å; V542-V614 HydrophobicContact CG1-CG2 4.08Å
543	E	94.8	Very high	93.6	Very high	108 Å²	108	47 Å²	47	51%	0.505	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	134.5	178.8	-176.8	171.2	-138.5	0	0	110.7	R562 L564	E543-R562 PolarHBondContact N-O 3.48Å; E543-R562 PolarHBondContact O-N 3.28Å; E543-L564 HydrophobicContact CB-CD1 4.08Å; E543-L564 HydrophobicContact CB-CD2 4.18Å; E543-L564 HydrophobicContact CB-CG 4.11Å
544	P	94.9	Very high	93.2	Very high	37 Å²	37	45.1 Å²	45.1	24%	0.24	25%	0.25	C	C	.	.			cis	-80.6	142.6	-9.4	33.5	-33.4	0	0	0	112.1	T547 C623 F625	P544-T547 HydrophobicContact CB-CG2 4.49Å; P544-T547 HydrophobicContact CG-CG2 3.79Å; P544-C623 VanDerWaalsContact O-CA 3.26Å; P544-C623 WeakPolarHBondContact O-CA 3.45Å; P544-C623 VanDerWaalsContact O-CB 3.27Å; P544-C623 WeakPolarHBondContact O-CB 3.5Å; P544-F625 HydrophobicContact CG-CD1 4.44Å; P544-F625 HydrophobicContact CG-CE1 3.74Å; P544-F625 HydrophobicContact CG-CZ 4.22Å
545	V	92.7	Very high	93	Very high	102 Å²	102	49.2 Å²	49.2	62%	0.618	27%	0.265	S	S	*	.	S	Bend	trans	-63.1	-43.7	174.4	179.5	0	0	0	0	111.3	T624	V545-T624 WeakPolarHBondContact O-CB 3.47Å; V545-T624 PolarHBondContact O-N 2.77Å; V545-T624 PolarHBondContact O-OG1 2.9Å
546	H	94.4	Very high	92.9	Very high	122 Å²	122	50.7 Å²	50.7	57%	0.565	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.1	140.6	170.7	-178.9	81.7	0	0	0	110.4	T624	H546-T624 CarbonylContact C-O 3.6Å; H546-T624 VanDerWaalsContact CA-O 3.27Å; H546-T624 WeakPolarHBondContact CA-O 3.22Å
547	T	93.9	Very high	92.9	Very high	52 Å²	52	51 Å²	51	32%	0.319	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	159	169.2	-164	0	0	0	0	111.2	P544 V549 T624 F625 Q626	P544-T547 HydrophobicContact CB-CG2 4.49Å; P544-T547 HydrophobicContact CG-CG2 3.79Å; T547-V549 HydrophobicContact CG2-CG2 4.21Å; T547-T624 PolarHBondContact N-O 2.92Å; T547-F625 HydrophobicContact CG2-CB 4.48Å; T547-F625 HydrophobicContact CG2-CD1 3.43Å; T547-F625 VanDerWaalsContact CG2-CD1 3.43Å; T547-F625 HydrophobicContact CG2-CE1 4.02Å; T547-F625 HydrophobicContact CG2-CG 4.26Å; T547-F625 CarbonylContact O-C 3.55Å; T547-F625 WeakPolarHBondContact O-CA 3.45Å; T547-Q626 PolarHBondContact O-N 3.13Å
548	E	93.6	Very high	92.9	Very high	71 Å²	71	53.4 Å²	53.4	33%	0.332	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	127.7	177.4	-168.7	-171.1	-179.6	0	0	110.5	R550 Q626 T628	E548-R550 IonicContact OE1-CZ 3.88Å; E548-R550 IonicContact OE1-NE 3.72Å; E548-R550 IonicContact OE1-NH1 3.8Å; E548-R550 PolarHBondContact OE1-NH1 2.93Å; E548-R550 IonicContact OE1-NH2 3.17Å; E548-R550 PolarHBondContact OE1-NH2 2.88Å; E548-R550 IonicContact OE2-CZ 2.91Å; E548-R550 IonicContact OE2-NH1 2.79Å; E548-R550 PolarHBondContact OE2-NH1 2.89Å; E548-R550 IonicContact OE2-NH2 3.5Å; E548-R550 PolarHBondContact OE2-NH2 2.88Å; E548-Q626 HydrophobicContact CG-CB 4.23Å; E548-Q626 HydrophobicContact CG-CG 4.35Å; E548-T628 HydrophobicContact CG-CG2 4.2Å; E548-T628 WeakPolarHBondContact OE1-CG2 3.47Å
549	V	93.3	Very high	93.1	Very high	37 Å²	37	51.7 Å²	51.7	22%	0.224	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	98.6	-175.1	-174.7	0	0	0	0	109.5	T547 V557 L559 Q626 V627 T628	T547-V549 HydrophobicContact CG2-CG2 4.21Å; V549-V557 HydrophobicContact CG1-CG1 3.89Å; V549-L559 HydrophobicContact CB-CD2 4.48Å; V549-L559 HydrophobicContact CG1-CD2 4.5Å; V549-L559 HydrophobicContact CG2-CD2 3.95Å; V549-Q626 PolarHBondContact N-O 3.07Å; V549-V627 HydrophobicContact CB-CG2 4.28Å; V549-V627 WeakPolarHBondContact O-CA 3.44Å; V549-T628 PolarHBondContact O-N 3.17Å
550	R	92.9	Very high	93.2	Very high	39 Å²	39	51.3 Å²	51.3	15%	0.147	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	120.3	174.6	-72.8	177.5	-177.4	69.6	5.3	110.3	E548 T628 K630 Y632 V666 D728	E548-R550 IonicContact OE1-CZ 3.88Å; E548-R550 IonicContact OE1-NE 3.72Å; E548-R550 IonicContact OE1-NH1 3.8Å; E548-R550 PolarHBondContact OE1-NH1 2.93Å; E548-R550 IonicContact OE1-NH2 3.17Å; E548-R550 PolarHBondContact OE1-NH2 2.88Å; E548-R550 IonicContact OE2-CZ 2.91Å; E548-R550 IonicContact OE2-NH1 2.79Å; E548-R550 PolarHBondContact OE2-NH1 2.89Å; E548-R550 IonicContact OE2-NH2 3.5Å; E548-R550 PolarHBondContact OE2-NH2 2.88Å; R550-T628 CarbonylContact C-O 3.57Å; R550-T628 WeakPolarHBondContact CA-O 3.38Å; R550-T628 HydrophobicContact CG-CG2 3.81Å; R550-K630 VanDerWaalsContact CD-O 3.27Å; R550-K630 WeakPolarHBondContact CD-O 3.47Å; R550-K630 WeakPolarHBondContact CG-O 3.33Å; R550-Y632 HydrophobicContact CB-CE2 4.12Å; R550-Y632 HydrophobicContact CG-CE2 4.43Å; R550-V666 HydrophobicContact CB-CG1 3.87Å; R550-D728 IonicContact CZ-OD2 2.71Å; R550-D728 IonicContact NE-OD2 3.24Å; R550-D728 PolarHBondContact NE-OD2 2.78Å; R550-D728 IonicContact NH2-OD2 3.92Å; R550-D728 PolarHBondContact NH2-OD2 2.71Å
551	Q	92.9	Very high	93.3	Very high	38 Å²	38	51 Å²	51	18%	0.178	28%	0.284	C	S	.	.			trans	-148.4	145.3	176	-175.7	64.9	-73.9	0	0	113.3	R555 P556 V557 L602 T628 A665	Q551-R555 HydrophobicContact CG-CB 3.98Å; Q551-P556 PolarHBondContact NE2-O 3.18Å; Q551-V557 HydrophobicContact CB-CG2 3.71Å; Q551-V557 HydrophobicContact CG-CG2 3.61Å; Q551-L602 HydrophobicContact CB-CD2 3.86Å; Q551-L602 HydrophobicContact CG-CD2 3.94Å; Q551-T628 PolarHBondContact N-O 3.33Å; Q551-A665 WeakPolarHBondContact CA-O 3.48Å; Q551-A665 PolarHBondContact OE1-O 2.89Å
552	G	89.6	Confident	93.3	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.286	C	S	.	.			trans	-80.7	163.9	176.4	0	0	0	0	0	114.9	D667	G552-D667 WeakPolarHBondContact CA-OD1 3.45Å
553	L	89.6	Confident	93.2	Very high	53 Å²	53	53.5 Å²	53.5	28%	0.277	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	148.4	-179.8	-74.1	174.5	0	0	0	112.4	R555 L602 R604 W607 D667	L553-R555 PolarHBondContact O-N 2.87Å; L553-R555 VanDerWaalsContact O-N 3.13Å; L553-L602 WeakPolarHBondContact CD2-O 3.33Å; L553-R604 HydrophobicContact CD1-CG 4.39Å; L553-R604 HydrophobicContact CD2-CG 4.24Å; L553-W607 HydrophobicContact CD1-CH2 3.87Å; L553-W607 HydrophobicContact CD1-CZ2 4.34Å; L553-W607 HydrophobicContact CD2-CH2 3.56Å; L553-W607 HydrophobicContact CD2-CZ2 3.5Å; L553-W607 VanDerWaalsContact CD2-CZ2 3.5Å; L553-W607 HydrophobicContact CD2-CZ3 4.33Å; L553-W607 HydrophobicContact CG-CH2 3.64Å; L553-W607 HydrophobicContact CG-CZ2 3.6Å; L553-D667 PolarHBondContact N-OD1 2.86Å
554	G	87.6	Confident	93.1	Very high	49 Å²	49	52.6 Å²	52.6	51%	0.505	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	-11.9	178	0	0	0	0	0	115.1	S601 L602	G554-S601 WeakPolarHBondContact CA-OG 3.37Å; G554-S601 PolarHBondContact O-OG 3.27Å; G554-S601 VanDerWaalsContact O-OG 3.05Å; G554-L602 PolarHBondContact N-O 3.05Å
555	R	91.1	Very high	92.9	Very high	86 Å²	86	58.6 Å²	58.6	33%	0.325	30%	0.303	S	S	.	.	S	Bend	trans	-87	158	-179.2	-61	174.5	-178.6	-178.6	3.7	111.8	Q551 L553 L602 G664 A665 V666	Q551-R555 HydrophobicContact CG-CB 3.98Å; L553-R555 PolarHBondContact O-N 2.87Å; L553-R555 VanDerWaalsContact O-N 3.13Å; R555-L602 WeakPolarHBondContact O-CB 3.42Å; R555-L602 PolarHBondContact O-N 2.81Å; R555-G664 PolarHBondContact NH1-O 2.86Å; R555-G664 PolarHBondContact NH2-O 2.88Å; R555-A665 PolarHBondContact NH1-O 2.82Å; R555-A665 VanDerWaalsContact NH1-O 3.1Å; R555-V666 PolarHBondContact NH1-O 2.86Å; R555-V666 PolarHBondContact NH2-O 2.89Å
556	P	93.6	Very high	92.7	Very high	79 Å²	79	54.3 Å²	54.3	51%	0.513	28%	0.278	S	S	.	.			trans	-77	155.4	173.7	31.4	-34.9	0	0	0	112.9	Q551 I599	Q551-P556 PolarHBondContact NE2-O 3.18Å; P556-I599 CarbonylContact C-O 3.57Å; P556-I599 WeakPolarHBondContact CA-O 3.44Å
557	V	94.1	Very high	92.5	Very high	8 Å²	8	51.6 Å²	51.6	5%	0.048	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	137.2	166.4	179.2	0	0	0	0	107.9	V549 Q551 L559 T598 I599 L602	V549-V557 HydrophobicContact CG1-CG1 3.89Å; Q551-V557 HydrophobicContact CB-CG2 3.71Å; Q551-V557 HydrophobicContact CG-CG2 3.61Å; V557-L559 HydrophobicContact CG1-CD2 3.61Å; V557-L559 HydrophobicContact CG1-CG 4.07Å; V557-T598 CarbonylContact O-C 3.55Å; V557-T598 WeakPolarHBondContact O-CA 3.45Å; V557-I599 HydrophobicContact CB-CB 4.19Å; V557-I599 HydrophobicContact CB-CD1 4.16Å; V557-I599 PolarHBondContact N-O 2.93Å; V557-I599 PolarHBondContact O-N 2.73Å; V557-L602 HydrophobicContact CG2-CD2 4.2Å
558	V	95.1	Very high	92.2	Very high	72 Å²	72	50.6 Å²	50.6	44%	0.436	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131.2	166.8	-175.8	0	0	0	0	107.3	E596 T598	V558-E596 HydrophobicContact CG1-CB 4.35Å; V558-E596 HydrophobicContact CG1-CG 4.47Å; V558-T598 HydrophobicContact CG2-CG2 4.1Å
559	L	96	Very high	91.7	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	117.1	173.9	-54.6	179.1	0	0	0	107.9	V549 V557 W576 E596 Y597 Y610 F625 V627	V549-L559 HydrophobicContact CB-CD2 4.48Å; V549-L559 HydrophobicContact CG1-CD2 4.5Å; V549-L559 HydrophobicContact CG2-CD2 3.95Å; V557-L559 HydrophobicContact CG1-CD2 3.61Å; V557-L559 HydrophobicContact CG1-CG 4.07Å; L559-W576 HydrophobicContact CB-CH2 3.6Å; L559-W576 HydrophobicContact CB-CZ3 3.66Å; L559-W576 HydrophobicContact CD1-CZ3 4.08Å; L559-W576 WeakPolarHBondContact O-CH2 3.39Å; L559-W576 WeakPolarHBondContact O-CZ2 3.48Å; L559-E596 CarbonylContact O-C 3.52Å; L559-E596 VanDerWaalsContact O-CA 3.27Å; L559-E596 WeakPolarHBondContact O-CA 3.33Å; L559-Y597 PolarHBondContact N-O 2.92Å; L559-Y597 PolarHBondContact O-N 2.64Å; L559-Y610 HydrophobicContact CD1-CD1 3.78Å; L559-Y610 HydrophobicContact CD1-CD2 4.22Å; L559-Y610 HydrophobicContact CD1-CG 3.59Å; L559-F625 HydrophobicContact CB-CD1 4.21Å; L559-F625 HydrophobicContact CB-CD2 4.42Å; L559-F625 HydrophobicContact CB-CE1 4.33Å; L559-F625 HydrophobicContact CB-CG 4.28Å; L559-F625 HydrophobicContact CD1-CB 4.11Å; L559-F625 HydrophobicContact CD1-CD2 4.45Å; L559-F625 HydrophobicContact CD1-CG 4.27Å; L559-F625 HydrophobicContact CD2-CB 3.94Å; L559-F625 HydrophobicContact CD2-CD1 3.97Å; L559-F625 HydrophobicContact CD2-CG 4.06Å; L559-F625 HydrophobicContact CG-CG 4.44Å; L559-V627 HydrophobicContact CD1-CG2 4.09Å; L559-V627 HydrophobicContact CD2-CG2 3.99Å
560	T	95.7	Very high	90.7	Very high	47 Å²	47	59.6 Å²	59.6	29%	0.288	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	123.5	-176.8	-47.1	0	0	0	0	109.1	E594 E596 F625	T560-E594 HydrophobicContact CG2-CB 4.23Å; T560-E596 HydrophobicContact CG2-CG 3.93Å; T560-E596 PolarHBondContact OG1-OE1 2.95Å; T560-F625 WeakPolarHBondContact O-CE1 3.49Å; T560-F625 VanDerWaalsContact O-CZ 3.28Å; T560-F625 WeakPolarHBondContact O-CZ 3.46Å
561	C	95	Very high	89.8	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	119.8	175.9	179.1	0	0	0	0	109.2	W576 E594 T595 C612 C623 F625	C561-W576 HydrophobicContact CB-CH2 4.07Å; C561-W576 HydrophobicContact CB-CZ2 4Å; C561-E594 WeakPolarHBondContact O-CA 3.41Å; C561-T595 HydrophobicContact CB-CG2 4.16Å; C561-T595 PolarHBondContact N-O 2.93Å; C561-T595 PolarHBondContact O-N 3.17Å; C561-C612 HydrophobicContact CB-CB 3.71Å; C561-C612 VanDerWaalsContact SG-SG 3.69Å; C561-C623 VanDerWaalsContact CA-SG 3.59Å; C561-C623 HydrophobicContact CB-CB 3.7Å; C561-C623 WeakPolarHBondContact CB-SG 3.29Å; C561-C623 WeakPolarHBondContact SG-CB 3.47Å; C561-C623 CovalentContact SG-SG 2.04Å; C561-C623 PolarHBondContact SG-SG 2.91Å; C561-F625 HydrophobicContact CB-CE2 4.3Å; C561-F625 HydrophobicContact CB-CZ 4.03Å
562	R	93.8	Very high	89.6	Confident	109 Å²	109	61.4 Å²	61.4	41%	0.411	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	145.4	-175.2	-173	173.8	-172.8	168.7	12.6	111.7	V542 E543 D593 E594	V542-R562 CarbonylContact C-O 3.6Å; V542-R562 WeakPolarHBondContact CA-O 3.43Å; V542-R562 WeakPolarHBondContact CB-O 3.37Å; E543-R562 PolarHBondContact N-O 3.48Å; E543-R562 PolarHBondContact O-N 3.28Å; R562-D593 CarbonylContact C-O 3.51Å; R562-D593 IonicContact CZ-OD2 3.17Å; R562-D593 IonicContact NE-OD2 2.76Å; R562-D593 PolarHBondContact NE-OD2 2.9Å; R562-D593 IonicContact NH2-OD1 3.86Å; R562-D593 IonicContact NH2-OD2 2.72Å; R562-D593 PolarHBondContact NH2-OD2 3.19Å; R562-E594 HydrophobicContact CB-CB 4.14Å; R562-E594 HydrophobicContact CG-CB 4.2Å
563	V	93	Very high	89.7	Confident	13 Å²	13	69.4 Å²	69.4	8%	0.079	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	117.3	175	-172.2	0	0	0	0	109.5	P540 V542 A566 L572 F588 D593 V614	P540-V563 HydrophobicContact CB-CG1 4.27Å; V542-V563 HydrophobicContact CG1-CG2 4.42Å; V563-A566 HydrophobicContact CG1-CB 4.15Å; V563-L572 HydrophobicContact CB-CD1 4.31Å; V563-L572 HydrophobicContact CG1-CD1 3.83Å; V563-L572 HydrophobicContact CG2-CD1 3.96Å; V563-F588 HydrophobicContact CG2-CE1 3.96Å; V563-F588 HydrophobicContact CG2-CE2 4.3Å; V563-F588 HydrophobicContact CG2-CZ 3.7Å; V563-D593 PolarHBondContact N-O 3.06Å; V563-V614 HydrophobicContact CG2-CB 4.46Å; V563-V614 HydrophobicContact CG2-CG1 3.75Å; V563-V614 HydrophobicContact CG2-CG2 4.28Å
564	L	91.8	Very high	89.9	Confident	89 Å²	89	67.8 Å²	67.8	47%	0.466	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-41.3	178.2	-59.2	-176.3	0	0	0	112.2	T541 E543	T541-L564 PolarHBondContact O-N 3.26Å; E543-L564 HydrophobicContact CB-CD1 4.08Å; E543-L564 HydrophobicContact CB-CD2 4.18Å; E543-L564 HydrophobicContact CB-CG 4.11Å
565	R	90.2	Very high	90.3	Very high	162 Å²	162	69 Å²	69	61%	0.611	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-154.7	139.2	-179.2	-60.2	-175.3	-179.5	169.2	0	109.9	Y538 T541	Y538-R565 HydrophobicContact CE2-CB 4Å; T541-R565 PolarHBondContact N-O 2.91Å; T541-R565 PolarHBondContact O-N 2.89Å
566	A	89.7	Confident	90.6	Very high	12 Å²	12	65 Å²	65	10%	0.099	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	147.2	169.1	0	0	0	0	0	110	P540 V563 L572	P540-A566 HydrophobicContact CB-CB 4.04Å; P540-A566 HydrophobicContact CG-CB 4.05Å; V563-A566 HydrophobicContact CG1-CB 4.15Å; A566-L572 HydrophobicContact CB-CD1 4.16Å; A566-L572 HydrophobicContact CB-CD2 3.97Å
567	H	89.7	Confident	90.7	Very high	65 Å²	65	62.4 Å²	62.4	30%	0.301	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	121	168.4	-162.5	-105	0	0	0	112	V536 Q537 Y538 N616	V536-H567 PolarHBondContact O-ND1 3.4Å; Q537-H567 CarbonylContact C-O 3.57Å; Q537-H567 VanDerWaalsContact CA-O 3.23Å; Q537-H567 WeakPolarHBondContact CA-O 3.28Å; Q537-H567 WeakPolarHBondContact CB-O 3.43Å; Y538-H567 HydrophobicContact CD1-CB 3.78Å; Y538-H567 HydrophobicContact CE1-CB 3.38Å; Y538-H567 HydrophobicContact CE2-CB 4.3Å; Y538-H567 HydrophobicContact CG-CB 4.39Å; Y538-H567 PolarHBondContact N-O 2.75Å; Y538-H567 PolarHBondContact O-N 2.87Å; H567-N616 PolarHBondContact O-ND2 3.44Å
568	P	88.4	Confident	90.7	Very high	31 Å²	31	63.4 Å²	63.4	20%	0.201	30%	0.3	C	S	.	.	S	Bend	cis	-65.5	154.3	-2.1	-18.4	33.4	0	0	0	112.6	Q537 N616	Q537-P568 HydrophobicContact CG-CG 4.32Å; Q537-P568 VanDerWaalsContact NE2-CG 3.32Å; P568-N616 PolarHBondContact O-ND2 3.04Å; P568-N616 VanDerWaalsContact O-ND2 3.1Å
569	S	82	Confident	90.2	Very high	74 Å²	74	63.4 Å²	63.4	52%	0.517	30%	0.304	S	S	.	.			trans	-107.9	-12.5	177.2	54.9	0	0	0	0	114	V571	S569-V571 PolarHBondContact O-N 3.09Å
570	R	72.9	Confident	89.7	Confident	224 Å²	224	71 Å²	71	85%	0.845	34%	0.344	S	S	*	.	S	Bend	trans	-67.8	-25.4	-165	-75.2	-176	171.5	172.2	-1.7	115.8
571	V	73.7	Confident	89.6	Confident	101 Å²	101	77.2 Å²	77.2	61%	0.612	36%	0.362	S	S	*	.	S	Bend	trans	-145.6	93.9	170.5	-174.5	0	0	0	0	108.3	S569	S569-V571 PolarHBondContact O-N 3.09Å
572	L	88.4	Confident	89.6	Confident	13 Å²	13	81.8 Å²	81.8	7%	0.068	39%	0.386	C	S	.	.			trans	-87.3	139	169	-61.9	-178.5	0	0	0	109.4	P540 V563 A566 A587 F588 V614 N616	P540-L572 HydrophobicContact CG-CD2 4.07Å; V563-L572 HydrophobicContact CB-CD1 4.31Å; V563-L572 HydrophobicContact CG1-CD1 3.83Å; V563-L572 HydrophobicContact CG2-CD1 3.96Å; A566-L572 HydrophobicContact CB-CD1 4.16Å; A566-L572 HydrophobicContact CB-CD2 3.97Å; L572-A587 VanDerWaalsContact O-CA 3.3Å; L572-A587 WeakPolarHBondContact O-CA 3.33Å; L572-F588 HydrophobicContact CB-CB 4.27Å; L572-F588 HydrophobicContact CB-CD2 3.46Å; L572-F588 VanDerWaalsContact CB-CD2 3.46Å; L572-F588 HydrophobicContact CB-CE2 4.07Å; L572-F588 HydrophobicContact CB-CG 4.13Å; L572-F588 PolarHBondContact O-N 3.49Å; L572-V614 HydrophobicContact CB-CG1 4.26Å; L572-V614 HydrophobicContact CD1-CG1 4.24Å; L572-N616 HydrophobicContact CD2-CB 3.66Å
573	R	92.4	Very high	89.6	Confident	168 Å²	168	79 Å²	79	63%	0.634	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	152.9	169.6	-64	-177.8	-173.4	169.2	4.1	109.8	G586 V614 I615	R573-G586 WeakPolarHBondContact CA-O 3.44Å; R573-V614 CarbonylContact O-C 3.54Å; R573-V614 WeakPolarHBondContact O-CA 3.24Å; R573-I615 PolarHBondContact N-O 2.86Å; R573-I615 PolarHBondContact O-N 3.07Å
574	F	94.3	Very high	89.6	Confident	19 Å²	19	82.6 Å²	82.6	8%	0.083	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	145.5	170.1	63.1	-96.2	0	0	0	111.9	W576 H584 A585 G586 F588 T595 N613 V614	F574-W576 AromaticContact CD2-CD1 3.63Å; F574-W576 AromaticContact CD2-NE1 3.88Å; F574-W576 AromaticContact CE2-CD1 3.89Å; F574-H584 AromaticContact CE2-CD2 3.76Å; F574-H584 AromaticContact CE2-NE2 3.78Å; F574-A585 CarbonylContact O-C 3.59Å; F574-A585 VanDerWaalsContact O-CA 3.28Å; F574-A585 WeakPolarHBondContact O-CA 3.21Å; F574-G586 PolarHBondContact N-O 3.23Å; F574-G586 PolarHBondContact O-N 3.04Å; F574-F588 HydrophobicContact CB-CE2 3.84Å; F574-F588 HydrophobicContact CB-CZ 4.39Å; F574-F588 AromaticContact CD1-CD2 3.8Å; F574-F588 HydrophobicContact CD1-CD2 3.8Å; F574-F588 AromaticContact CD1-CE2 3.66Å; F574-F588 HydrophobicContact CD1-CE2 3.66Å; F574-F588 HydrophobicContact CD1-CG 4.45Å; F574-F588 HydrophobicContact CD1-CZ 4.19Å; F574-F588 HydrophobicContact CG-CE2 4.2Å; F574-T595 HydrophobicContact CB-CG2 4.08Å; F574-T595 HydrophobicContact CD1-CG2 4.23Å; F574-T595 HydrophobicContact CD2-CG2 4.24Å; F574-T595 WeakPolarHBondContact CD2-OG1 3.46Å; F574-T595 WeakPolarHBondContact CE2-OG1 3.28Å; F574-T595 HydrophobicContact CG-CG2 3.93Å; F574-T595 VanDerWaalsContact CZ-OG1 3.27Å; F574-T595 WeakPolarHBondContact CZ-OG1 3.38Å; F574-N613 CarbonylContact C-O 3.52Å; F574-N613 VanDerWaalsContact CA-O 3.27Å; F574-N613 WeakPolarHBondContact CA-O 3.22Å; F574-V614 HydrophobicContact CB-CG2 4.41Å
575	E	95.8	Very high	89.7	Confident	76 Å²	76	80.7 Å²	80.7	36%	0.355	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	118.8	173.7	-65.2	-179.8	173.2	0	0	109.1	L577 L582 A585 C612 N613	E575-L577 HydrophobicContact CB-CD1 4.09Å; E575-L582 HydrophobicContact CB-CD1 3.94Å; E575-L582 HydrophobicContact CG-CD1 4.3Å; E575-A585 HydrophobicContact CG-CB 4.18Å; E575-C612 WeakPolarHBondContact O-CA 3.32Å; E575-N613 PolarHBondContact N-O 3.16Å; E575-N613 PolarHBondContact O-N 2.76Å
576	W	96.8	Very high	89.8	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	122.4	171.4	-76	99.4	0	0	0	109.5	L559 C561 F574 L583 H584 T595 Y597 T611 C612 F625	L559-W576 HydrophobicContact CB-CH2 3.6Å; L559-W576 HydrophobicContact CB-CZ3 3.66Å; L559-W576 HydrophobicContact CD1-CZ3 4.08Å; L559-W576 WeakPolarHBondContact O-CH2 3.39Å; L559-W576 WeakPolarHBondContact O-CZ2 3.48Å; C561-W576 HydrophobicContact CB-CH2 4.07Å; C561-W576 HydrophobicContact CB-CZ2 4Å; F574-W576 AromaticContact CD2-CD1 3.63Å; F574-W576 AromaticContact CD2-NE1 3.88Å; F574-W576 AromaticContact CE2-CD1 3.89Å; W576-L583 WeakPolarHBondContact O-CB 3.34Å; W576-L583 PolarHBondContact O-N 3.26Å; W576-H584 HydrophobicContact CB-CB 4.38Å; W576-H584 PolarHBondContact N-O 2.82Å; W576-H584 PolarHBondContact O-N 3.32Å; W576-T595 HydrophobicContact CZ2-CG2 4.15Å; W576-T595 PolarHBondContact NE1-OG1 3.4Å; W576-Y597 HydrophobicContact CB-CD2 4.21Å; W576-Y597 HydrophobicContact CD2-CG 4.27Å; W576-Y597 HydrophobicContact CE3-CG 4.4Å; W576-Y597 HydrophobicContact CG-CD2 4.23Å; W576-Y597 HydrophobicContact CG-CG 4.34Å; W576-T611 CarbonylContact C-O 3.45Å; W576-T611 WeakPolarHBondContact CA-O 3.28Å; W576-C612 HydrophobicContact CD2-CB 3.76Å; W576-C612 HydrophobicContact CE3-CB 3.72Å; W576-C612 HydrophobicContact CH2-CB 3.76Å; W576-C612 HydrophobicContact CZ2-CB 3.79Å; W576-C612 HydrophobicContact CZ3-CB 3.73Å; W576-F625 HydrophobicContact CH2-CD2 4.21Å; W576-F625 AromaticContact CH2-CE2 3.51Å; W576-F625 HydrophobicContact CH2-CE2 3.51Å; W576-F625 AromaticContact CH2-CZ 3.89Å; W576-F625 HydrophobicContact CH2-CZ 3.89Å; W576-F625 AromaticContact CZ3-CD2 3.78Å; W576-F625 HydrophobicContact CZ3-CD2 3.78Å; W576-F625 AromaticContact CZ3-CE2 3.5Å; W576-F625 HydrophobicContact CZ3-CE2 3.5Å; W576-F625 VanDerWaalsContact CZ3-CE2 3.5Å; W576-F625 HydrophobicContact CZ3-CZ 4.3Å
577	L	95.5	Very high	89.8	Confident	25 Å²	25	76.6 Å²	76.6	13%	0.131	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	154.5	176.5	-50.1	90.6	0	0	0	110.9	E575 R581 L582 Y610 T611 N613	E575-L577 HydrophobicContact CB-CD1 4.09Å; L577-R581 CarbonylContact C-O 3.52Å; L577-R581 WeakPolarHBondContact CA-O 2.96Å; L577-L582 HydrophobicContact CG-CD1 4.23Å; L577-Y610 CarbonylContact O-C 3.58Å; L577-Y610 VanDerWaalsContact O-CA 3.31Å; L577-Y610 WeakPolarHBondContact O-CA 3.45Å; L577-T611 WeakPolarHBondContact CD1-OG1 3.45Å; L577-T611 PolarHBondContact N-O 2.96Å; L577-T611 PolarHBondContact O-N 3Å; L577-N613 WeakPolarHBondContact CD1-ND2 3.24Å
578	L	93.6	Very high	89.5	Confident	30 Å²	30	74.7 Å²	74.7	16%	0.157	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	116	162	165.6	60	0	0	0	107.8	N580 R581 L583 E605 Y610	L578-N580 PolarHBondContact O-N 2.88Å; L578-R581 PolarHBondContact N-O 3.26Å; L578-R581 PolarHBondContact O-N 3.07Å; L578-L583 HydrophobicContact CB-CD1 3.85Å; L578-L583 HydrophobicContact CB-CD2 4.15Å; L578-L583 HydrophobicContact CB-CG 4.2Å; L578-E605 WeakPolarHBondContact CD2-O 3.45Å; L578-Y610 HydrophobicContact CB-CD1 4.3Å; L578-Y610 HydrophobicContact CB-CE1 4.11Å; L578-Y610 HydrophobicContact CD1-CD2 3.95Å; L578-Y610 HydrophobicContact CD1-CE2 3.73Å; L578-Y610 HydrophobicContact CD1-CG 4.45Å; L578-Y610 HydrophobicContact CD2-CE2 4.47Å
579	S	85.9	Confident	89	Confident	72 Å²	72	78.2 Å²	78.2	50%	0.503	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	-102	-164	-54.9	0	0	0	0	110.5	E609	S579-E609 PolarHBondContact N-O 2.92Å
580	N	85.6	Confident	88.3	Confident	161 Å²	161	83 Å²	83	86%	0.861	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.6	2.3	177.9	-64.4	-14.2	0	0	0	113.6	L578	L578-N580 PolarHBondContact O-N 2.88Å
581	R	92.1	Very high	88.2	Confident	177 Å²	177	80.3 Å²	80.3	67%	0.668	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.7	116.6	-177.9	179.4	-178.9	177.8	-178.9	1	110.2	L577 L578 L583	L577-R581 CarbonylContact C-O 3.52Å; L577-R581 WeakPolarHBondContact CA-O 2.96Å; L578-R581 PolarHBondContact N-O 3.26Å; L578-R581 PolarHBondContact O-N 3.07Å; R581-L583 PolarHBondContact O-N 3.07Å
582	L	95	Very high	88.5	Confident	97 Å²	97	82.1 Å²	82.1	51%	0.508	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	130.2	170	-172.8	68.2	0	0	0	110.6	E575 L577 A585	E575-L582 HydrophobicContact CB-CD1 3.94Å; E575-L582 HydrophobicContact CG-CD1 4.3Å; L577-L582 HydrophobicContact CG-CD1 4.23Å; L582-A585 HydrophobicContact CD1-CB 4.38Å
583	L	94.2	Very high	88.3	Confident	51 Å²	51	84.6 Å²	84.6	27%	0.267	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	-45.4	-179.8	-59.1	173.8	0	0	0	111.9	W576 L578 R581 Y597 Y610	W576-L583 WeakPolarHBondContact O-CB 3.34Å; W576-L583 PolarHBondContact O-N 3.26Å; L578-L583 HydrophobicContact CB-CD1 3.85Å; L578-L583 HydrophobicContact CB-CD2 4.15Å; L578-L583 HydrophobicContact CB-CG 4.2Å; R581-L583 PolarHBondContact O-N 3.07Å; L583-Y597 HydrophobicContact CB-CE2 3.82Å; L583-Y597 HydrophobicContact CD1-CD1 4.42Å; L583-Y597 HydrophobicContact CD1-CE1 3.82Å; L583-Y597 HydrophobicContact CD1-CE2 4.25Å; L583-Y610 HydrophobicContact CD1-CD1 3.67Å; L583-Y610 HydrophobicContact CD1-CE1 3.49Å; L583-Y610 VanDerWaalsContact CD1-CE1 3.49Å
584	H	93.6	Very high	88.3	Confident	87 Å²	87	80.8 Å²	80.8	40%	0.403	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	141.9	-177.5	-179.6	45.6	0	0	0	109.2	F574 W576 Y597	F574-H584 AromaticContact CE2-CD2 3.76Å; F574-H584 AromaticContact CE2-NE2 3.78Å; W576-H584 HydrophobicContact CB-CB 4.38Å; W576-H584 PolarHBondContact N-O 2.82Å; W576-H584 PolarHBondContact O-N 3.32Å; H584-Y597 HydrophobicContact CB-CD2 4.16Å; H584-Y597 HydrophobicContact CB-CE2 4.08Å
585	A	93.7	Very high	88.2	Confident	49 Å²	49	80.3 Å²	80.3	41%	0.405	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	151.4	173.8	0	0	0	0	0	109.6	F574 E575 L582	F574-A585 CarbonylContact O-C 3.59Å; F574-A585 VanDerWaalsContact O-CA 3.28Å; F574-A585 WeakPolarHBondContact O-CA 3.21Å; E575-A585 HydrophobicContact CG-CB 4.18Å; L582-A585 HydrophobicContact CD1-CB 4.38Å
586	G	91.8	Very high	88.2	Confident	29 Å²	29	81.5 Å²	81.5	30%	0.299	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.7	-170.6	-178.8	0	0	0	0	0	113.3	R573 F574	R573-G586 WeakPolarHBondContact CA-O 3.44Å; F574-G586 PolarHBondContact N-O 3.23Å; F574-G586 PolarHBondContact O-N 3.04Å
587	A	90	Very high	88.1	Confident	59 Å²	59	84.1 Å²	84.1	49%	0.488	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	151.2	171.4	0	0	0	0	0	109.5	L572	L572-A587 VanDerWaalsContact O-CA 3.3Å; L572-A587 WeakPolarHBondContact O-CA 3.33Å
588	F	84.5	Confident	88	Confident	25 Å²	25	86.2 Å²	86.2	11%	0.11	45%	0.446	C	S	.	.			trans	-74.1	139.6	171.2	-68.4	-101.9	0	0	0	109.7	V563 L572 F574 K592 T595 V614	V563-F588 HydrophobicContact CG2-CE1 3.96Å; V563-F588 HydrophobicContact CG2-CE2 4.3Å; V563-F588 HydrophobicContact CG2-CZ 3.7Å; L572-F588 HydrophobicContact CB-CB 4.27Å; L572-F588 HydrophobicContact CB-CD2 3.46Å; L572-F588 VanDerWaalsContact CB-CD2 3.46Å; L572-F588 HydrophobicContact CB-CE2 4.07Å; L572-F588 HydrophobicContact CB-CG 4.13Å; L572-F588 PolarHBondContact O-N 3.49Å; F574-F588 HydrophobicContact CB-CE2 3.84Å; F574-F588 HydrophobicContact CB-CZ 4.39Å; F574-F588 AromaticContact CD1-CD2 3.8Å; F574-F588 HydrophobicContact CD1-CD2 3.8Å; F574-F588 AromaticContact CD1-CE2 3.66Å; F574-F588 HydrophobicContact CD1-CE2 3.66Å; F574-F588 HydrophobicContact CD1-CG 4.45Å; F574-F588 HydrophobicContact CD1-CZ 4.19Å; F574-F588 HydrophobicContact CG-CE2 4.2Å; F588-K592 WeakPolarHBondContact CD1-O 3.38Å; F588-T595 HydrophobicContact CE1-CG2 4.22Å; F588-T595 HydrophobicContact CZ-CG2 3.74Å; F588-V614 HydrophobicContact CD2-CG1 4.49Å; F588-V614 HydrophobicContact CE2-CB 4.39Å; F588-V614 HydrophobicContact CE2-CG1 3.58Å; F588-V614 HydrophobicContact CE2-CG2 4Å; F588-V614 HydrophobicContact CZ-CG1 4.06Å; F588-V614 HydrophobicContact CZ-CG2 3.88Å
589	D	77.6	Confident	88.1	Confident	105 Å²	105	85.7 Å²	85.7	56%	0.561	44%	0.443	S	S	*	.			trans	-81.2	158.8	169.1	-175.4	22.6	0	0	0	110	H591 K592	D589-H591 PolarHBondContact O-N 3.18Å; D589-K592 PolarHBondContact O-N 3.16Å
590	Q	67.5	Low	88.4	Confident	174 Å²	174	92.9 Å²	92.9	81%	0.813	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-12.2	-173.5	-60.2	-172.9	14	0	0	114.2
591	H	70.6	Confident	88.7	Confident	169 Å²	169	88.8 Å²	88.8	78%	0.782	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.9	10.4	179.8	-57.4	-51.2	0	0	0	114.1	D589	D589-H591 PolarHBondContact O-N 3.18Å
592	K	78.9	Confident	88.7	Confident	138 Å²	138	80.5 Å²	80.5	60%	0.6	41%	0.412	S	S	*	.			trans	-124.6	126.6	177.6	-67.7	-166.7	175	-165.2	0	111.8	F588 D589	F588-K592 WeakPolarHBondContact CD1-O 3.38Å; D589-K592 PolarHBondContact O-N 3.16Å
593	D	85.8	Confident	88.4	Confident	65 Å²	65	80 Å²	80	35%	0.348	41%	0.41	S	S	.	.	S	Bend	trans	-103.3	-2.7	171.1	61.8	-31.5	0	0	0	112.9	R562 V563	R562-D593 CarbonylContact C-O 3.51Å; R562-D593 IonicContact CZ-OD2 3.17Å; R562-D593 IonicContact NE-OD2 2.76Å; R562-D593 PolarHBondContact NE-OD2 2.9Å; R562-D593 IonicContact NH2-OD1 3.86Å; R562-D593 IonicContact NH2-OD2 2.72Å; R562-D593 PolarHBondContact NH2-OD2 3.19Å; V563-D593 PolarHBondContact N-O 3.06Å
594	E	91.3	Very high	88.1	Confident	88 Å²	88	86.4 Å²	86.4	41%	0.411	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	151.4	177.6	67.7	-169.4	-178.6	0	0	113.7	T560 C561 R562	T560-E594 HydrophobicContact CG2-CB 4.23Å; C561-E594 WeakPolarHBondContact O-CA 3.41Å; R562-E594 HydrophobicContact CB-CB 4.14Å; R562-E594 HydrophobicContact CG-CB 4.2Å
595	T	93.2	Very high	87.8	Confident	10 Å²	10	89.3 Å²	89.3	6%	0.061	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	146.2	173.7	-179.1	0	0	0	0	109.6	C561 F574 W576 F588 C612	C561-T595 HydrophobicContact CB-CG2 4.16Å; C561-T595 PolarHBondContact N-O 2.93Å; C561-T595 PolarHBondContact O-N 3.17Å; F574-T595 HydrophobicContact CB-CG2 4.08Å; F574-T595 HydrophobicContact CD1-CG2 4.23Å; F574-T595 HydrophobicContact CD2-CG2 4.24Å; F574-T595 WeakPolarHBondContact CD2-OG1 3.46Å; F574-T595 WeakPolarHBondContact CE2-OG1 3.28Å; F574-T595 HydrophobicContact CG-CG2 3.93Å; F574-T595 VanDerWaalsContact CZ-OG1 3.27Å; F574-T595 WeakPolarHBondContact CZ-OG1 3.38Å; W576-T595 HydrophobicContact CZ2-CG2 4.15Å; W576-T595 PolarHBondContact NE1-OG1 3.4Å; F588-T595 HydrophobicContact CE1-CG2 4.22Å; F588-T595 HydrophobicContact CZ-CG2 3.74Å; T595-C612 VanDerWaalsContact CG2-SG 3.55Å
596	E	94.1	Very high	87.5	Confident	100 Å²	100	87.2 Å²	87.2	47%	0.467	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	141	-175.4	-62.1	-159.7	127.3	0	0	112.4	V558 L559 T560	V558-E596 HydrophobicContact CG1-CB 4.35Å; V558-E596 HydrophobicContact CG1-CG 4.47Å; L559-E596 CarbonylContact O-C 3.52Å; L559-E596 VanDerWaalsContact O-CA 3.27Å; L559-E596 WeakPolarHBondContact O-CA 3.33Å; T560-E596 HydrophobicContact CG2-CG 3.93Å; T560-E596 PolarHBondContact OG1-OE1 2.95Å
597	Y	95	Very high	87.5	Confident	56 Å²	56	88 Å²	88	22%	0.22	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	114.9	168.5	-170.6	-96.8	0	0	0	111.2	L559 W576 L583 H584 I599 Y610	L559-Y597 PolarHBondContact N-O 2.92Å; L559-Y597 PolarHBondContact O-N 2.64Å; W576-Y597 HydrophobicContact CB-CD2 4.21Å; W576-Y597 HydrophobicContact CD2-CG 4.27Å; W576-Y597 HydrophobicContact CE3-CG 4.4Å; W576-Y597 HydrophobicContact CG-CD2 4.23Å; W576-Y597 HydrophobicContact CG-CG 4.34Å; L583-Y597 HydrophobicContact CB-CE2 3.82Å; L583-Y597 HydrophobicContact CD1-CD1 4.42Å; L583-Y597 HydrophobicContact CD1-CE1 3.82Å; L583-Y597 HydrophobicContact CD1-CE2 4.25Å; H584-Y597 HydrophobicContact CB-CD2 4.16Å; H584-Y597 HydrophobicContact CB-CE2 4.08Å; Y597-I599 HydrophobicContact CD1-CG1 4.01Å; Y597-I599 HydrophobicContact CE1-CD1 4.47Å; Y597-I599 HydrophobicContact CE1-CG1 3.69Å; Y597-Y610 HydrophobicContact CD1-CD1 4.35Å; Y597-Y610 HydrophobicContact CD1-CE1 4.21Å; Y597-Y610 HydrophobicContact CE1-CD1 4.46Å; Y597-Y610 AromaticContact CE1-CE1 3.92Å; Y597-Y610 HydrophobicContact CE1-CE1 3.92Å
598	T	94.8	Very high	87.6	Confident	69 Å²	69	86 Å²	86	42%	0.423	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	104.3	-173.6	-61.3	0	0	0	0	111.8	V557 V558 R600	V557-T598 CarbonylContact O-C 3.55Å; V557-T598 WeakPolarHBondContact O-CA 3.45Å; V558-T598 HydrophobicContact CG2-CG2 4.1Å; T598-R600 HydrophobicContact CG2-CG 4.5Å; T598-R600 PolarHBondContact O-N 2.84Å
599	I	94.7	Very high	88.1	Confident	19 Å²	19	88 Å²	88	10%	0.097	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	107.4	168.6	-57.3	163.9	0	0	0	106.9	P556 V557 Y597 S601 L602 Y610	P556-I599 CarbonylContact C-O 3.57Å; P556-I599 WeakPolarHBondContact CA-O 3.44Å; V557-I599 HydrophobicContact CB-CB 4.19Å; V557-I599 HydrophobicContact CB-CD1 4.16Å; V557-I599 PolarHBondContact N-O 2.93Å; V557-I599 PolarHBondContact O-N 2.73Å; Y597-I599 HydrophobicContact CD1-CG1 4.01Å; Y597-I599 HydrophobicContact CE1-CD1 4.47Å; Y597-I599 HydrophobicContact CE1-CG1 3.69Å; I599-S601 VanDerWaalsContact C-N 3.34Å; I599-S601 PolarHBondContact O-N 2.75Å; I599-L602 HydrophobicContact CD1-CD1 4.3Å; I599-L602 HydrophobicContact CG2-CB 4.42Å; I599-L602 HydrophobicContact CG2-CD1 4.1Å; I599-Y610 HydrophobicContact CD1-CE1 3.88Å; I599-Y610 HydrophobicContact CD1-CE2 4.14Å; I599-Y610 WeakPolarHBondContact CD1-OH 3.31Å
600	R	91.6	Very high	89	Confident	222 Å²	222	83.5 Å²	83.5	84%	0.838	39%	0.39	S	S	*	.	S	Bend	trans	-70.6	-28	-175.6	-64.9	-176.3	-178.7	-179.1	0	114	T598	T598-R600 HydrophobicContact CG2-CG 4.5Å; T598-R600 PolarHBondContact O-N 2.84Å
601	S	92.2	Very high	90.4	Very high	75 Å²	75	75.5 Å²	75.5	52%	0.524	35%	0.354	S	S	.	.	S	Bend	trans	-155.6	112.1	-179.9	-171.1	0	0	0	0	108.3	G554 I599 N603	G554-S601 WeakPolarHBondContact CA-OG 3.37Å; G554-S601 PolarHBondContact O-OG 3.27Å; G554-S601 VanDerWaalsContact O-OG 3.05Å; I599-S601 VanDerWaalsContact C-N 3.34Å; I599-S601 PolarHBondContact O-N 2.75Å; S601-N603 PolarHBondContact O-N 2.85Å
602	L	91.8	Very high	91.6	Very high	4 Å²	4	67.5 Å²	67.5	2%	0.021	32%	0.316	C	S	.	.			trans	-73.3	123.7	-173.6	-171.3	62.2	0	0	0	111.3	Q551 L553 G554 R555 V557 I599 G606 V627	Q551-L602 HydrophobicContact CB-CD2 3.86Å; Q551-L602 HydrophobicContact CG-CD2 3.94Å; L553-L602 WeakPolarHBondContact CD2-O 3.33Å; G554-L602 PolarHBondContact N-O 3.05Å; R555-L602 WeakPolarHBondContact O-CB 3.42Å; R555-L602 PolarHBondContact O-N 2.81Å; V557-L602 HydrophobicContact CG2-CD2 4.2Å; I599-L602 HydrophobicContact CD1-CD1 4.3Å; I599-L602 HydrophobicContact CG2-CB 4.42Å; I599-L602 HydrophobicContact CG2-CD1 4.1Å; L602-G606 VanDerWaalsContact CD1-O 3.3Å; L602-G606 WeakPolarHBondContact CD1-O 3.29Å; L602-V627 HydrophobicContact CD1-CG1 4.26Å; L602-V627 HydrophobicContact CD2-CG1 4.46Å
603	N	90.8	Very high	92.4	Very high	87 Å²	87	62.8 Å²	62.8	47%	0.465	30%	0.298	S	S	.	.			trans	-107.7	176.3	174.1	77	2.9	0	0	0	110.9	S601 E605 G606	S601-N603 PolarHBondContact O-N 2.85Å; N603-E605 PolarHBondContact O-N 2.94Å; N603-E605 PolarHBondContact OD1-N 2.95Å; N603-E605 VanDerWaalsContact OD1-N 3.1Å; N603-G606 PolarHBondContact O-N 2.83Å; N603-G606 VanDerWaalsContact O-N 3.12Å; N603-G606 PolarHBondContact OD1-N 3.04Å
604	R	86.3	Confident	92.9	Very high	184 Å²	184	59.7 Å²	59.7	69%	0.694	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-64.7	-24	-178.8	-70.4	-174.1	165.9	-174.3	-7.3	114.5	L553 W607	L553-R604 HydrophobicContact CD1-CG 4.39Å; L553-R604 HydrophobicContact CD2-CG 4.24Å; R604-W607 HydrophobicContact CB-CE3 4.38Å; R604-W607 HydrophobicContact CB-CZ3 4.12Å; R604-W607 HydrophobicContact CG-CH2 4.3Å; R604-W607 HydrophobicContact CG-CZ3 3.81Å
605	E	86.9	Confident	93	Very high	149 Å²	149	58.1 Å²	58.1	70%	0.696	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-85	-14.1	177.5	-63.7	178.7	179.8	0	0	112.2	L578 N603 W607	L578-E605 WeakPolarHBondContact CD2-O 3.45Å; N603-E605 PolarHBondContact O-N 2.94Å; N603-E605 PolarHBondContact OD1-N 2.95Å; N603-E605 VanDerWaalsContact OD1-N 3.1Å; E605-W607 VanDerWaalsContact C-N 3.31Å; E605-W607 PolarHBondContact O-N 2.87Å
606	G	88.4	Confident	92.9	Very high	4 Å²	4	58.5 Å²	58.5	4%	0.041	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-87.8	13.8	177.3	0	0	0	0	0	114.7	L602 N603 Y610	L602-G606 VanDerWaalsContact CD1-O 3.3Å; L602-G606 WeakPolarHBondContact CD1-O 3.29Å; N603-G606 PolarHBondContact O-N 2.83Å; N603-G606 VanDerWaalsContact O-N 3.12Å; N603-G606 PolarHBondContact OD1-N 3.04Å; G606-Y610 VanDerWaalsContact CA-OH 3.31Å; G606-Y610 WeakPolarHBondContact CA-OH 3.32Å; G606-Y610 WeakPolarHBondContact O-CE2 3.36Å; G606-Y610 PolarHBondContact O-OH 2.77Å
607	W	91.6	Very high	92.6	Very high	47 Å²	47	60 Å²	60	18%	0.178	28%	0.284	C	S	.	.			trans	-98.4	134.6	167.8	-65.9	-46.7	0	0	0	109.8	L553 R604 E605 V627 F724	L553-W607 HydrophobicContact CD1-CH2 3.87Å; L553-W607 HydrophobicContact CD1-CZ2 4.34Å; L553-W607 HydrophobicContact CD2-CH2 3.56Å; L553-W607 HydrophobicContact CD2-CZ2 3.5Å; L553-W607 VanDerWaalsContact CD2-CZ2 3.5Å; L553-W607 HydrophobicContact CD2-CZ3 4.33Å; L553-W607 HydrophobicContact CG-CH2 3.64Å; L553-W607 HydrophobicContact CG-CZ2 3.6Å; R604-W607 HydrophobicContact CB-CE3 4.38Å; R604-W607 HydrophobicContact CB-CZ3 4.12Å; R604-W607 HydrophobicContact CG-CH2 4.3Å; R604-W607 HydrophobicContact CG-CZ3 3.81Å; E605-W607 VanDerWaalsContact C-N 3.31Å; E605-W607 PolarHBondContact O-N 2.87Å; W607-V627 CarbonylContact C-O 3.55Å; W607-V627 WeakPolarHBondContact CA-O 3.49Å; W607-F724 HydrophobicContact CB-CE2 4.47Å; W607-F724 AromaticContact CD2-CD2 3.71Å; W607-F724 HydrophobicContact CD2-CD2 3.71Å; W607-F724 AromaticContact CD2-CE2 3.7Å; W607-F724 HydrophobicContact CD2-CE2 3.7Å; W607-F724 AromaticContact CE2-CD2 3.74Å; W607-F724 AromaticContact CE3-CD2 3.63Å; W607-F724 HydrophobicContact CE3-CD2 3.63Å; W607-F724 AromaticContact CE3-CE2 3.72Å; W607-F724 HydrophobicContact CE3-CE2 3.72Å; W607-F724 HydrophobicContact CG-CD2 4.46Å; W607-F724 HydrophobicContact CG-CE2 4.06Å; W607-F724 HydrophobicContact CH2-CB 4.27Å; W607-F724 AromaticContact CH2-CD2 3.62Å; W607-F724 HydrophobicContact CH2-CD2 3.62Å; W607-F724 HydrophobicContact CH2-CG 4.43Å; W607-F724 AromaticContact CZ2-CD2 3.71Å; W607-F724 HydrophobicContact CZ2-CD2 3.71Å; W607-F724 AromaticContact CZ3-CD2 3.58Å; W607-F724 HydrophobicContact CZ3-CD2 3.58Å; W607-F724 HydrophobicContact CZ3-CE2 4.13Å
608	G	91.9	Very high	92.3	Very high	15 Å²	15	58.1 Å²	58.1	16%	0.155	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	150.6	-172.7	-177.4	0	0	0	0	0	113.2	Y610 V627	G608-Y610 PolarHBondContact O-N 2.89Å; G608-V627 PolarHBondContact N-O 2.93Å; G608-V627 PolarHBondContact O-N 3.34Å
609	E	95.3	Very high	92.1	Very high	69 Å²	69	56.1 Å²	56.1	32%	0.322	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	113.2	174.1	-172.7	179.9	118.4	0	0	109.6	S579 T611 K622 T624	S579-E609 PolarHBondContact N-O 2.92Å; E609-T611 HydrophobicContact CG-CG2 3.88Å; E609-T611 WeakPolarHBondContact OE1-CG2 3.44Å; E609-K622 IonicContact OE1-NZ 3.22Å; E609-K622 PolarHBondContact OE1-NZ 2.62Å; E609-T624 VanDerWaalsContact CD-CG2 3.42Å; E609-T624 HydrophobicContact CG-CG2 3.53Å
610	Y	96.8	Very high	92	Very high	9 Å²	9	58 Å²	58	4%	0.035	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	138.6	165.3	-74.3	-104.3	0	0	0	109.4	L559 L577 L578 L583 Y597 I599 G606 G608 F625 V627	L559-Y610 HydrophobicContact CD1-CD1 3.78Å; L559-Y610 HydrophobicContact CD1-CD2 4.22Å; L559-Y610 HydrophobicContact CD1-CG 3.59Å; L577-Y610 CarbonylContact O-C 3.58Å; L577-Y610 VanDerWaalsContact O-CA 3.31Å; L577-Y610 WeakPolarHBondContact O-CA 3.45Å; L578-Y610 HydrophobicContact CB-CD1 4.3Å; L578-Y610 HydrophobicContact CB-CE1 4.11Å; L578-Y610 HydrophobicContact CD1-CD2 3.95Å; L578-Y610 HydrophobicContact CD1-CE2 3.73Å; L578-Y610 HydrophobicContact CD1-CG 4.45Å; L578-Y610 HydrophobicContact CD2-CE2 4.47Å; L583-Y610 HydrophobicContact CD1-CD1 3.67Å; L583-Y610 HydrophobicContact CD1-CE1 3.49Å; L583-Y610 VanDerWaalsContact CD1-CE1 3.49Å; Y597-Y610 HydrophobicContact CD1-CD1 4.35Å; Y597-Y610 HydrophobicContact CD1-CE1 4.21Å; Y597-Y610 HydrophobicContact CE1-CD1 4.46Å; Y597-Y610 AromaticContact CE1-CE1 3.92Å; Y597-Y610 HydrophobicContact CE1-CE1 3.92Å; I599-Y610 HydrophobicContact CD1-CE1 3.88Å; I599-Y610 HydrophobicContact CD1-CE2 4.14Å; I599-Y610 WeakPolarHBondContact CD1-OH 3.31Å; G606-Y610 VanDerWaalsContact CA-OH 3.31Å; G606-Y610 WeakPolarHBondContact CA-OH 3.32Å; G606-Y610 WeakPolarHBondContact O-CE2 3.36Å; G606-Y610 PolarHBondContact O-OH 2.77Å; G608-Y610 PolarHBondContact O-N 2.89Å; Y610-F625 PolarHBondContact N-O 3.05Å; Y610-F625 PolarHBondContact O-N 2.81Å; Y610-V627 HydrophobicContact CD2-CB 3.81Å; Y610-V627 HydrophobicContact CD2-CG2 3.4Å; Y610-V627 VanDerWaalsContact CD2-CG2 3.4Å; Y610-V627 HydrophobicContact CE2-CB 3.82Å; Y610-V627 HydrophobicContact CE2-CG1 4.4Å; Y610-V627 HydrophobicContact CE2-CG2 3.77Å; Y610-V627 HydrophobicContact CG-CG2 4.22Å
611	T	96.9	Very high	92.1	Very high	7 Å²	7	47.8 Å²	47.8	4%	0.043	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	131.6	-178.7	70.2	0	0	0	0	110.2	W576 L577 E609 C623	W576-T611 CarbonylContact C-O 3.45Å; W576-T611 WeakPolarHBondContact CA-O 3.28Å; L577-T611 WeakPolarHBondContact CD1-OG1 3.45Å; L577-T611 PolarHBondContact N-O 2.96Å; L577-T611 PolarHBondContact O-N 3Å; E609-T611 HydrophobicContact CG-CG2 3.88Å; E609-T611 WeakPolarHBondContact OE1-CG2 3.44Å; T611-C623 WeakPolarHBondContact CA-O 3.38Å
612	C	96.4	Very high	92.3	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	107.7	167	-179	0	0	0	0	108.9	C561 E575 W576 T595 C623 F625	C561-C612 HydrophobicContact CB-CB 3.71Å; C561-C612 VanDerWaalsContact SG-SG 3.69Å; E575-C612 WeakPolarHBondContact O-CA 3.32Å; W576-C612 HydrophobicContact CD2-CB 3.76Å; W576-C612 HydrophobicContact CE3-CB 3.72Å; W576-C612 HydrophobicContact CH2-CB 3.76Å; W576-C612 HydrophobicContact CZ2-CB 3.79Å; W576-C612 HydrophobicContact CZ3-CB 3.73Å; T595-C612 VanDerWaalsContact CG2-SG 3.55Å; C612-C623 HydrophobicContact CB-CB 4.2Å; C612-C623 PolarHBondContact N-O 2.97Å; C612-C623 PolarHBondContact O-N 2.88Å; C612-F625 HydrophobicContact CB-CE2 4.39Å
613	N	95.4	Very high	92.5	Very high	40 Å²	40	48.1 Å²	48.1	21%	0.214	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	112	173.1	-63.7	-28.8	0	0	0	108.3	F574 E575 L577 I615 G621	F574-N613 CarbonylContact C-O 3.52Å; F574-N613 VanDerWaalsContact CA-O 3.27Å; F574-N613 WeakPolarHBondContact CA-O 3.22Å; E575-N613 PolarHBondContact N-O 3.16Å; E575-N613 PolarHBondContact O-N 2.76Å; L577-N613 WeakPolarHBondContact CD1-ND2 3.24Å; N613-I615 HydrophobicContact CB-CD1 4.39Å; N613-I615 HydrophobicContact CB-CG1 4.31Å; N613-G621 CarbonylContact C-O 3.59Å; N613-G621 WeakPolarHBondContact CA-O 3.14Å
614	V	94.9	Very high	92.8	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	123.1	171.8	-178.8	0	0	0	0	109.1	P540 V542 V563 L572 R573 F574 F588 A620 G621	P540-V614 HydrophobicContact CB-CB 4.25Å; P540-V614 HydrophobicContact CB-CG1 3.89Å; P540-V614 HydrophobicContact CG-CG1 3.99Å; P540-V614 WeakPolarHBondContact CG-O 3.23Å; V542-V614 HydrophobicContact CG1-CB 4.05Å; V542-V614 HydrophobicContact CG1-CG2 4.08Å; V563-V614 HydrophobicContact CG2-CB 4.46Å; V563-V614 HydrophobicContact CG2-CG1 3.75Å; V563-V614 HydrophobicContact CG2-CG2 4.28Å; L572-V614 HydrophobicContact CB-CG1 4.26Å; L572-V614 HydrophobicContact CD1-CG1 4.24Å; R573-V614 CarbonylContact O-C 3.54Å; R573-V614 WeakPolarHBondContact O-CA 3.24Å; F574-V614 HydrophobicContact CB-CG2 4.41Å; F588-V614 HydrophobicContact CD2-CG1 4.49Å; F588-V614 HydrophobicContact CE2-CB 4.39Å; F588-V614 HydrophobicContact CE2-CG1 3.58Å; F588-V614 HydrophobicContact CE2-CG2 4Å; F588-V614 HydrophobicContact CZ-CG1 4.06Å; F588-V614 HydrophobicContact CZ-CG2 3.88Å; V614-A620 CarbonylContact O-C 3.58Å; V614-A620 VanDerWaalsContact O-CA 3.25Å; V614-A620 WeakPolarHBondContact O-CA 3.49Å; V614-G621 PolarHBondContact N-O 3.02Å; V614-G621 PolarHBondContact O-N 3.31Å
615	I	93.3	Very high	93.3	Very high	55 Å²	55	36.1 Å²	36.1	28%	0.282	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	134.8	-162.4	-47.9	178.7	0	0	0	111	R573 N613 A620	R573-I615 PolarHBondContact N-O 2.86Å; R573-I615 PolarHBondContact O-N 3.07Å; N613-I615 HydrophobicContact CB-CD1 4.39Å; N613-I615 HydrophobicContact CB-CG1 4.31Å; I615-A620 HydrophobicContact CG1-CB 4.02Å
616	N	91.6	Very high	93.7	Very high	18 Å²	18	32.3 Å²	32.3	10%	0.096	18%	0.179	C	C	.	.			trans	-131.3	-174.2	165.4	79.6	-1.7	0	0	0	111.2	Y538 P540 H567 P568 L572 A618 G619	Y538-N616 PolarHBondContact O-ND2 2.79Å; P540-N616 HydrophobicContact CG-CB 4.22Å; H567-N616 PolarHBondContact O-ND2 3.44Å; P568-N616 PolarHBondContact O-ND2 3.04Å; P568-N616 VanDerWaalsContact O-ND2 3.1Å; L572-N616 HydrophobicContact CD2-CB 3.66Å; N616-A618 PolarHBondContact O-N 2.87Å; N616-A618 WeakPolarHBondContact OD1-CB 3.44Å; N616-A618 PolarHBondContact OD1-N 3.29Å; N616-G619 PolarHBondContact N-O 2.89Å; N616-G619 PolarHBondContact O-N 2.68Å; N616-G619 PolarHBondContact OD1-N 3.39Å; N616-G619 VanDerWaalsContact OD1-N 3.16Å; N616-G619 PolarHBondContact OD1-O 2.67Å
617	E	89.3	Confident	94	Very high	132 Å²	132	32.1 Å²	32.1	62%	0.617	18%	0.177	S	C	*	.	S	Bend	trans	-64.3	-20.9	-178.4	-62.1	178.5	165.1	0	0	114.6	R456 Q537	R456-E617 PolarHBondContact NH2-O 3.04Å; Q537-E617 PolarHBondContact NE2-OE2 2.64Å
618	A	88.3	Confident	94	Very high	16 Å²	16	30.3 Å²	30.3	13%	0.132	17%	0.171	C	C	.	.	S	Bend	trans	-88	-29	177.1	0	0	0	0	0	113.1	R456 Q537 N616	R456-A618 HydrophobicContact CG-CB 4.49Å; Q537-A618 HydrophobicContact CB-CB 3.93Å; N616-A618 PolarHBondContact O-N 2.87Å; N616-A618 WeakPolarHBondContact OD1-CB 3.44Å; N616-A618 PolarHBondContact OD1-N 3.29Å
619	G	90.4	Very high	94	Very high	27 Å²	27	29.7 Å²	29.7	28%	0.278	16%	0.164	S	C	.	.			trans	158.7	-156.9	178.4	0	0	0	0	0	113.3	P540 N616	P540-G619 WeakPolarHBondContact CD-O 3.37Å; N616-G619 PolarHBondContact N-O 2.89Å; N616-G619 PolarHBondContact O-N 2.68Å; N616-G619 PolarHBondContact OD1-N 3.39Å; N616-G619 VanDerWaalsContact OD1-N 3.16Å; N616-G619 PolarHBondContact OD1-O 2.67Å
620	A	91.8	Very high	93.9	Very high	58 Å²	58	29.8 Å²	29.8	48%	0.479	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	138.3	-176.7	0	0	0	0	0	112.6	V614 I615	V614-A620 CarbonylContact O-C 3.58Å; V614-A620 VanDerWaalsContact O-CA 3.25Å; V614-A620 WeakPolarHBondContact O-CA 3.49Å; I615-A620 HydrophobicContact CG1-CB 4.02Å
621	G	94.4	Very high	93.6	Very high	8 Å²	8	29.4 Å²	29.4	8%	0.082	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	137.8	160	0	0	0	0	0	110	P540 N613 V614	P540-G621 WeakPolarHBondContact O-CA 3.37Å; N613-G621 CarbonylContact C-O 3.59Å; N613-G621 WeakPolarHBondContact CA-O 3.14Å; V614-G621 PolarHBondContact N-O 3.02Å; V614-G621 PolarHBondContact O-N 3.31Å
622	K	95.8	Very high	93.4	Very high	85 Å²	85	31.7 Å²	31.7	37%	0.37	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	116.6	-179.4	-176.7	-173	179.1	-166.5	0	110.7	E609 T624	E609-K622 IonicContact OE1-NZ 3.22Å; E609-K622 PolarHBondContact OE1-NZ 2.62Å; K622-T624 WeakPolarHBondContact CE-OG1 3.43Å
623	C	96.8	Very high	93.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	138.1	157.5	-60.8	0	0	0	0	109.3	P544 C561 T611 C612 F625	P544-C623 VanDerWaalsContact O-CA 3.26Å; P544-C623 WeakPolarHBondContact O-CA 3.45Å; P544-C623 VanDerWaalsContact O-CB 3.27Å; P544-C623 WeakPolarHBondContact O-CB 3.5Å; C561-C623 VanDerWaalsContact CA-SG 3.59Å; C561-C623 HydrophobicContact CB-CB 3.7Å; C561-C623 WeakPolarHBondContact CB-SG 3.29Å; C561-C623 WeakPolarHBondContact SG-CB 3.47Å; C561-C623 CovalentContact SG-SG 2.04Å; C561-C623 PolarHBondContact SG-SG 2.91Å; T611-C623 WeakPolarHBondContact CA-O 3.38Å; C612-C623 HydrophobicContact CB-CB 4.2Å; C612-C623 PolarHBondContact N-O 2.97Å; C612-C623 PolarHBondContact O-N 2.88Å; C623-F625 HydrophobicContact CB-CD2 4.41Å; C623-F625 HydrophobicContact CB-CE2 3.44Å; C623-F625 VanDerWaalsContact CB-CE2 3.44Å; C623-F625 HydrophobicContact CB-CZ 3.69Å
624	T	96.8	Very high	93	Very high	13 Å²	13	31.6 Å²	31.6	8%	0.08	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	124.4	-178.5	-45.9	0	0	0	0	110.4	V545 H546 T547 E609 K622	V545-T624 WeakPolarHBondContact O-CB 3.47Å; V545-T624 PolarHBondContact O-N 2.77Å; V545-T624 PolarHBondContact O-OG1 2.9Å; H546-T624 CarbonylContact C-O 3.6Å; H546-T624 VanDerWaalsContact CA-O 3.27Å; H546-T624 WeakPolarHBondContact CA-O 3.22Å; T547-T624 PolarHBondContact N-O 2.92Å; E609-T624 VanDerWaalsContact CD-CG2 3.42Å; E609-T624 HydrophobicContact CG-CG2 3.53Å; K622-T624 WeakPolarHBondContact CE-OG1 3.43Å
625	F	96.5	Very high	92.5	Very high	6 Å²	6	33.3 Å²	33.3	3%	0.026	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	109.1	-177.1	-49.2	-99.8	0	0	0	109.7	P544 T547 L559 T560 C561 W576 Y610 C612 C623 V627	P544-F625 HydrophobicContact CG-CD1 4.44Å; P544-F625 HydrophobicContact CG-CE1 3.74Å; P544-F625 HydrophobicContact CG-CZ 4.22Å; T547-F625 HydrophobicContact CG2-CB 4.48Å; T547-F625 HydrophobicContact CG2-CD1 3.43Å; T547-F625 VanDerWaalsContact CG2-CD1 3.43Å; T547-F625 HydrophobicContact CG2-CE1 4.02Å; T547-F625 HydrophobicContact CG2-CG 4.26Å; T547-F625 CarbonylContact O-C 3.55Å; T547-F625 WeakPolarHBondContact O-CA 3.45Å; L559-F625 HydrophobicContact CB-CD1 4.21Å; L559-F625 HydrophobicContact CB-CD2 4.42Å; L559-F625 HydrophobicContact CB-CE1 4.33Å; L559-F625 HydrophobicContact CB-CG 4.28Å; L559-F625 HydrophobicContact CD1-CB 4.11Å; L559-F625 HydrophobicContact CD1-CD2 4.45Å; L559-F625 HydrophobicContact CD1-CG 4.27Å; L559-F625 HydrophobicContact CD2-CB 3.94Å; L559-F625 HydrophobicContact CD2-CD1 3.97Å; L559-F625 HydrophobicContact CD2-CG 4.06Å; L559-F625 HydrophobicContact CG-CG 4.44Å; T560-F625 WeakPolarHBondContact O-CE1 3.49Å; T560-F625 VanDerWaalsContact O-CZ 3.28Å; T560-F625 WeakPolarHBondContact O-CZ 3.46Å; C561-F625 HydrophobicContact CB-CE2 4.3Å; C561-F625 HydrophobicContact CB-CZ 4.03Å; W576-F625 HydrophobicContact CH2-CD2 4.21Å; W576-F625 AromaticContact CH2-CE2 3.51Å; W576-F625 HydrophobicContact CH2-CE2 3.51Å; W576-F625 AromaticContact CH2-CZ 3.89Å; W576-F625 HydrophobicContact CH2-CZ 3.89Å; W576-F625 AromaticContact CZ3-CD2 3.78Å; W576-F625 HydrophobicContact CZ3-CD2 3.78Å; W576-F625 AromaticContact CZ3-CE2 3.5Å; W576-F625 HydrophobicContact CZ3-CE2 3.5Å; W576-F625 VanDerWaalsContact CZ3-CE2 3.5Å; W576-F625 HydrophobicContact CZ3-CZ 4.3Å; Y610-F625 PolarHBondContact N-O 3.05Å; Y610-F625 PolarHBondContact O-N 2.81Å; C612-F625 HydrophobicContact CB-CE2 4.39Å; C623-F625 HydrophobicContact CB-CD2 4.41Å; C623-F625 HydrophobicContact CB-CE2 3.44Å; C623-F625 VanDerWaalsContact CB-CE2 3.44Å; C623-F625 HydrophobicContact CB-CZ 3.69Å; F625-V627 PolarHBondContact O-N 2.85Å
626	Q	95.2	Very high	92.1	Very high	69 Å²	69	31 Å²	31	32%	0.322	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	99.8	175.5	-178.5	64.1	3.9	0	0	109.5	T547 E548 V549	T547-Q626 PolarHBondContact O-N 3.13Å; E548-Q626 HydrophobicContact CG-CB 4.23Å; E548-Q626 HydrophobicContact CG-CG 4.35Å; V549-Q626 PolarHBondContact N-O 3.07Å
627	V	94.5	Very high	91.6	Very high	1 Å²	1	32 Å²	32	1%	0.006	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	123.2	-178.4	-177.9	0	0	0	0	109.7	V549 L559 L602 W607 G608 Y610 F625	V549-V627 HydrophobicContact CB-CG2 4.28Å; V549-V627 WeakPolarHBondContact O-CA 3.44Å; L559-V627 HydrophobicContact CD1-CG2 4.09Å; L559-V627 HydrophobicContact CD2-CG2 3.99Å; L602-V627 HydrophobicContact CD1-CG1 4.26Å; L602-V627 HydrophobicContact CD2-CG1 4.46Å; W607-V627 CarbonylContact C-O 3.55Å; W607-V627 WeakPolarHBondContact CA-O 3.49Å; G608-V627 PolarHBondContact N-O 2.93Å; G608-V627 PolarHBondContact O-N 3.34Å; Y610-V627 HydrophobicContact CD2-CB 3.81Å; Y610-V627 HydrophobicContact CD2-CG2 3.4Å; Y610-V627 VanDerWaalsContact CD2-CG2 3.4Å; Y610-V627 HydrophobicContact CE2-CB 3.82Å; Y610-V627 HydrophobicContact CE2-CG1 4.4Å; Y610-V627 HydrophobicContact CE2-CG2 3.77Å; Y610-V627 HydrophobicContact CG-CG2 4.22Å; F625-V627 PolarHBondContact O-N 2.85Å
628	T	92.8	Very high	90.6	Very high	9 Å²	9	29.3 Å²	29.3	6%	0.055	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	152.7	-170.4	-176.1	0	0	0	0	113.6	E548 V549 R550 Q551 K630	E548-T628 HydrophobicContact CG-CG2 4.2Å; E548-T628 WeakPolarHBondContact OE1-CG2 3.47Å; V549-T628 PolarHBondContact O-N 3.17Å; R550-T628 CarbonylContact C-O 3.57Å; R550-T628 WeakPolarHBondContact CA-O 3.38Å; R550-T628 HydrophobicContact CG-CG2 3.81Å; Q551-T628 PolarHBondContact N-O 3.33Å; T628-K630 HydrophobicContact CG2-CB 4.18Å; T628-K630 PolarHBondContact OG1-N 2.76Å
629	G	90.8	Very high	89.4	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.01	17%	0.168	C	C	.	.			trans	-94.1	3.2	172.2	0	0	0	0	0	114.2	A631 F724	G629-A631 PolarHBondContact O-N 2.74Å; G629-F724 VanDerWaalsContact C-CG 3.43Å; G629-F724 WeakPolarHBondContact O-CB 3.27Å
630	K	92.3	Very high	88.2	Confident	71 Å²	71	33 Å²	33	31%	0.309	17%	0.169	S	C	.	.	P	Polyproline II helix	trans	-55.8	129.9	174.1	-80.7	-172.9	149.1	-157.6	0	111.5	R550 T628 V666 F724 D728	R550-K630 VanDerWaalsContact CD-O 3.27Å; R550-K630 WeakPolarHBondContact CD-O 3.47Å; R550-K630 WeakPolarHBondContact CG-O 3.33Å; T628-K630 HydrophobicContact CG2-CB 4.18Å; T628-K630 PolarHBondContact OG1-N 2.76Å; K630-V666 WeakPolarHBondContact O-CG1 3.48Å; K630-F724 HydrophobicContact CB-CE1 4.4Å; K630-F724 HydrophobicContact CG-CD1 4.07Å; K630-F724 HydrophobicContact CG-CE1 3.48Å; K630-F724 VanDerWaalsContact CG-CE1 3.48Å; K630-F724 HydrophobicContact CG-CZ 4.14Å; K630-D728 WeakPolarHBondContact CD-OD1 3.33Å; K630-D728 IonicContact NZ-OD1 2.93Å; K630-D728 PolarHBondContact NZ-OD1 3.36Å
631	A	92.5	Very high	86.5	Confident	2 Å²	2	36.2 Å²	36.2	2%	0.017	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-68.1	144.2	165.7	0	0	0	0	0	111	G629 V666 P720 T722 G727 D728	G629-A631 PolarHBondContact O-N 2.74Å; A631-V666 HydrophobicContact CB-CG2 3.83Å; A631-P720 HydrophobicContact CB-CB 4.06Å; A631-P720 HydrophobicContact CB-CG 3.82Å; A631-T722 HydrophobicContact CB-CG2 3.74Å; A631-G727 WeakPolarHBondContact O-CA 3.29Å; A631-D728 PolarHBondContact O-N 3.23Å
632	Y	91.1	Very high	84.7	Confident	55 Å²	55	36.1 Å²	36.1	22%	0.216	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-55.7	157.8	164.4	-73.2	-80.4	0	0	0	110.7	R550 Q660 M661 N662 A665 P720	R550-Y632 HydrophobicContact CB-CE2 4.12Å; R550-Y632 HydrophobicContact CG-CE2 4.43Å; Y632-Q660 PolarHBondContact O-NE2 2.75Å; Y632-M661 HydrophobicContact CD1-CE 4.2Å; Y632-M661 HydrophobicContact CD1-CG 4.41Å; Y632-M661 HydrophobicContact CD1-SD 3.64Å; Y632-M661 HydrophobicContact CE1-CE 4.46Å; Y632-M661 HydrophobicContact CE1-SD 4.45Å; Y632-M661 HydrophobicContact CG-CG 4.23Å; Y632-M661 HydrophobicContact CG-SD 4Å; Y632-N662 HydrophobicContact CD2-CB 3.83Å; Y632-N662 HydrophobicContact CE2-CB 4.03Å; Y632-A665 HydrophobicContact CD2-CB 3.93Å; Y632-A665 HydrophobicContact CE2-CB 3.62Å; Y632-P720 WeakPolarHBondContact O-CG 3.27Å
633	P	91.2	Very high	83	Confident	37 Å²	37	32.8 Å²	32.8	24%	0.24	15%	0.154	C	C	.	.	P	Polyproline II helix	trans	-69.4	154.3	-178.8	29.4	-35.5	0	0	0	113.1	M661 D728	P633-M661 WeakPolarHBondContact O-CB 3.08Å; P633-M661 PolarHBondContact O-N 2.7Å; P633-D728 VanDerWaalsContact CA-O 3.26Å; P633-D728 WeakPolarHBondContact CA-O 3.26Å; P633-D728 HydrophobicContact CB-CB 4.31Å; P633-D728 WeakPolarHBondContact CB-O 3.29Å
634	P	91.8	Very high	81	Confident	1 Å²	1	35 Å²	35	1%	0.006	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	153.3	165.6	25.7	-31.1	0	0	0	110.9	W658 T659 Y672 L718 T730	P634-W658 HydrophobicContact CB-CG 4.33Å; P634-T659 WeakPolarHBondContact CA-O 3.3Å; P634-Y672 HydrophobicContact CB-CE1 4.07Å; P634-Y672 HydrophobicContact CG-CD1 4.49Å; P634-Y672 HydrophobicContact CG-CE1 4.34Å; P634-L718 HydrophobicContact CB-CD2 3.97Å; P634-L718 HydrophobicContact CG-CB 3.95Å; P634-L718 HydrophobicContact CG-CD2 3.89Å; P634-L718 HydrophobicContact CG-CG 3.98Å; P634-L718 VanDerWaalsContact CG-O 3.28Å; P634-L718 WeakPolarHBondContact CG-O 3.49Å; P634-T730 HydrophobicContact CG-CG2 3.88Å; P634-T730 WeakPolarHBondContact O-CB 3.35Å; P634-T730 VanDerWaalsContact O-CG2 3.27Å; P634-T730 WeakPolarHBondContact O-CG2 3.38Å; P634-T730 PolarHBondContact O-OG1 3.42Å
635	E	86.1	Confident	78.9	Confident	35 Å²	35	39.6 Å²	39.6	16%	0.164	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	101.7	-176.1	-59.7	153.5	142.9	0	0	107.2	H66 P67 Y637 W658 T659 M661	H66-E635 PolarHBondContact CE1-O 2.72Å; H66-E635 VanDerWaalsContact CE1-O 3.3Å; P67-E635 HydrophobicContact CB-CB 4.31Å; P67-E635 HydrophobicContact CB-CG 4.15Å; P67-E635 HydrophobicContact CG-CG 4.18Å; P67-E635 WeakPolarHBondContact CG-OE1 3.37Å; E635-Y637 PolarHBondContact O-N 2.9Å; E635-W658 CarbonylContact O-C 3.44Å; E635-W658 WeakPolarHBondContact O-CA 3.34Å; E635-W658 VanDerWaalsContact O-CB 3.31Å; E635-W658 WeakPolarHBondContact O-CB 3.23Å; E635-T659 WeakPolarHBondContact CB-OG1 3.46Å; E635-T659 PolarHBondContact N-O 3.12Å; E635-T659 PolarHBondContact O-N 2.95Å; E635-T659 PolarHBondContact OE2-OG1 2.8Å; E635-M661 VanDerWaalsContact CD-CA 3.48Å; E635-M661 HydrophobicContact CG-CB 3.92Å; E635-M661 WeakPolarHBondContact OE1-CA 3.26Å; E635-M661 VanDerWaalsContact OE1-CB 3.29Å; E635-M661 WeakPolarHBondContact OE1-CB 3.28Å; E635-M661 WeakPolarHBondContact OE1-CG 3.48Å; E635-M661 WeakPolarHBondContact OE2-CA 3.11Å; E635-M661 PolarHBondContact OE2-N 2.71Å
636	F	84.7	Confident	76.7	Confident	6 Å²	6	41.7 Å²	41.7	3%	0.026	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	135.5	178.2	-78.4	-53	0	0	0	111.3	H66 Y638 L656 W658 V716 L718 T730 R732	H66-F636 PolarHBondContact CE1-O 2.83Å; F636-Y638 HydrophobicContact CB-CE2 3.79Å; F636-Y638 WeakPolarHBondContact O-CD2 3.48Å; F636-Y638 WeakPolarHBondContact O-CE2 3.49Å; F636-L656 HydrophobicContact CD1-CD1 4.03Å; F636-L656 HydrophobicContact CD1-CG 4.34Å; F636-L656 HydrophobicContact CE1-CD1 3.52Å; F636-L656 HydrophobicContact CE1-CD2 3.9Å; F636-L656 HydrophobicContact CE1-CG 3.74Å; F636-L656 HydrophobicContact CZ-CD1 4.14Å; F636-L656 HydrophobicContact CZ-CD2 4.48Å; F636-W658 HydrophobicContact CD1-CB 4Å; F636-V716 HydrophobicContact CZ-CG1 4.14Å; F636-L718 HydrophobicContact CE1-CB 4.18Å; F636-L718 HydrophobicContact CE1-CD2 4.08Å; F636-L718 HydrophobicContact CZ-CB 3.74Å; F636-L718 HydrophobicContact CZ-CD2 4.48Å; F636-T730 HydrophobicContact CD2-CG2 3.27Å; F636-T730 HydrophobicContact CE2-CG2 3.19Å; F636-T730 HydrophobicContact CG-CG2 4.05Å; F636-T730 HydrophobicContact CZ-CG2 3.87Å; F636-R732 HydrophobicContact CD2-CB 3.27Å; F636-R732 HydrophobicContact CD2-CG 4.26Å; F636-R732 HydrophobicContact CE2-CB 3.42Å; F636-R732 VanDerWaalsContact CE2-CB 3.42Å; F636-R732 HydrophobicContact CG-CB 4.07Å; F636-R732 HydrophobicContact CZ-CB 4.33Å
637	Y	80.3	Confident	74.4	Confident	39 Å²	39	48.2 Å²	48.2	15%	0.153	22%	0.215	C	C	.	.			trans	-88.5	120	176.3	-165.2	-83.7	0	0	0	109.3	S22 H66 E635 D639 T640 Q657 L700 R732	S22-Y637 WeakPolarHBondContact O-CE2 3.35Å; H66-Y637 HydrophobicContact CB-CD2 4.1Å; H66-Y637 HydrophobicContact CB-CE2 3.92Å; H66-Y637 AromaticContact CD2-CD2 3.7Å; H66-Y637 AromaticContact CE1-CD2 3.92Å; H66-Y637 AromaticContact CG-CD2 3.49Å; H66-Y637 VanDerWaalsContact CG-CD2 3.49Å; H66-Y637 AromaticContact CG-CE2 3.8Å; H66-Y637 AromaticContact ND1-CD2 3.66Å; H66-Y637 AromaticContact NE2-CD2 3.95Å; E635-Y637 PolarHBondContact O-N 2.9Å; Y637-D639 HydrophobicContact CE1-CB 3.86Å; Y637-T640 HydrophobicContact CD1-CG2 4.1Å; Y637-T640 WeakPolarHBondContact CD1-OG1 3.44Å; Y637-T640 HydrophobicContact CE1-CG2 3.78Å; Y637-Q657 PolarHBondContact N-O 2.87Å; Y637-L700 HydrophobicContact CD2-CD1 3.67Å; Y637-L700 HydrophobicContact CD2-CD2 4.46Å; Y637-L700 HydrophobicContact CE2-CD1 4.45Å; Y637-L700 HydrophobicContact CG-CD1 3.78Å; Y637-R732 PolarHBondContact O-NH1 2.94Å
638	Y	68.9	Low	72.6	Confident	77 Å²	77	55 Å²	55	30%	0.302	24%	0.241	S	C	.	.			trans	-98	-27.9	-174.1	-69.7	-91.1	0	0	0	113.2	R68 F636 T640 R732	R68-Y638 HydrophobicContact CB-CD2 4.04Å; R68-Y638 HydrophobicContact CB-CE2 4.05Å; R68-Y638 HydrophobicContact CG-CD2 4.44Å; R68-Y638 HydrophobicContact CG-CE2 4.49Å; F636-Y638 HydrophobicContact CB-CE2 3.79Å; F636-Y638 WeakPolarHBondContact O-CD2 3.48Å; F636-Y638 WeakPolarHBondContact O-CE2 3.49Å; Y638-T640 PolarHBondContact O-N 2.83Å; Y638-R732 HydrophobicContact CE1-CG 4.01Å
639	D	62.8	Low	71	Confident	74 Å²	74	60.2 Å²	60.2	40%	0.396	28%	0.275	S	S	.	.	S	Bend	trans	-83.7	35.7	-165.6	-59.6	-9.3	0	0	0	113.2	G65 Y637	G65-D639 PolarHBondContact N-OD2 2.86Å; Y637-D639 HydrophobicContact CE1-CB 3.86Å
640	T	64.6	Low	70	Confident	46 Å²	46	70 Å²	70	28%	0.282	31%	0.311	S	S	.	.	S	Bend	trans	-135.3	138.4	176.8	37.5	0	0	0	0	113.1	Y637 Y638 S642 Q657	Y637-T640 HydrophobicContact CD1-CG2 4.1Å; Y637-T640 WeakPolarHBondContact CD1-OG1 3.44Å; Y637-T640 HydrophobicContact CE1-CG2 3.78Å; Y638-T640 PolarHBondContact O-N 2.83Å; T640-S642 PolarHBondContact O-N 2.67Å; T640-S642 VanDerWaalsContact O-N 3.08Å; T640-S642 PolarHBondContact O-OG 2.66Å; T640-Q657 PolarHBondContact OG1-OE1 3.04Å
641	Y	56.9	Low	69.2	Low	125 Å²	125	67.8 Å²	67.8	49%	0.49	30%	0.304	S	S	.	.			trans	-61.5	113.3	166.9	-169	-93.2	0	0	0	109.9	P643 A738 P739	Y641-P643 HydrophobicContact CE1-CB 4.03Å; Y641-P643 HydrophobicContact CE1-CG 4.04Å; Y641-P643 HydrophobicContact CE2-CG 4.42Å; Y641-A738 PolarHBondContact OH-O 3.47Å; Y641-P739 VanDerWaalsContact OH-CA 3.31Å; Y641-P739 WeakPolarHBondContact OH-CA 3.43Å
642	S	57.2	Low	68.2	Low	7 Å²	7	67.8 Å²	67.8	5%	0.049	30%	0.303	C	S	.	.			trans	-103.7	-24.4	-165.6	-57.7	0	0	0	0	116.2	T640 L644 F654 K655	T640-S642 PolarHBondContact O-N 2.67Å; T640-S642 VanDerWaalsContact O-N 3.08Å; T640-S642 PolarHBondContact O-OG 2.66Å; S642-L644 PolarHBondContact O-N 3.05Å; S642-F654 VanDerWaalsContact CB-CE2 3.43Å; S642-K655 PolarHBondContact O-N 3.42Å
643	P	58.9	Low	67.6	Low	14 Å²	14	65.2 Å²	65.2	9%	0.091	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	130.7	176.1	-25.2	33.5	0	0	0	113.5	Y641 S737 P739	Y641-P643 HydrophobicContact CE1-CB 4.03Å; Y641-P643 HydrophobicContact CE1-CG 4.04Å; Y641-P643 HydrophobicContact CE2-CG 4.42Å; P643-S737 VanDerWaalsContact CG-OG 3.23Å; P643-S737 WeakPolarHBondContact CG-OG 3.47Å; P643-P739 HydrophobicContact CB-CG 4.43Å
644	L	56.2	Low	67	Low	48 Å²	48	63.9 Å²	63.9	25%	0.251	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	124.3	171.3	-64.2	168.3	0	0	0	109.2	S642 Q646 G653 K655 N704	S642-L644 PolarHBondContact O-N 3.05Å; L644-Q646 PolarHBondContact O-N 3.4Å; L644-G653 PolarHBondContact N-O 2.84Å; L644-G653 PolarHBondContact O-N 2.86Å; L644-K655 HydrophobicContact CD1-CB 4.21Å; L644-K655 HydrophobicContact CD2-CB 4.05Å; L644-K655 HydrophobicContact CG-CB 4.05Å; L644-N704 HydrophobicContact CD1-CB 3.68Å
645	W	51.3	Low	66.6	Low	108 Å²	108	66.9 Å²	66.9	41%	0.409	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-63.6	132.1	177.3	-178.2	95.6	0	0	0	111.2	Y647 P739 N741 H743	W645-Y647 AromaticContact CH2-CD2 3.54Å; W645-Y647 HydrophobicContact CH2-CD2 3.54Å; W645-Y647 HydrophobicContact CH2-CE2 4.24Å; W645-Y647 HydrophobicContact CH2-CG 4.43Å; W645-Y647 AromaticContact CZ2-CD2 3.64Å; W645-Y647 HydrophobicContact CZ2-CD2 3.64Å; W645-Y647 HydrophobicContact CZ2-CE2 4.2Å; W645-Y647 HydrophobicContact CZ3-CD2 4.45Å; W645-P739 HydrophobicContact CB-CB 4.49Å; W645-N741 VanDerWaalsContact NE1-CG 3.34Å; W645-N741 PolarHBondContact NE1-OD1 2.85Å; W645-N741 VanDerWaalsContact NE1-OD1 3.13Å; W645-H743 AromaticContact CH2-CD2 3.96Å; W645-H743 AromaticContact CH2-NE2 3.99Å; W645-H743 AromaticContact CZ2-CD2 3.79Å
646	Q	51.8	Low	66.6	Low	51 Å²	51	65.2 Å²	65.2	24%	0.238	29%	0.289	C	S	.	.			trans	-140.5	135.4	176.3	-65.5	-169.5	-6.8	0	0	109.8	L644 R648	L644-Q646 PolarHBondContact O-N 3.4Å; Q646-R648 PolarHBondContact O-N 2.91Å
647	Y	45.3	Very low	66.8	Low	206 Å²	206	65.3 Å²	65.3	81%	0.808	29%	0.289	S	S	*	.	S	Bend	trans	-75.5	20.7	-176.2	-150	-105.7	0	0	0	114.3	W645	W645-Y647 AromaticContact CH2-CD2 3.54Å; W645-Y647 HydrophobicContact CH2-CD2 3.54Å; W645-Y647 HydrophobicContact CH2-CE2 4.24Å; W645-Y647 HydrophobicContact CH2-CG 4.43Å; W645-Y647 AromaticContact CZ2-CD2 3.64Å; W645-Y647 HydrophobicContact CZ2-CD2 3.64Å; W645-Y647 HydrophobicContact CZ2-CE2 4.2Å; W645-Y647 HydrophobicContact CZ3-CD2 4.45Å
648	R	58.3	Low	67.3	Low	144 Å²	144	63.5 Å²	63.5	54%	0.543	28%	0.282	S	S	.	.			trans	-107.7	131.4	-179.2	-70.9	-177.3	175.3	177.4	1.1	109.7	Q646 R650 V651 E707 K710	Q646-R648 PolarHBondContact O-N 2.91Å; R648-R650 PolarHBondContact O-N 3.47Å; R648-V651 HydrophobicContact CB-CG2 3.55Å; R648-V651 HydrophobicContact CG-CG2 4.29Å; R648-E707 IonicContact NH1-OE1 2.93Å; R648-E707 PolarHBondContact NH1-OE1 2.96Å; R648-K710 PolarHBondContact O-NZ 3.3Å
649	P	59.1	Low	68.2	Low	118 Å²	118	59.9 Å²	59.9	77%	0.766	27%	0.268	S	S	*	.	S	Bend	trans	-66.5	-37.5	-170.7	23.1	-32.9	0	0	0	113.5	K710	P649-K710 PolarHBondContact O-NZ 2.81Å
650	R	68.7	Low	69.7	Low	207 Å²	207	56.5 Å²	56.5	78%	0.781	25%	0.25	S	C	*	.	S	Bend	trans	-93.6	-10.9	-173.2	-68.2	-172	178.1	-173.1	-0.7	116.1	R648 K710	R648-R650 PolarHBondContact O-N 3.47Å; R650-K710 PolarHBondContact O-N 2.95Å
651	V	74.9	Confident	70.7	Confident	24 Å²	24	57.2 Å²	57.2	15%	0.145	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	156.9	-175.6	-63.3	0	0	0	0	113.2	R648 L708 K710	R648-V651 HydrophobicContact CB-CG2 3.55Å; R648-V651 HydrophobicContact CG-CG2 4.29Å; V651-L708 CarbonylContact C-O 3.54Å; V651-L708 WeakPolarHBondContact CA-O 3.36Å; V651-L708 VanDerWaalsContact CB-O 3.27Å; V651-L708 WeakPolarHBondContact CB-O 3.44Å; V651-K710 WeakPolarHBondContact O-CE 3.16Å; V651-K710 PolarHBondContact O-NZ 2.91Å
652	Y	72.5	Confident	72.1	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.008	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	162.9	172.9	74.4	-74.8	0	0	0	110.5	F654 L708 I709 K710 E712 Y714 Y736	Y652-F654 HydrophobicContact CE2-CB 4.27Å; Y652-F654 HydrophobicContact CE2-CD2 4.31Å; Y652-L708 HydrophobicContact CD1-CB 3.71Å; Y652-L708 VanDerWaalsContact CD1-O 3.27Å; Y652-L708 WeakPolarHBondContact CD1-O 3.45Å; Y652-L708 HydrophobicContact CD2-CD1 4.46Å; Y652-L708 HydrophobicContact CE1-CB 3.41Å; Y652-L708 VanDerWaalsContact CE1-CB 3.41Å; Y652-L708 HydrophobicContact CE1-CD1 4.36Å; Y652-L708 HydrophobicContact CE2-CB 4.3Å; Y652-L708 HydrophobicContact CE2-CD1 3.87Å; Y652-L708 HydrophobicContact CG-CB 4.27Å; Y652-L708 PolarHBondContact N-O 2.83Å; Y652-L708 PolarHBondContact O-N 3.09Å; Y652-I709 WeakPolarHBondContact CE1-O 3.46Å; Y652-K710 HydrophobicContact CD1-CG 3.95Å; Y652-E712 PolarHBondContact OH-O 2.94Å; Y652-Y714 HydrophobicContact CE1-CE2 4.45Å; Y652-Y736 AromaticContact CD1-CD2 3.74Å; Y652-Y736 HydrophobicContact CD1-CD2 3.74Å; Y652-Y736 HydrophobicContact CD1-CG 4.4Å; Y652-Y736 AromaticContact CD2-CD2 3.92Å; Y652-Y736 HydrophobicContact CD2-CD2 3.92Å; Y652-Y736 HydrophobicContact CE1-CD2 4.15Å; Y652-Y736 HydrophobicContact CE1-CG 4.45Å; Y652-Y736 HydrophobicContact CE2-CD2 4.32Å; Y652-Y736 AromaticContact CG-CD2 3.64Å; Y652-Y736 HydrophobicContact CG-CD2 3.64Å; Y652-Y736 HydrophobicContact CG-CE2 4.21Å
653	G	77.5	Confident	73.6	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	161.8	165.4	0	0	0	0	0	111.1	L644 L705	L644-G653 PolarHBondContact N-O 2.84Å; L644-G653 PolarHBondContact O-N 2.86Å; G653-L705 CarbonylContact C-O 3.53Å; G653-L705 WeakPolarHBondContact CA-O 3.35Å
654	F	80	Confident	74.9	Confident	9 Å²	9	56.3 Å²	56.3	4%	0.039	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	123	177.8	-170.6	-81.7	0	0	0	110.2	S642 Y652 L656 L705 L708 I734	S642-F654 VanDerWaalsContact CB-CE2 3.43Å; Y652-F654 HydrophobicContact CE2-CB 4.27Å; Y652-F654 HydrophobicContact CE2-CD2 4.31Å; F654-L656 HydrophobicContact CE1-CD1 4.35Å; F654-L656 PolarHBondContact O-N 2.93Å; F654-L656 VanDerWaalsContact O-N 3.17Å; F654-L705 HydrophobicContact CB-CB 4.28Å; F654-L705 HydrophobicContact CB-CD1 4.44Å; F654-L705 HydrophobicContact CD1-CD1 4.39Å; F654-L705 PolarHBondContact N-O 3.36Å; F654-L705 WeakPolarHBondContact O-CB 3.24Å; F654-L705 PolarHBondContact O-N 3Å; F654-L708 HydrophobicContact CB-CD1 3.75Å; F654-I734 HydrophobicContact CB-CD1 3.97Å; F654-I734 HydrophobicContact CD1-CB 4.4Å; F654-I734 HydrophobicContact CD1-CD1 3.97Å; F654-I734 HydrophobicContact CD1-CG2 4.04Å; F654-I734 HydrophobicContact CD2-CB 4.1Å; F654-I734 HydrophobicContact CD2-CD1 4.19Å; F654-I734 HydrophobicContact CE1-CB 4.16Å; F654-I734 HydrophobicContact CE1-CG2 3.52Å; F654-I734 HydrophobicContact CE2-CB 3.81Å; F654-I734 HydrophobicContact CE2-CG2 4.03Å; F654-I734 HydrophobicContact CG-CB 4.38Å; F654-I734 HydrophobicContact CG-CD1 3.78Å; F654-I734 HydrophobicContact CZ-CB 3.84Å; F654-I734 HydrophobicContact CZ-CG2 3.51Å
655	K	82.9	Confident	76.4	Confident	65 Å²	65	55.2 Å²	55.2	28%	0.283	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	95.5	175.2	-170.7	-175.1	177.7	-149.7	0	109	S642 L644 Q657	S642-K655 PolarHBondContact O-N 3.42Å; L644-K655 HydrophobicContact CD1-CB 4.21Å; L644-K655 HydrophobicContact CD2-CB 4.05Å; L644-K655 HydrophobicContact CG-CB 4.05Å; K655-Q657 HydrophobicContact CD-CG 4.3Å; K655-Q657 VanDerWaalsContact CD-OE1 3.32Å; K655-Q657 HydrophobicContact CG-CG 4.03Å
656	L	86.8	Confident	78.3	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	130.9	172.1	-163.8	68.7	0	0	0	108.9	F636 F654 W658 L674 T702 H703 L705 V716	F636-L656 HydrophobicContact CD1-CD1 4.03Å; F636-L656 HydrophobicContact CD1-CG 4.34Å; F636-L656 HydrophobicContact CE1-CD1 3.52Å; F636-L656 HydrophobicContact CE1-CD2 3.9Å; F636-L656 HydrophobicContact CE1-CG 3.74Å; F636-L656 HydrophobicContact CZ-CD1 4.14Å; F636-L656 HydrophobicContact CZ-CD2 4.48Å; F654-L656 HydrophobicContact CE1-CD1 4.35Å; F654-L656 PolarHBondContact O-N 2.93Å; F654-L656 VanDerWaalsContact O-N 3.17Å; L656-W658 HydrophobicContact CD2-CE3 4.42Å; L656-W658 HydrophobicContact CD2-CZ3 4.27Å; L656-W658 HydrophobicContact CG-CE3 4.26Å; L656-W658 HydrophobicContact CG-CZ3 4.37Å; L656-L674 HydrophobicContact CD2-CD1 3.8Å; L656-T702 CarbonylContact O-C 3.48Å; L656-T702 VanDerWaalsContact O-CA 3.28Å; L656-T702 WeakPolarHBondContact O-CA 3.5Å; L656-H703 WeakPolarHBondContact CA-O 3.45Å; L656-H703 WeakPolarHBondContact CB-O 3.49Å; L656-H703 PolarHBondContact N-O 2.86Å; L656-H703 PolarHBondContact O-N 3.4Å; L656-L705 HydrophobicContact CB-CD1 4.42Å; L656-L705 HydrophobicContact CB-CG 4.29Å; L656-V716 HydrophobicContact CD1-CB 4.45Å; L656-V716 HydrophobicContact CD1-CG1 3.92Å; L656-V716 HydrophobicContact CD2-CG1 3.74Å
657	Q	87.9	Confident	80.1	Confident	7 Å²	7	48.8 Å²	48.8	3%	0.033	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	139.8	179.4	-61.6	-162.7	-136.9	0	0	110.5	Y637 T640 K655 L700 M701 T702	Y637-Q657 PolarHBondContact N-O 2.87Å; T640-Q657 PolarHBondContact OG1-OE1 3.04Å; K655-Q657 HydrophobicContact CD-CG 4.3Å; K655-Q657 VanDerWaalsContact CD-OE1 3.32Å; K655-Q657 HydrophobicContact CG-CG 4.03Å; Q657-L700 HydrophobicContact CB-CD1 4.31Å; Q657-M701 WeakPolarHBondContact CA-O 3.32Å; Q657-T702 HydrophobicContact CG-CG2 3.82Å
658	W	90.4	Very high	82.3	Confident	1 Å²	1	45.2 Å²	45.2	0%	0.004	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	160.2	-179.8	70.1	100.1	0	0	0	112.4	P634 E635 F636 L656 Y672 I689 M701 H703 L718	P634-W658 HydrophobicContact CB-CG 4.33Å; E635-W658 CarbonylContact O-C 3.44Å; E635-W658 WeakPolarHBondContact O-CA 3.34Å; E635-W658 VanDerWaalsContact O-CB 3.31Å; E635-W658 WeakPolarHBondContact O-CB 3.23Å; F636-W658 HydrophobicContact CD1-CB 4Å; L656-W658 HydrophobicContact CD2-CE3 4.42Å; L656-W658 HydrophobicContact CD2-CZ3 4.27Å; L656-W658 HydrophobicContact CG-CE3 4.26Å; L656-W658 HydrophobicContact CG-CZ3 4.37Å; W658-Y672 AromaticContact CZ2-CD2 3.98Å; W658-Y672 HydrophobicContact CZ2-CD2 3.98Å; W658-Y672 HydrophobicContact CZ2-CE2 4.09Å; W658-Y672 HydrophobicContact CZ2-CG 4.37Å; W658-Y672 AromaticContact NE1-CE1 3.59Å; W658-Y672 AromaticContact NE1-CE2 3.68Å; W658-Y672 AromaticContact NE1-CZ 3.31Å; W658-Y672 VanDerWaalsContact NE1-CZ 3.31Å; W658-Y672 PolarHBondContact NE1-OH 3.27Å; W658-I689 HydrophobicContact CH2-CD1 3.9Å; W658-M701 HydrophobicContact CD2-CB 3.84Å; W658-M701 VanDerWaalsContact CE2-CB 3.48Å; W658-M701 HydrophobicContact CE3-CB 4.32Å; W658-M701 HydrophobicContact CG-CB 4.31Å; W658-M701 HydrophobicContact CH2-CB 4.19Å; W658-M701 HydrophobicContact CZ2-CB 3.7Å; W658-M701 HydrophobicContact CZ2-CE 3.95Å; W658-M701 HydrophobicContact CZ2-CG 4.48Å; W658-M701 HydrophobicContact CZ2-SD 4.01Å; W658-M701 HydrophobicContact CZ3-CB 4.48Å; W658-M701 PolarHBondContact N-O 2.98Å; W658-M701 WeakPolarHBondContact O-CB 3.09Å; W658-M701 PolarHBondContact O-N 2.64Å; W658-H703 HydrophobicContact CH2-CB 3.78Å; W658-H703 HydrophobicContact CZ3-CB 3.69Å; W658-L718 HydrophobicContact CB-CD2 4.49Å; W658-L718 HydrophobicContact CD2-CD2 3.48Å; W658-L718 VanDerWaalsContact CD2-CD2 3.48Å; W658-L718 VanDerWaalsContact CE2-CD2 3.5Å; W658-L718 HydrophobicContact CE3-CD2 4Å; W658-L718 HydrophobicContact CG-CD2 3.7Å; W658-L718 HydrophobicContact CH2-CD2 4.5Å; W658-L718 HydrophobicContact CZ2-CD2 4.03Å; W658-L718 HydrophobicContact CZ3-CD2 4.48Å
659	T	89.4	Confident	83.9	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.006	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	165.1	160.1	54.8	0	0	0	0	109.8	S22 H66 P634 E635 E699 L700	S22-T659 WeakPolarHBondContact OG-CG2 3.42Å; H66-T659 VanDerWaalsContact NE2-CG2 3.35Å; H66-T659 WeakPolarHBondContact NE2-CG2 3.39Å; H66-T659 PolarHBondContact NE2-OG1 3.02Å; P634-T659 WeakPolarHBondContact CA-O 3.3Å; E635-T659 WeakPolarHBondContact CB-OG1 3.46Å; E635-T659 PolarHBondContact N-O 3.12Å; E635-T659 PolarHBondContact O-N 2.95Å; E635-T659 PolarHBondContact OE2-OG1 2.8Å; T659-E699 WeakPolarHBondContact CG2-O 3.39Å; T659-L700 HydrophobicContact CG2-CD1 4.33Å
660	Q	92.4	Very high	85.6	Confident	3 Å²	3	35.6 Å²	35.6	1%	0.014	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	129.8	165.2	179.5	53.1	45.5	0	0	110.5	Y632 N662 P663 I669 Y672 I695	Y632-Q660 PolarHBondContact O-NE2 2.75Å; Q660-N662 PolarHBondContact O-N 2.97Å; Q660-P663 HydrophobicContact CB-CB 4.11Å; Q660-P663 HydrophobicContact CB-CG 4.5Å; Q660-P663 HydrophobicContact CG-CB 3.7Å; Q660-P663 HydrophobicContact CG-CG 4.43Å; Q660-P663 WeakPolarHBondContact O-CD 3.26Å; Q660-I669 HydrophobicContact CB-CD1 4.45Å; Q660-I669 HydrophobicContact CG-CD1 3.56Å; Q660-Y672 PolarHBondContact OE1-OH 2.85Å; Q660-I695 HydrophobicContact CB-CG2 4.15Å
661	M	86.6	Confident	86.8	Confident	62 Å²	62	26.2 Å²	26.2	31%	0.305	15%	0.146	S	C	.	.	S	Bend	trans	-67.2	123.1	167.9	-171.5	-175.9	-168.4	0	0	109.6	Y632 P633 E635	Y632-M661 HydrophobicContact CD1-CE 4.2Å; Y632-M661 HydrophobicContact CD1-CG 4.41Å; Y632-M661 HydrophobicContact CD1-SD 3.64Å; Y632-M661 HydrophobicContact CE1-CE 4.46Å; Y632-M661 HydrophobicContact CE1-SD 4.45Å; Y632-M661 HydrophobicContact CG-CG 4.23Å; Y632-M661 HydrophobicContact CG-SD 4Å; P633-M661 WeakPolarHBondContact O-CB 3.08Å; P633-M661 PolarHBondContact O-N 2.7Å; E635-M661 VanDerWaalsContact CD-CA 3.48Å; E635-M661 HydrophobicContact CG-CB 3.92Å; E635-M661 WeakPolarHBondContact OE1-CA 3.26Å; E635-M661 VanDerWaalsContact OE1-CB 3.29Å; E635-M661 WeakPolarHBondContact OE1-CB 3.28Å; E635-M661 WeakPolarHBondContact OE1-CG 3.48Å; E635-M661 WeakPolarHBondContact OE2-CA 3.11Å; E635-M661 PolarHBondContact OE2-N 2.71Å
662	N	86.4	Confident	87.8	Confident	54 Å²	54	25.1 Å²	25.1	29%	0.289	14%	0.139	S	C	.	.	S	Bend	trans	42.4	59	174	-65	-36.1	0	0	0	115.1	Y632 Q660 G664 A665 K697	Y632-N662 HydrophobicContact CD2-CB 3.83Å; Y632-N662 HydrophobicContact CE2-CB 4.03Å; Q660-N662 PolarHBondContact O-N 2.97Å; N662-G664 PolarHBondContact O-N 2.95Å; N662-A665 HydrophobicContact CB-CB 4.27Å; N662-A665 VanDerWaalsContact O-CB 3.31Å; N662-A665 WeakPolarHBondContact O-CB 3.43Å; N662-A665 PolarHBondContact O-N 3.44Å; N662-K697 PolarHBondContact OD1-NZ 2.93Å
663	P	88.3	Confident	89	Confident	19 Å²	19	28.4 Å²	28.4	12%	0.123	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-59.3	-27.3	-171	21.9	-32.9	0	0	0	114.3	Q660 A665 I695 K697	Q660-P663 HydrophobicContact CB-CB 4.11Å; Q660-P663 HydrophobicContact CB-CG 4.5Å; Q660-P663 HydrophobicContact CG-CB 3.7Å; Q660-P663 HydrophobicContact CG-CG 4.43Å; Q660-P663 WeakPolarHBondContact O-CD 3.26Å; P663-A665 VanDerWaalsContact C-N 3.34Å; P663-A665 PolarHBondContact O-N 2.85Å; P663-I695 HydrophobicContact CB-CB 4.28Å; P663-I695 HydrophobicContact CB-CG2 4.38Å; P663-I695 WeakPolarHBondContact CB-O 3.11Å; P663-I695 WeakPolarHBondContact CG-O 3.48Å; P663-K697 HydrophobicContact CG-CB 4.37Å
664	G	86.9	Confident	89.8	Confident	54 Å²	54	28.4 Å²	28.4	56%	0.557	15%	0.152	S	C	*	.	G	3₁₀ helix	trans	-77.3	-9.4	177.5	0	0	0	0	0	115.4	R555 N662 V666	R555-G664 PolarHBondContact NH1-O 2.86Å; R555-G664 PolarHBondContact NH2-O 2.88Å; N662-G664 PolarHBondContact O-N 2.95Å; G664-V666 VanDerWaalsContact C-N 3.34Å; G664-V666 PolarHBondContact O-N 2.75Å
665	A	87.3	Confident	90.5	Very high	24 Å²	24	28 Å²	28	20%	0.198	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-67.1	-30.3	-172	0	0	0	0	0	114	Q551 R555 Y632 N662 P663	Q551-A665 WeakPolarHBondContact CA-O 3.48Å; Q551-A665 PolarHBondContact OE1-O 2.89Å; R555-A665 PolarHBondContact NH1-O 2.82Å; R555-A665 VanDerWaalsContact NH1-O 3.1Å; Y632-A665 HydrophobicContact CD2-CB 3.93Å; Y632-A665 HydrophobicContact CE2-CB 3.62Å; N662-A665 HydrophobicContact CB-CB 4.27Å; N662-A665 VanDerWaalsContact O-CB 3.31Å; N662-A665 WeakPolarHBondContact O-CB 3.43Å; N662-A665 PolarHBondContact O-N 3.44Å; P663-A665 VanDerWaalsContact C-N 3.34Å; P663-A665 PolarHBondContact O-N 2.85Å
666	V	91.4	Very high	90.9	Very high	5 Å²	5	25.7 Å²	25.7	3%	0.03	14%	0.141	C	C	.	.	S	Bend	trans	-126.4	-167.6	-179.1	-64.9	0	0	0	0	111.8	R550 R555 K630 A631 G664 T722	R550-V666 HydrophobicContact CB-CG1 3.87Å; R555-V666 PolarHBondContact NH1-O 2.86Å; R555-V666 PolarHBondContact NH2-O 2.89Å; K630-V666 WeakPolarHBondContact O-CG1 3.48Å; A631-V666 HydrophobicContact CB-CG2 3.83Å; G664-V666 VanDerWaalsContact C-N 3.34Å; G664-V666 PolarHBondContact O-N 2.75Å; V666-T722 HydrophobicContact CG2-CG2 4.15Å
667	D	89.3	Confident	91.1	Very high	19 Å²	19	28 Å²	28	10%	0.102	15%	0.15	C	C	.	.	S	Bend	trans	-55.3	144.5	166.6	-81.9	25.8	0	0	0	110.6	G552 L553 I669 T722 R723	G552-D667 WeakPolarHBondContact CA-OD1 3.45Å; L553-D667 PolarHBondContact N-OD1 2.86Å; D667-I669 PolarHBondContact O-N 3.17Å; D667-T722 WeakPolarHBondContact O-CG2 3.28Å; D667-R723 HydrophobicContact CB-CB 4.36Å; D667-R723 WeakPolarHBondContact OD2-CB 3.26Å
668	R	91.2	Very high	91.1	Very high	131 Å²	131	30.2 Å²	30.2	49%	0.494	16%	0.16	S	C	.	.	P	Polyproline II helix	trans	-54.7	141.6	-177.9	78.3	179.8	-167.1	170	8.7	111.6	V670	R668-V670 HydrophobicContact CG-CG1 4.36Å
669	I	93.3	Very high	90.7	Very high	10 Å²	10	33.3 Å²	33.3	5%	0.051	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-65.4	136.7	168.5	-63.7	174.9	0	0	0	108.4	Q660 D667 A671 Y672 V691 I695 P720 I721 T722	Q660-I669 HydrophobicContact CB-CD1 4.45Å; Q660-I669 HydrophobicContact CG-CD1 3.56Å; D667-I669 PolarHBondContact O-N 3.17Å; I669-A671 VanDerWaalsContact CG2-O 3.26Å; I669-A671 WeakPolarHBondContact CG2-O 3.23Å; I669-Y672 HydrophobicContact CD1-CE1 4.25Å; I669-Y672 HydrophobicContact CG2-CD2 4.28Å; I669-Y672 HydrophobicContact CG2-CE2 3.93Å; I669-V691 HydrophobicContact CG2-CG2 4.22Å; I669-I695 HydrophobicContact CB-CD1 4.17Å; I669-I695 HydrophobicContact CD1-CD1 4.27Å; I669-I695 HydrophobicContact CG2-CD1 4.39Å; I669-P720 HydrophobicContact CD1-CB 3.72Å; I669-P720 HydrophobicContact CG1-CB 4.2Å; I669-I721 CarbonylContact C-O 3.58Å; I669-I721 WeakPolarHBondContact CA-O 3.34Å; I669-T722 HydrophobicContact CG1-CG2 4.03Å
670	V	93.3	Very high	90.1	Very high	51 Å²	51	36.3 Å²	36.3	31%	0.309	21%	0.21	S	C	.	.			trans	-114.2	-23.4	179.4	-64.8	0	0	0	0	112.5	R668 V691 I721	R668-V670 HydrophobicContact CG-CG1 4.36Å; V670-V691 PolarHBondContact O-N 3.17Å; V670-I721 HydrophobicContact CG2-CG2 4.03Å; V670-I721 WeakPolarHBondContact CG2-O 3.08Å; V670-I721 PolarHBondContact N-O 3.15Å
671	A	94.9	Very high	89.8	Confident	10 Å²	10	40.6 Å²	40.6	8%	0.083	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	167.6	173.1	0	0	0	0	0	110.3	I669 I689 I721	I669-A671 VanDerWaalsContact CG2-O 3.26Å; I669-A671 WeakPolarHBondContact CG2-O 3.23Å; A671-I689 CarbonylContact C-O 3.48Å; A671-I689 WeakPolarHBondContact CA-O 3.29Å; A671-I689 WeakPolarHBondContact CB-O 3.41Å; A671-I721 HydrophobicContact CB-CB 4.4Å; A671-I721 HydrophobicContact CB-CD1 4.21Å; A671-I721 WeakPolarHBondContact O-CB 3.42Å; A671-I721 PolarHBondContact O-N 2.95Å
672	Y	95.9	Very high	89.6	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	134.9	159.3	-64.8	-97.2	0	0	0	109.9	P634 W658 Q660 I669 L674 E688 I689 V691 I695 M701 L718 T719 P720	P634-Y672 HydrophobicContact CB-CE1 4.07Å; P634-Y672 HydrophobicContact CG-CD1 4.49Å; P634-Y672 HydrophobicContact CG-CE1 4.34Å; W658-Y672 AromaticContact CZ2-CD2 3.98Å; W658-Y672 HydrophobicContact CZ2-CD2 3.98Å; W658-Y672 HydrophobicContact CZ2-CE2 4.09Å; W658-Y672 HydrophobicContact CZ2-CG 4.37Å; W658-Y672 AromaticContact NE1-CE1 3.59Å; W658-Y672 AromaticContact NE1-CE2 3.68Å; W658-Y672 AromaticContact NE1-CZ 3.31Å; W658-Y672 VanDerWaalsContact NE1-CZ 3.31Å; W658-Y672 PolarHBondContact NE1-OH 3.27Å; Q660-Y672 PolarHBondContact OE1-OH 2.85Å; I669-Y672 HydrophobicContact CD1-CE1 4.25Å; I669-Y672 HydrophobicContact CG2-CD2 4.28Å; I669-Y672 HydrophobicContact CG2-CE2 3.93Å; Y672-L674 PolarHBondContact O-N 3.33Å; Y672-E688 CarbonylContact O-C 3.56Å; Y672-E688 WeakPolarHBondContact O-CA 3.42Å; Y672-I689 PolarHBondContact N-O 3.13Å; Y672-I689 PolarHBondContact O-N 2.82Å; Y672-V691 HydrophobicContact CD2-CG2 3.84Å; Y672-V691 HydrophobicContact CE2-CG2 3.8Å; Y672-I695 HydrophobicContact CE2-CD1 4.04Å; Y672-I695 WeakPolarHBondContact OH-CD1 3.37Å; Y672-M701 HydrophobicContact CD2-CE 4.37Å; Y672-M701 HydrophobicContact CE2-CE 3.72Å; Y672-M701 HydrophobicContact CE2-SD 3.46Å; Y672-M701 WeakPolarHBondContact CE2-SD 3.16Å; Y672-M701 PolarHBondContact OH-SD 2.92Å; Y672-M701 VanDerWaalsContact OH-SD 3.37Å; Y672-L718 HydrophobicContact CD1-CD1 4.41Å; Y672-L718 HydrophobicContact CD1-CD2 4.06Å; Y672-L718 HydrophobicContact CD1-CG 3.91Å; Y672-L718 HydrophobicContact CG-CD1 4.29Å; Y672-L718 HydrophobicContact CG-CD2 4.47Å; Y672-L718 HydrophobicContact CG-CG 4.29Å; Y672-T719 CarbonylContact C-O 3.58Å; Y672-T719 VanDerWaalsContact CA-O 3.26Å; Y672-T719 WeakPolarHBondContact CA-O 3.31Å; Y672-P720 HydrophobicContact CD1-CB 3.96Å; Y672-P720 HydrophobicContact CE1-CB 3.83Å
673	R	96.3	Very high	89.7	Confident	71 Å²	71	53.5 Å²	53.5	27%	0.268	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	109.9	165.6	-167.4	164.2	-69.2	162.9	-10.1	108.8	E688 L718 T719 I721 E726	R673-E688 IonicContact CZ-OE1 3.59Å; R673-E688 IonicContact NE-OE1 2.77Å; R673-E688 PolarHBondContact NE-OE1 3.37Å; R673-E688 VanDerWaalsContact NE-OE1 3.12Å; R673-E688 IonicContact NH2-OE1 3.59Å; R673-E688 PolarHBondContact NH2-OE1 3.37Å; R673-L718 WeakPolarHBondContact O-CA 3.12Å; R673-T719 PolarHBondContact N-O 2.86Å; R673-T719 PolarHBondContact O-N 2.91Å; R673-I721 HydrophobicContact CB-CD1 4.13Å; R673-E726 WeakPolarHBondContact CD-OE1 3.48Å; R673-E726 IonicContact CZ-OE1 3.1Å; R673-E726 IonicContact NE-OE1 2.71Å; R673-E726 VanDerWaalsContact NH1-CD 3.35Å; R673-E726 IonicContact NH1-OE1 2.78Å; R673-E726 PolarHBondContact NH1-OE1 3.15Å; R673-E726 IonicContact NH1-OE2 2.68Å
674	L	95.4	Very high	89.7	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	113.5	172.6	170.7	66.2	0	0	0	108.2	L656 Y672 I676 E686 Q687 I689 L705 V716 R717 L718	L656-L674 HydrophobicContact CD2-CD1 3.8Å; Y672-L674 PolarHBondContact O-N 3.33Å; L674-I676 HydrophobicContact CD1-CG1 4.15Å; L674-I676 HydrophobicContact CD2-CD1 4.23Å; L674-I676 HydrophobicContact CD2-CG1 4.44Å; L674-I676 HydrophobicContact CG-CD1 4.4Å; L674-I676 HydrophobicContact CG-CG1 4.07Å; L674-E686 CarbonylContact O-C 3.58Å; L674-E686 VanDerWaalsContact O-CA 3.31Å; L674-E686 WeakPolarHBondContact O-CA 3.4Å; L674-Q687 PolarHBondContact N-O 3.05Å; L674-Q687 PolarHBondContact O-N 3.38Å; L674-I689 HydrophobicContact CB-CD1 3.99Å; L674-I689 HydrophobicContact CB-CG1 4.21Å; L674-I689 HydrophobicContact CD2-CD1 4.14Å; L674-L705 HydrophobicContact CD1-CD2 4.27Å; L674-L705 HydrophobicContact CD2-CD2 3.61Å; L674-V716 HydrophobicContact CD1-CG1 3.48Å; L674-V716 VanDerWaalsContact CD1-CG1 3.48Å; L674-R717 WeakPolarHBondContact CA-O 3.44Å; L674-L718 HydrophobicContact CB-CD1 4.15Å; L674-L718 HydrophobicContact CD1-CD1 4.28Å
675	G	93.8	Very high	89.8	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	134.9	167.2	0	0	0	0	0	110.4	W685 V716 R717	G675-W685 CarbonylContact C-O 3.58Å; G675-W685 WeakPolarHBondContact CA-O 3.46Å; G675-V716 CarbonylContact O-C 3.53Å; G675-V716 WeakPolarHBondContact O-CA 3.39Å; G675-R717 PolarHBondContact N-O 2.8Å; G675-R717 PolarHBondContact O-N 2.77Å
676	I	92.4	Very high	90.1	Very high	18 Å²	18	63.3 Å²	63.3	9%	0.092	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	135.6	173.5	-45.6	176.2	0	0	0	109.2	L674 W685 L705 L708 Y714 E715	L674-I676 HydrophobicContact CD1-CG1 4.15Å; L674-I676 HydrophobicContact CD2-CD1 4.23Å; L674-I676 HydrophobicContact CD2-CG1 4.44Å; L674-I676 HydrophobicContact CG-CD1 4.4Å; L674-I676 HydrophobicContact CG-CG1 4.07Å; I676-W685 HydrophobicContact CB-CE3 4.3Å; I676-W685 HydrophobicContact CD1-CE3 3.71Å; I676-W685 HydrophobicContact CD1-CZ3 3.61Å; I676-W685 HydrophobicContact CG1-CE3 3.99Å; I676-W685 HydrophobicContact CG1-CZ3 4.27Å; I676-W685 PolarHBondContact N-O 3.02Å; I676-W685 PolarHBondContact O-N 3.17Å; I676-L705 HydrophobicContact CD1-CD1 4.47Å; I676-L705 HydrophobicContact CD1-CD2 3.84Å; I676-L708 HydrophobicContact CG2-CD2 4.43Å; I676-Y714 HydrophobicContact CG2-CD1 3.93Å; I676-Y714 HydrophobicContact CG2-CG 4.44Å; I676-E715 WeakPolarHBondContact CA-O 3.38Å
677	R	90.6	Very high	90.2	Very high	49 Å²	49	66.8 Å²	66.8	19%	0.185	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	150.9	165.2	65.4	178.1	-177.7	161	-4.9	111.1	L681 R683 W684 Y714 E715	R677-L681 WeakPolarHBondContact CD-O 3.33Å; R677-L681 PolarHBondContact NH1-O 2.96Å; R677-R683 WeakPolarHBondContact CB-O 3.45Å; R677-W684 HydrophobicContact CB-CD2 4.19Å; R677-W684 HydrophobicContact CB-CE3 4.03Å; R677-W684 HydrophobicContact CB-CZ3 4.41Å; R677-W684 VanDerWaalsContact CD-CE2 3.47Å; R677-W684 HydrophobicContact CG-CD2 3.99Å; R677-W684 HydrophobicContact CG-CE3 3.84Å; R677-W684 HydrophobicContact CG-CH2 3.91Å; R677-W684 HydrophobicContact CG-CZ2 4.05Å; R677-W684 HydrophobicContact CG-CZ3 3.8Å; R677-Y714 CarbonylContact O-C 3.46Å; R677-Y714 WeakPolarHBondContact O-CA 3.19Å; R677-Y714 WeakPolarHBondContact O-CB 3.46Å; R677-E715 HydrophobicContact CG-CB 3.86Å; R677-E715 IonicContact CZ-OE1 2.84Å; R677-E715 IonicContact CZ-OE2 2.7Å; R677-E715 PolarHBondContact N-O 2.9Å; R677-E715 VanDerWaalsContact NE-CD 3.32Å; R677-E715 IonicContact NE-OE1 2.88Å; R677-E715 PolarHBondContact NE-OE1 3.47Å; R677-E715 IonicContact NE-OE2 3.04Å; R677-E715 PolarHBondContact NE-OE2 3.34Å; R677-E715 VanDerWaalsContact NH2-CD 3.31Å; R677-E715 IonicContact NH2-OE1 3.27Å; R677-E715 PolarHBondContact NH2-OE1 2.82Å; R677-E715 VanDerWaalsContact NH2-OE1 3.14Å; R677-E715 IonicContact NH2-OE2 2.73Å; R677-E715 PolarHBondContact NH2-OE2 2.65Å; R677-E715 PolarHBondContact O-N 3.39Å
678	Q	87.9	Confident	90.3	Very high	52 Å²	52	70.5 Å²	70.5	24%	0.243	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	139.7	167.5	-172.5	-179.5	-8.3	0	0	108.9	G680 L681 E712 Y714	Q678-G680 PolarHBondContact O-N 2.79Å; Q678-L681 HydrophobicContact CB-CD1 3.87Å; Q678-L681 HydrophobicContact CB-CG 4.09Å; Q678-L681 PolarHBondContact O-N 2.65Å; Q678-E712 HydrophobicContact CG-CB 4.34Å; Q678-E712 PolarHBondContact NE2-OE2 3.49Å; Q678-Y714 HydrophobicContact CB-CD1 4.11Å; Q678-Y714 HydrophobicContact CB-CE1 3.9Å; Q678-Y714 HydrophobicContact CG-CE1 4.44Å
679	V	81.5	Confident	90.5	Very high	66 Å²	66	65.1 Å²	65.1	40%	0.4	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	130.8	178.7	171.7	0	0	0	0	109.5	S713 E715 I733	V679-S713 WeakPolarHBondContact CG2-O 3.28Å; V679-S713 PolarHBondContact N-O 2.84Å; V679-E715 HydrophobicContact CG2-CG 4.27Å; V679-I733 HydrophobicContact CG2-CG2 4.15Å
680	G	77.8	Confident	90.4	Very high	65 Å²	65	69.9 Å²	69.9	67%	0.67	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.9	-13.1	-177	0	0	0	0	0	115.8	Q678	Q678-G680 PolarHBondContact O-N 2.79Å
681	L	84.9	Confident	90.3	Very high	92 Å²	92	68.4 Å²	68.4	48%	0.482	33%	0.333	S	S	.	.			trans	-87.4	150.6	172	-60.9	-170.8	0	0	0	112	R677 Q678	R677-L681 WeakPolarHBondContact CD-O 3.33Å; R677-L681 PolarHBondContact NH1-O 2.96Å; Q678-L681 HydrophobicContact CB-CD1 3.87Å; Q678-L681 HydrophobicContact CB-CG 4.09Å; Q678-L681 PolarHBondContact O-N 2.65Å
682	Q	82.2	Confident	89.5	Confident	163 Å²	163	70.7 Å²	70.7	76%	0.762	36%	0.358	S	S	*	.			trans	-89.2	-25.1	179.8	-66	-62.6	-16.6	0	0	113.9
683	R	88.9	Confident	88.7	Confident	224 Å²	224	77.4 Å²	77.4	85%	0.845	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-84.6	121.6	-175.4	-175.5	175	-178.2	174.2	1.6	111.2	R677	R677-R683 WeakPolarHBondContact CB-O 3.45Å
684	W	88.5	Confident	88.1	Confident	64 Å²	64	79.1 Å²	79.1	24%	0.242	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-80.9	142.6	164.9	-65	89.6	0	0	0	110.9	R677 E686 E715 R717	R677-W684 HydrophobicContact CB-CD2 4.19Å; R677-W684 HydrophobicContact CB-CE3 4.03Å; R677-W684 HydrophobicContact CB-CZ3 4.41Å; R677-W684 VanDerWaalsContact CD-CE2 3.47Å; R677-W684 HydrophobicContact CG-CD2 3.99Å; R677-W684 HydrophobicContact CG-CE3 3.84Å; R677-W684 HydrophobicContact CG-CH2 3.91Å; R677-W684 HydrophobicContact CG-CZ2 4.05Å; R677-W684 HydrophobicContact CG-CZ3 3.8Å; W684-E686 HydrophobicContact CB-CG 4.26Å; W684-E715 HydrophobicContact CH2-CB 3.93Å; W684-E715 HydrophobicContact CZ3-CB 4.31Å; W684-R717 HydrophobicContact CE3-CB 4.43Å; W684-R717 HydrophobicContact CH2-CB 3.79Å; W684-R717 HydrophobicContact CZ3-CB 3.69Å
685	W	89.6	Confident	87.8	Confident	149 Å²	149	80.2 Å²	80.2	56%	0.564	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.8	136.3	157.7	178.1	89.5	0	0	0	107.6	G675 I676 Q687	G675-W685 CarbonylContact C-O 3.58Å; G675-W685 WeakPolarHBondContact CA-O 3.46Å; I676-W685 HydrophobicContact CB-CE3 4.3Å; I676-W685 HydrophobicContact CD1-CE3 3.71Å; I676-W685 HydrophobicContact CD1-CZ3 3.61Å; I676-W685 HydrophobicContact CG1-CE3 3.99Å; I676-W685 HydrophobicContact CG1-CZ3 4.27Å; I676-W685 PolarHBondContact N-O 3.02Å; I676-W685 PolarHBondContact O-N 3.17Å; W685-Q687 HydrophobicContact CH2-CB 3.8Å; W685-Q687 HydrophobicContact CH2-CG 4.4Å; W685-Q687 VanDerWaalsContact CH2-OE1 3.25Å; W685-Q687 HydrophobicContact CZ3-CB 3.77Å
686	E	92.5	Very high	87.3	Confident	91 Å²	91	81.7 Å²	81.7	43%	0.425	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	140.9	-174.1	-58	-159.3	129.8	0	0	112.5	L674 W684 R717	L674-E686 CarbonylContact O-C 3.58Å; L674-E686 VanDerWaalsContact O-CA 3.31Å; L674-E686 WeakPolarHBondContact O-CA 3.4Å; W684-E686 HydrophobicContact CB-CG 4.26Å; E686-R717 IonicContact OE1-CZ 2.66Å; E686-R717 IonicContact OE1-NH2 3.22Å; E686-R717 PolarHBondContact OE1-NH2 2.95Å
687	Q	92.9	Very high	86.7	Confident	77 Å²	77	87.6 Å²	87.6	36%	0.36	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	148.5	176.8	179.8	178.9	10	0	0	109.1	L674 W685	L674-Q687 PolarHBondContact N-O 3.05Å; L674-Q687 PolarHBondContact O-N 3.38Å; W685-Q687 HydrophobicContact CH2-CB 3.8Å; W685-Q687 HydrophobicContact CH2-CG 4.4Å; W685-Q687 VanDerWaalsContact CH2-OE1 3.25Å; W685-Q687 HydrophobicContact CZ3-CB 3.77Å
688	E	92.9	Very high	86	Confident	98 Å²	98	85.5 Å²	85.5	46%	0.458	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	129.5	169.5	-63.1	-169.1	167.7	0	0	110.7	Y672 R673 P690 I721	Y672-E688 CarbonylContact O-C 3.56Å; Y672-E688 WeakPolarHBondContact O-CA 3.42Å; R673-E688 IonicContact CZ-OE1 3.59Å; R673-E688 IonicContact NE-OE1 2.77Å; R673-E688 PolarHBondContact NE-OE1 3.37Å; R673-E688 VanDerWaalsContact NE-OE1 3.12Å; R673-E688 IonicContact NH2-OE1 3.59Å; R673-E688 PolarHBondContact NH2-OE1 3.37Å; E688-P690 WeakPolarHBondContact O-CD 3.32Å; E688-I721 HydrophobicContact CG-CD1 4.42Å
689	I	93.9	Very high	85.9	Confident	17 Å²	17	87.6 Å²	87.6	9%	0.087	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	104	176.1	-53.2	173.2	0	0	0	106.9	W658 A671 Y672 L674 H703 L718	W658-I689 HydrophobicContact CH2-CD1 3.9Å; A671-I689 CarbonylContact C-O 3.48Å; A671-I689 WeakPolarHBondContact CA-O 3.29Å; A671-I689 WeakPolarHBondContact CB-O 3.41Å; Y672-I689 PolarHBondContact N-O 3.13Å; Y672-I689 PolarHBondContact O-N 2.82Å; L674-I689 HydrophobicContact CB-CD1 3.99Å; L674-I689 HydrophobicContact CB-CG1 4.21Å; L674-I689 HydrophobicContact CD2-CD1 4.14Å; I689-H703 HydrophobicContact CD1-CB 3.95Å; I689-L718 HydrophobicContact CD1-CD1 4.24Å
690	P	92.6	Very high	86.1	Confident	111 Å²	111	87.4 Å²	87.4	72%	0.721	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	148.7	-178.1	28.9	-35.1	0	0	0	112	E688	E688-P690 WeakPolarHBondContact O-CD 3.32Å
691	V	90.9	Very high	86.6	Confident	19 Å²	19	85.7 Å²	85.7	12%	0.115	43%	0.434	C	S	.	.			trans	-122.1	113.7	177.8	-176.8	0	0	0	0	108.8	I669 V670 Y672 D693 I695 M701	I669-V691 HydrophobicContact CG2-CG2 4.22Å; V670-V691 PolarHBondContact O-N 3.17Å; Y672-V691 HydrophobicContact CD2-CG2 3.84Å; Y672-V691 HydrophobicContact CE2-CG2 3.8Å; V691-D693 WeakPolarHBondContact CG1-O 3.29Å; V691-I695 HydrophobicContact CG1-CD1 4Å; V691-I695 HydrophobicContact CG1-CG1 3.9Å; V691-M701 HydrophobicContact CG2-CE 4.07Å
692	G	77.9	Confident	86.8	Confident	59 Å²	59	84.8 Å²	84.8	61%	0.608	43%	0.432	S	S	*	.			trans	-79.7	-49.7	-179.8	0	0	0	0	0	113.2
693	D	79.8	Confident	87.1	Confident	141 Å²	141	78.9 Å²	78.9	75%	0.754	41%	0.405	S	S	*	.	S	Bend	trans	-98.8	170.4	-170.6	-61.1	-62.7	0	0	0	113.5	V691 I695	V691-D693 WeakPolarHBondContact CG1-O 3.29Å; D693-I695 PolarHBondContact O-N 2.88Å
694	T	84.1	Confident	87.1	Confident	107 Å²	107	72.3 Å²	72.3	66%	0.656	39%	0.386	S	S	*	.			trans	-83.8	107.6	179.3	49.3	0	0	0	0	111.8	G696	T694-G696 PolarHBondContact O-N 2.6Å
695	I	88.1	Confident	87	Confident	23 Å²	23	69.5 Å²	69.5	12%	0.118	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-56.9	123.4	179.9	-54	166.8	0	0	0	111.6	Q660 P663 I669 Y672 V691 D693 E699 M701	Q660-I695 HydrophobicContact CB-CG2 4.15Å; P663-I695 HydrophobicContact CB-CB 4.28Å; P663-I695 HydrophobicContact CB-CG2 4.38Å; P663-I695 WeakPolarHBondContact CB-O 3.11Å; P663-I695 WeakPolarHBondContact CG-O 3.48Å; I669-I695 HydrophobicContact CB-CD1 4.17Å; I669-I695 HydrophobicContact CD1-CD1 4.27Å; I669-I695 HydrophobicContact CG2-CD1 4.39Å; Y672-I695 HydrophobicContact CE2-CD1 4.04Å; Y672-I695 WeakPolarHBondContact OH-CD1 3.37Å; V691-I695 HydrophobicContact CG1-CD1 4Å; V691-I695 HydrophobicContact CG1-CG1 3.9Å; D693-I695 PolarHBondContact O-N 2.88Å; I695-E699 WeakPolarHBondContact CA-OE2 3.19Å; I695-E699 HydrophobicContact CG2-CB 4.22Å; I695-M701 HydrophobicContact CD1-CE 4.36Å; I695-M701 HydrophobicContact CD1-SD 3.65Å; I695-M701 HydrophobicContact CG1-SD 4.15Å; I695-M701 HydrophobicContact CG2-SD 4.5Å
696	G	84	Confident	86.7	Confident	31 Å²	31	66.4 Å²	66.4	32%	0.32	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-74.8	151.8	172.6	0	0	0	0	0	113.3	T694 G698 E699	T694-G696 PolarHBondContact O-N 2.6Å; G696-G698 PolarHBondContact O-N 3.07Å; G696-E699 PolarHBondContact N-OE2 2.93Å; G696-E699 VanDerWaalsContact O-CB 3.28Å; G696-E699 WeakPolarHBondContact O-CB 3.28Å; G696-E699 PolarHBondContact O-N 3.02Å; G696-E699 VanDerWaalsContact O-N 3.12Å
697	K	79.5	Confident	86.2	Confident	141 Å²	141	67.8 Å²	67.8	61%	0.613	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	119.3	173.8	-179	167.3	177.8	160.7	0	109.6	N662 P663	N662-K697 PolarHBondContact OD1-NZ 2.93Å; P663-K697 HydrophobicContact CG-CB 4.37Å
698	G	75.1	Confident	85.7	Confident	6 Å²	6	64.5 Å²	64.5	6%	0.062	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	11.9	-175.1	0	0	0	0	0	114.8	S22 G696	S22-G698 PolarHBondContact N-O 2.94Å; S22-G698 PolarHBondContact OG-O 2.93Å; G696-G698 PolarHBondContact O-N 3.07Å
699	E	86.1	Confident	85.1	Confident	95 Å²	95	63.8 Å²	63.8	44%	0.444	36%	0.363	S	S	.	.			trans	-74.1	126.8	170.3	-171.8	-174.5	148.1	0	0	110.9	T659 I695 G696 M701	T659-E699 WeakPolarHBondContact CG2-O 3.39Å; I695-E699 WeakPolarHBondContact CA-OE2 3.19Å; I695-E699 HydrophobicContact CG2-CB 4.22Å; G696-E699 PolarHBondContact N-OE2 2.93Å; G696-E699 VanDerWaalsContact O-CB 3.28Å; G696-E699 WeakPolarHBondContact O-CB 3.28Å; G696-E699 PolarHBondContact O-N 3.02Å; G696-E699 VanDerWaalsContact O-N 3.12Å; E699-M701 PolarHBondContact O-N 3.04Å
700	L	84.9	Confident	84.1	Confident	62 Å²	62	65.6 Å²	65.6	33%	0.325	37%	0.371	S	S	.	.			trans	-91.3	100.6	-174.8	-172.6	57.5	0	0	0	111.5	Y637 Q657 T659	Y637-L700 HydrophobicContact CD2-CD1 3.67Å; Y637-L700 HydrophobicContact CD2-CD2 4.46Å; Y637-L700 HydrophobicContact CE2-CD1 4.45Å; Y637-L700 HydrophobicContact CG-CD1 3.78Å; Q657-L700 HydrophobicContact CB-CD1 4.31Å; T659-L700 HydrophobicContact CG2-CD1 4.33Å
701	M	89.5	Confident	83	Confident	29 Å²	29	64.9 Å²	64.9	14%	0.143	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	149.1	174.9	-59.4	-167.1	73.3	0	0	111.4	Q657 W658 Y672 V691 I695 E699	Q657-M701 WeakPolarHBondContact CA-O 3.32Å; W658-M701 HydrophobicContact CD2-CB 3.84Å; W658-M701 VanDerWaalsContact CE2-CB 3.48Å; W658-M701 HydrophobicContact CE3-CB 4.32Å; W658-M701 HydrophobicContact CG-CB 4.31Å; W658-M701 HydrophobicContact CH2-CB 4.19Å; W658-M701 HydrophobicContact CZ2-CB 3.7Å; W658-M701 HydrophobicContact CZ2-CE 3.95Å; W658-M701 HydrophobicContact CZ2-CG 4.48Å; W658-M701 HydrophobicContact CZ2-SD 4.01Å; W658-M701 HydrophobicContact CZ3-CB 4.48Å; W658-M701 PolarHBondContact N-O 2.98Å; W658-M701 WeakPolarHBondContact O-CB 3.09Å; W658-M701 PolarHBondContact O-N 2.64Å; Y672-M701 HydrophobicContact CD2-CE 4.37Å; Y672-M701 HydrophobicContact CE2-CE 3.72Å; Y672-M701 HydrophobicContact CE2-SD 3.46Å; Y672-M701 WeakPolarHBondContact CE2-SD 3.16Å; Y672-M701 PolarHBondContact OH-SD 2.92Å; Y672-M701 VanDerWaalsContact OH-SD 3.37Å; V691-M701 HydrophobicContact CG2-CE 4.07Å; I695-M701 HydrophobicContact CD1-CE 4.36Å; I695-M701 HydrophobicContact CD1-SD 3.65Å; I695-M701 HydrophobicContact CG1-SD 4.15Å; I695-M701 HydrophobicContact CG2-SD 4.5Å; E699-M701 PolarHBondContact O-N 3.04Å
702	T	88.6	Confident	82.5	Confident	74 Å²	74	67.4 Å²	67.4	45%	0.454	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	141.4	178.7	77.6	0	0	0	0	112	L656 Q657	L656-T702 CarbonylContact O-C 3.48Å; L656-T702 VanDerWaalsContact O-CA 3.28Å; L656-T702 WeakPolarHBondContact O-CA 3.5Å; Q657-T702 HydrophobicContact CG-CG2 3.82Å
703	H	89.5	Confident	82.7	Confident	39 Å²	39	66.3 Å²	66.3	18%	0.181	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	139.7	175	-175.7	82.7	0	0	0	110.7	L656 W658 I689	L656-H703 WeakPolarHBondContact CA-O 3.45Å; L656-H703 WeakPolarHBondContact CB-O 3.49Å; L656-H703 PolarHBondContact N-O 2.86Å; L656-H703 PolarHBondContact O-N 3.4Å; W658-H703 HydrophobicContact CH2-CB 3.78Å; W658-H703 HydrophobicContact CZ3-CB 3.69Å; I689-H703 HydrophobicContact CD1-CB 3.95Å
704	N	88.2	Confident	82.9	Confident	86 Å²	86	60.6 Å²	60.6	46%	0.46	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	108.8	-173.2	-69	-12.2	0	0	0	110.7	L644	L644-N704 HydrophobicContact CD1-CB 3.68Å
705	L	86.9	Confident	83.2	Confident	5 Å²	5	57.2 Å²	57.2	3%	0.026	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	138.5	169.2	-48.2	-178	0	0	0	108.9	G653 F654 L656 L674 I676 L708 V716 I734	G653-L705 CarbonylContact C-O 3.53Å; G653-L705 WeakPolarHBondContact CA-O 3.35Å; F654-L705 HydrophobicContact CB-CB 4.28Å; F654-L705 HydrophobicContact CB-CD1 4.44Å; F654-L705 HydrophobicContact CD1-CD1 4.39Å; F654-L705 PolarHBondContact N-O 3.36Å; F654-L705 WeakPolarHBondContact O-CB 3.24Å; F654-L705 PolarHBondContact O-N 3Å; L656-L705 HydrophobicContact CB-CD1 4.42Å; L656-L705 HydrophobicContact CB-CG 4.29Å; L674-L705 HydrophobicContact CD1-CD2 4.27Å; L674-L705 HydrophobicContact CD2-CD2 3.61Å; I676-L705 HydrophobicContact CD1-CD1 4.47Å; I676-L705 HydrophobicContact CD1-CD2 3.84Å; L705-L708 HydrophobicContact CB-CD1 4.07Å; L705-L708 HydrophobicContact CB-CG 4.49Å; L705-V716 HydrophobicContact CD1-CG2 3.93Å; L705-I734 HydrophobicContact CD1-CD1 3.63Å
706	T	81.9	Confident	83.3	Confident	84 Å²	84	56.1 Å²	56.1	52%	0.515	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	162.5	-179.8	56.8	0	0	0	0	111.4	L708	T706-L708 PolarHBondContact O-N 2.85Å
707	E	82.3	Confident	83.8	Confident	120 Å²	120	57.9 Å²	57.9	56%	0.561	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	66.1	18.1	174.3	-44.5	-156.5	129.2	0	0	115.1	R648	R648-E707 IonicContact NH1-OE1 2.93Å; R648-E707 PolarHBondContact NH1-OE1 2.96Å
708	L	82.6	Confident	84.5	Confident	8 Å²	8	51.1 Å²	51.1	4%	0.042	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	138.3	171	-55.4	177.4	0	0	0	110	V651 Y652 F654 I676 L705 T706 Y714 I734	V651-L708 CarbonylContact C-O 3.54Å; V651-L708 WeakPolarHBondContact CA-O 3.36Å; V651-L708 VanDerWaalsContact CB-O 3.27Å; V651-L708 WeakPolarHBondContact CB-O 3.44Å; Y652-L708 HydrophobicContact CD1-CB 3.71Å; Y652-L708 VanDerWaalsContact CD1-O 3.27Å; Y652-L708 WeakPolarHBondContact CD1-O 3.45Å; Y652-L708 HydrophobicContact CD2-CD1 4.46Å; Y652-L708 HydrophobicContact CE1-CB 3.41Å; Y652-L708 VanDerWaalsContact CE1-CB 3.41Å; Y652-L708 HydrophobicContact CE1-CD1 4.36Å; Y652-L708 HydrophobicContact CE2-CB 4.3Å; Y652-L708 HydrophobicContact CE2-CD1 3.87Å; Y652-L708 HydrophobicContact CG-CB 4.27Å; Y652-L708 PolarHBondContact N-O 2.83Å; Y652-L708 PolarHBondContact O-N 3.09Å; F654-L708 HydrophobicContact CB-CD1 3.75Å; I676-L708 HydrophobicContact CG2-CD2 4.43Å; L705-L708 HydrophobicContact CB-CD1 4.07Å; L705-L708 HydrophobicContact CB-CG 4.49Å; T706-L708 PolarHBondContact O-N 2.85Å; L708-Y714 HydrophobicContact CB-CD2 4.27Å; L708-Y714 HydrophobicContact CB-CE2 3.84Å; L708-Y714 HydrophobicContact CD2-CD1 4.09Å; L708-Y714 HydrophobicContact CD2-CD2 4.05Å; L708-Y714 HydrophobicContact CD2-CE1 4.15Å; L708-Y714 HydrophobicContact CD2-CE2 4.1Å; L708-Y714 HydrophobicContact CD2-CG 4.05Å; L708-Y714 HydrophobicContact CG-CE2 4.49Å; L708-I734 HydrophobicContact CD1-CD1 3.62Å
709	I	81.4	Confident	85.5	Confident	82 Å²	82	51.2 Å²	51.2	42%	0.421	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	137.9	-172.7	-60.1	170.1	0	0	0	110.7	Y652 E712 Y714	Y652-I709 WeakPolarHBondContact CE1-O 3.46Å; I709-E712 HydrophobicContact CB-CG 4.21Å; I709-E712 HydrophobicContact CG2-CG 4.11Å; I709-E712 WeakPolarHBondContact O-CB 3.49Å; I709-E712 PolarHBondContact O-N 2.77Å; I709-Y714 WeakPolarHBondContact CB-OH 3.49Å; I709-Y714 PolarHBondContact N-OH 2.9Å
710	K	72.5	Confident	86	Confident	56 Å²	56	46.7 Å²	46.7	24%	0.243	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	139.2	172.6	-60.6	174.9	178.9	157.4	0	110.8	R648 P649 R650 V651 Y652 Y736	R648-K710 PolarHBondContact O-NZ 3.3Å; P649-K710 PolarHBondContact O-NZ 2.81Å; R650-K710 PolarHBondContact O-N 2.95Å; V651-K710 WeakPolarHBondContact O-CE 3.16Å; V651-K710 PolarHBondContact O-NZ 2.91Å; Y652-K710 HydrophobicContact CD1-CG 3.95Å; K710-Y736 HydrophobicContact CB-CD1 4.42Å; K710-Y736 HydrophobicContact CB-CE1 4.44Å; K710-Y736 HydrophobicContact CB-CG 4.49Å; K710-Y736 HydrophobicContact CD-CD2 4.41Å; K710-Y736 HydrophobicContact CD-CE1 4.26Å; K710-Y736 HydrophobicContact CD-CE2 3.75Å; K710-Y736 HydrophobicContact CG-CD1 4.4Å; K710-Y736 HydrophobicContact CG-CD2 3.84Å; K710-Y736 HydrophobicContact CG-CE1 4.26Å; K710-Y736 HydrophobicContact CG-CE2 3.69Å; K710-Y736 HydrophobicContact CG-CG 4.19Å
711	P	70.1	Confident	86.4	Confident	95 Å²	95	44.9 Å²	44.9	62%	0.617	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	cis	-95.3	23.9	-1.5	40.3	-35.5	0	0	0	112.7	Y736	P711-Y736 HydrophobicContact CB-CD1 4.16Å
712	E	80.4	Confident	86.5	Confident	72 Å²	72	43.8 Å²	43.8	34%	0.336	23%	0.23	S	C	.	.			trans	-62.9	151.4	-166.1	-61.1	-60.1	145.8	0	0	113.2	Y652 Q678 I709 Y714	Y652-E712 PolarHBondContact OH-O 2.94Å; Q678-E712 HydrophobicContact CG-CB 4.34Å; Q678-E712 PolarHBondContact NE2-OE2 3.49Å; I709-E712 HydrophobicContact CB-CG 4.21Å; I709-E712 HydrophobicContact CG2-CG 4.11Å; I709-E712 WeakPolarHBondContact O-CB 3.49Å; I709-E712 PolarHBondContact O-N 2.77Å; E712-Y714 HydrophobicContact CB-CE2 3.82Å
713	S	81.4	Confident	86.4	Confident	37 Å²	37	48.4 Å²	48.4	26%	0.259	24%	0.239	S	C	.	.			trans	-105.6	146.2	174.2	-60.7	0	0	0	0	110.4	V679 I734	V679-S713 WeakPolarHBondContact CG2-O 3.28Å; V679-S713 PolarHBondContact N-O 2.84Å; S713-I734 CarbonylContact C-O 3.5Å; S713-I734 WeakPolarHBondContact CA-O 3.38Å
714	Y	84.8	Confident	86.3	Confident	21 Å²	21	49.8 Å²	49.8	8%	0.082	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	136.4	-174.3	-67.9	-97.5	0	0	0	110.7	Y652 I676 R677 Q678 L708 I709 E712 I733 I734	Y652-Y714 HydrophobicContact CE1-CE2 4.45Å; I676-Y714 HydrophobicContact CG2-CD1 3.93Å; I676-Y714 HydrophobicContact CG2-CG 4.44Å; R677-Y714 CarbonylContact O-C 3.46Å; R677-Y714 WeakPolarHBondContact O-CA 3.19Å; R677-Y714 WeakPolarHBondContact O-CB 3.46Å; Q678-Y714 HydrophobicContact CB-CD1 4.11Å; Q678-Y714 HydrophobicContact CB-CE1 3.9Å; Q678-Y714 HydrophobicContact CG-CE1 4.44Å; L708-Y714 HydrophobicContact CB-CD2 4.27Å; L708-Y714 HydrophobicContact CB-CE2 3.84Å; L708-Y714 HydrophobicContact CD2-CD1 4.09Å; L708-Y714 HydrophobicContact CD2-CD2 4.05Å; L708-Y714 HydrophobicContact CD2-CE1 4.15Å; L708-Y714 HydrophobicContact CD2-CE2 4.1Å; L708-Y714 HydrophobicContact CD2-CG 4.05Å; L708-Y714 HydrophobicContact CG-CE2 4.49Å; I709-Y714 WeakPolarHBondContact CB-OH 3.49Å; I709-Y714 PolarHBondContact N-OH 2.9Å; E712-Y714 HydrophobicContact CB-CE2 3.82Å; Y714-I733 CarbonylContact O-C 3.54Å; Y714-I733 WeakPolarHBondContact O-CA 3.37Å; Y714-I734 PolarHBondContact N-O 2.81Å; Y714-I734 WeakPolarHBondContact O-CG1 3.31Å; Y714-I734 PolarHBondContact O-N 2.94Å
715	E	89.6	Confident	86.3	Confident	35 Å²	35	47.1 Å²	47.1	16%	0.164	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	131.5	162.4	-75.1	173.1	-135.4	0	0	109.4	I676 R677 V679 W684 I733	I676-E715 WeakPolarHBondContact CA-O 3.38Å; R677-E715 HydrophobicContact CG-CB 3.86Å; R677-E715 IonicContact CZ-OE1 2.84Å; R677-E715 IonicContact CZ-OE2 2.7Å; R677-E715 PolarHBondContact N-O 2.9Å; R677-E715 VanDerWaalsContact NE-CD 3.32Å; R677-E715 IonicContact NE-OE1 2.88Å; R677-E715 PolarHBondContact NE-OE1 3.47Å; R677-E715 IonicContact NE-OE2 3.04Å; R677-E715 PolarHBondContact NE-OE2 3.34Å; R677-E715 VanDerWaalsContact NH2-CD 3.31Å; R677-E715 IonicContact NH2-OE1 3.27Å; R677-E715 PolarHBondContact NH2-OE1 2.82Å; R677-E715 VanDerWaalsContact NH2-OE1 3.14Å; R677-E715 IonicContact NH2-OE2 2.73Å; R677-E715 PolarHBondContact NH2-OE2 2.65Å; R677-E715 PolarHBondContact O-N 3.39Å; V679-E715 HydrophobicContact CG2-CG 4.27Å; W684-E715 HydrophobicContact CH2-CB 3.93Å; W684-E715 HydrophobicContact CZ3-CB 4.31Å; E715-I733 HydrophobicContact CG-CG1 3.99Å
716	V	90.4	Very high	86.6	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	114.7	175.1	-176.1	0	0	0	0	108.4	F636 L656 L674 G675 L705 V731 R732 I734	F636-V716 HydrophobicContact CZ-CG1 4.14Å; L656-V716 HydrophobicContact CD1-CB 4.45Å; L656-V716 HydrophobicContact CD1-CG1 3.92Å; L656-V716 HydrophobicContact CD2-CG1 3.74Å; L674-V716 HydrophobicContact CD1-CG1 3.48Å; L674-V716 VanDerWaalsContact CD1-CG1 3.48Å; G675-V716 CarbonylContact O-C 3.53Å; G675-V716 WeakPolarHBondContact O-CA 3.39Å; L705-V716 HydrophobicContact CD1-CG2 3.93Å; V716-V731 CarbonylContact O-C 3.57Å; V716-V731 WeakPolarHBondContact O-CA 3.26Å; V716-R732 PolarHBondContact N-O 3.4Å; V716-R732 PolarHBondContact O-N 3.05Å; V716-I734 HydrophobicContact CG2-CD1 3.71Å; V716-I734 HydrophobicContact CG2-CG1 3.89Å; V716-I734 HydrophobicContact CG2-CG2 4.06Å
717	R	93.9	Very high	87.1	Confident	68 Å²	68	47.2 Å²	47.2	26%	0.257	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	137.4	170.4	177.5	170.7	69.2	-178.4	2.3	109	L674 G675 W684 E686 T730 V731	L674-R717 WeakPolarHBondContact CA-O 3.44Å; G675-R717 PolarHBondContact N-O 2.8Å; G675-R717 PolarHBondContact O-N 2.77Å; W684-R717 HydrophobicContact CE3-CB 4.43Å; W684-R717 HydrophobicContact CH2-CB 3.79Å; W684-R717 HydrophobicContact CZ3-CB 3.69Å; E686-R717 IonicContact OE1-CZ 2.66Å; E686-R717 IonicContact OE1-NH2 3.22Å; E686-R717 PolarHBondContact OE1-NH2 2.95Å; R717-T730 CarbonylContact C-O 3.56Å; R717-T730 WeakPolarHBondContact CA-O 3.39Å; R717-V731 HydrophobicContact CB-CG2 4.14Å; R717-V731 HydrophobicContact CG-CG2 4.17Å
718	L	95.3	Very high	87.6	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	118.6	172.3	-164.2	70.7	0	0	0	110.1	P634 F636 W658 Y672 R673 L674 I689 S729 T730	P634-L718 HydrophobicContact CB-CD2 3.97Å; P634-L718 HydrophobicContact CG-CB 3.95Å; P634-L718 HydrophobicContact CG-CD2 3.89Å; P634-L718 HydrophobicContact CG-CG 3.98Å; P634-L718 VanDerWaalsContact CG-O 3.28Å; P634-L718 WeakPolarHBondContact CG-O 3.49Å; F636-L718 HydrophobicContact CE1-CB 4.18Å; F636-L718 HydrophobicContact CE1-CD2 4.08Å; F636-L718 HydrophobicContact CZ-CB 3.74Å; F636-L718 HydrophobicContact CZ-CD2 4.48Å; W658-L718 HydrophobicContact CB-CD2 4.49Å; W658-L718 HydrophobicContact CD2-CD2 3.48Å; W658-L718 VanDerWaalsContact CD2-CD2 3.48Å; W658-L718 VanDerWaalsContact CE2-CD2 3.5Å; W658-L718 HydrophobicContact CE3-CD2 4Å; W658-L718 HydrophobicContact CG-CD2 3.7Å; W658-L718 HydrophobicContact CH2-CD2 4.5Å; W658-L718 HydrophobicContact CZ2-CD2 4.03Å; W658-L718 HydrophobicContact CZ3-CD2 4.48Å; Y672-L718 HydrophobicContact CD1-CD1 4.41Å; Y672-L718 HydrophobicContact CD1-CD2 4.06Å; Y672-L718 HydrophobicContact CD1-CG 3.91Å; Y672-L718 HydrophobicContact CG-CD1 4.29Å; Y672-L718 HydrophobicContact CG-CD2 4.47Å; Y672-L718 HydrophobicContact CG-CG 4.29Å; R673-L718 WeakPolarHBondContact O-CA 3.12Å; L674-L718 HydrophobicContact CB-CD1 4.15Å; L674-L718 HydrophobicContact CD1-CD1 4.28Å; I689-L718 HydrophobicContact CD1-CD1 4.24Å; L718-S729 WeakPolarHBondContact O-CA 3.49Å; L718-T730 PolarHBondContact N-O 3.43Å; L718-T730 PolarHBondContact O-N 3.03Å
719	T	95.3	Very high	88	Confident	8 Å²	8	45.7 Å²	45.7	5%	0.049	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	125.4	-178.2	-46.9	0	0	0	0	109.6	Y672 R673 E726 G727 S729	Y672-T719 CarbonylContact C-O 3.58Å; Y672-T719 VanDerWaalsContact CA-O 3.26Å; Y672-T719 WeakPolarHBondContact CA-O 3.31Å; R673-T719 PolarHBondContact N-O 2.86Å; R673-T719 PolarHBondContact O-N 2.91Å; T719-E726 HydrophobicContact CG2-CB 3.82Å; T719-E726 HydrophobicContact CG2-CG 4.03Å; T719-G727 WeakPolarHBondContact CG2-O 3.47Å; T719-S729 VanDerWaalsContact OG1-CB 3.22Å; T719-S729 WeakPolarHBondContact OG1-CB 3.05Å
720	P	95.6	Very high	88.2	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	135.1	178.6	29.7	-27.1	0	0	0	110.2	A631 Y632 I669 Y672 G727 D728	A631-P720 HydrophobicContact CB-CB 4.06Å; A631-P720 HydrophobicContact CB-CG 3.82Å; Y632-P720 WeakPolarHBondContact O-CG 3.27Å; I669-P720 HydrophobicContact CD1-CB 3.72Å; I669-P720 HydrophobicContact CG1-CB 4.2Å; Y672-P720 HydrophobicContact CD1-CB 3.96Å; Y672-P720 HydrophobicContact CE1-CB 3.83Å; P720-G727 PolarHBondContact O-N 3.12Å; P720-D728 WeakPolarHBondContact CD-O 3.33Å
721	I	94.1	Very high	88.9	Confident	23 Å²	23	44.2 Å²	44.2	12%	0.118	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	126.4	176.3	-59.2	170.7	0	0	0	109.1	I669 V670 A671 R673 E688 E726	I669-I721 CarbonylContact C-O 3.58Å; I669-I721 WeakPolarHBondContact CA-O 3.34Å; V670-I721 HydrophobicContact CG2-CG2 4.03Å; V670-I721 WeakPolarHBondContact CG2-O 3.08Å; V670-I721 PolarHBondContact N-O 3.15Å; A671-I721 HydrophobicContact CB-CB 4.4Å; A671-I721 HydrophobicContact CB-CD1 4.21Å; A671-I721 WeakPolarHBondContact O-CB 3.42Å; A671-I721 PolarHBondContact O-N 2.95Å; R673-I721 HydrophobicContact CB-CD1 4.13Å; E688-I721 HydrophobicContact CG-CD1 4.42Å; I721-E726 HydrophobicContact CG1-CG 4.48Å
722	T	91.5	Very high	89.5	Confident	6 Å²	6	40.9 Å²	40.9	4%	0.037	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	-174.4	170.6	78.5	0	0	0	0	110.3	A631 V666 D667 I669 F724 G725	A631-T722 HydrophobicContact CB-CG2 3.74Å; V666-T722 HydrophobicContact CG2-CG2 4.15Å; D667-T722 WeakPolarHBondContact O-CG2 3.28Å; I669-T722 HydrophobicContact CG1-CG2 4.03Å; T722-F724 PolarHBondContact O-N 3.44Å; T722-F724 WeakPolarHBondContact OG1-CB 3.33Å; T722-F724 PolarHBondContact OG1-N 2.75Å; T722-F724 VanDerWaalsContact OG1-N 3.09Å; T722-G725 PolarHBondContact N-O 2.57Å; T722-G725 PolarHBondContact O-N 2.68Å; T722-G725 VanDerWaalsContact O-N 3.12Å
723	R	85.9	Confident	89.5	Confident	172 Å²	172	42.2 Å²	42.2	65%	0.649	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-11.4	171.3	-69.6	177.4	169.4	178.5	-4	114.5	D667	D667-R723 HydrophobicContact CB-CB 4.36Å; D667-R723 WeakPolarHBondContact OD2-CB 3.26Å
724	F	87.1	Confident	89.5	Confident	68 Å²	68	40.6 Å²	40.6	30%	0.298	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-35.9	168.7	175.1	-90.3	0	0	0	111.4	W607 G629 K630 T722	W607-F724 HydrophobicContact CB-CE2 4.47Å; W607-F724 AromaticContact CD2-CD2 3.71Å; W607-F724 HydrophobicContact CD2-CD2 3.71Å; W607-F724 AromaticContact CD2-CE2 3.7Å; W607-F724 HydrophobicContact CD2-CE2 3.7Å; W607-F724 AromaticContact CE2-CD2 3.74Å; W607-F724 AromaticContact CE3-CD2 3.63Å; W607-F724 HydrophobicContact CE3-CD2 3.63Å; W607-F724 AromaticContact CE3-CE2 3.72Å; W607-F724 HydrophobicContact CE3-CE2 3.72Å; W607-F724 HydrophobicContact CG-CD2 4.46Å; W607-F724 HydrophobicContact CG-CE2 4.06Å; W607-F724 HydrophobicContact CH2-CB 4.27Å; W607-F724 AromaticContact CH2-CD2 3.62Å; W607-F724 HydrophobicContact CH2-CD2 3.62Å; W607-F724 HydrophobicContact CH2-CG 4.43Å; W607-F724 AromaticContact CZ2-CD2 3.71Å; W607-F724 HydrophobicContact CZ2-CD2 3.71Å; W607-F724 AromaticContact CZ3-CD2 3.58Å; W607-F724 HydrophobicContact CZ3-CD2 3.58Å; W607-F724 HydrophobicContact CZ3-CE2 4.13Å; G629-F724 VanDerWaalsContact C-CG 3.43Å; G629-F724 WeakPolarHBondContact O-CB 3.27Å; K630-F724 HydrophobicContact CB-CE1 4.4Å; K630-F724 HydrophobicContact CG-CD1 4.07Å; K630-F724 HydrophobicContact CG-CE1 3.48Å; K630-F724 VanDerWaalsContact CG-CE1 3.48Å; K630-F724 HydrophobicContact CG-CZ 4.14Å; T722-F724 PolarHBondContact O-N 3.44Å; T722-F724 WeakPolarHBondContact OG1-CB 3.33Å; T722-F724 PolarHBondContact OG1-N 2.75Å; T722-F724 VanDerWaalsContact OG1-N 3.09Å
725	G	89.6	Confident	88.7	Confident	29 Å²	29	43.3 Å²	43.3	30%	0.299	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	131.3	-149	-168.6	0	0	0	0	0	110.5	T722	T722-G725 PolarHBondContact N-O 2.57Å; T722-G725 PolarHBondContact O-N 2.68Å; T722-G725 VanDerWaalsContact O-N 3.12Å
726	E	92.9	Very high	87.5	Confident	86 Å²	86	44.8 Å²	44.8	40%	0.402	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	128.3	173.4	-68.9	-177.4	135	0	0	111.4	R673 T719 I721	R673-E726 WeakPolarHBondContact CD-OE1 3.48Å; R673-E726 IonicContact CZ-OE1 3.1Å; R673-E726 IonicContact NE-OE1 2.71Å; R673-E726 VanDerWaalsContact NH1-CD 3.35Å; R673-E726 IonicContact NH1-OE1 2.78Å; R673-E726 PolarHBondContact NH1-OE1 3.15Å; R673-E726 IonicContact NH1-OE2 2.68Å; T719-E726 HydrophobicContact CG2-CB 3.82Å; T719-E726 HydrophobicContact CG2-CG 4.03Å; I721-E726 HydrophobicContact CG1-CG 4.48Å
727	G	92.3	Very high	85.7	Confident	5 Å²	5	47.3 Å²	47.3	5%	0.052	25%	0.246	C	C	.	.			trans	-79.4	-161.7	161.8	0	0	0	0	0	111.7	A631 T719 P720	A631-G727 WeakPolarHBondContact O-CA 3.29Å; T719-G727 WeakPolarHBondContact CG2-O 3.47Å; P720-G727 PolarHBondContact O-N 3.12Å
728	D	92.4	Very high	83.5	Confident	35 Å²	35	47.2 Å²	47.2	19%	0.187	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-81.6	135.5	-176	-58.2	-50.3	0	0	0	111.6	R550 K630 A631 P633 P720	R550-D728 IonicContact CZ-OD2 2.71Å; R550-D728 IonicContact NE-OD2 3.24Å; R550-D728 PolarHBondContact NE-OD2 2.78Å; R550-D728 IonicContact NH2-OD2 3.92Å; R550-D728 PolarHBondContact NH2-OD2 2.71Å; K630-D728 WeakPolarHBondContact CD-OD1 3.33Å; K630-D728 IonicContact NZ-OD1 2.93Å; K630-D728 PolarHBondContact NZ-OD1 3.36Å; A631-D728 PolarHBondContact O-N 3.23Å; P633-D728 VanDerWaalsContact CA-O 3.26Å; P633-D728 WeakPolarHBondContact CA-O 3.26Å; P633-D728 HydrophobicContact CB-CB 4.31Å; P633-D728 WeakPolarHBondContact CB-O 3.29Å; P720-D728 WeakPolarHBondContact CD-O 3.33Å
729	S	91.4	Very high	81.1	Confident	61 Å²	61	48.8 Å²	48.8	43%	0.427	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-90.2	136.3	-174.7	68.1	0	0	0	0	112.4	L718 T719	L718-S729 WeakPolarHBondContact O-CA 3.49Å; T719-S729 VanDerWaalsContact OG1-CB 3.22Å; T719-S729 WeakPolarHBondContact OG1-CB 3.05Å
730	T	85.9	Confident	78.6	Confident	34 Å²	34	54 Å²	54	21%	0.209	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	150.2	170.4	-129.1	0	0	0	0	110	P634 F636 R717 L718	P634-T730 HydrophobicContact CG-CG2 3.88Å; P634-T730 WeakPolarHBondContact O-CB 3.35Å; P634-T730 VanDerWaalsContact O-CG2 3.27Å; P634-T730 WeakPolarHBondContact O-CG2 3.38Å; P634-T730 PolarHBondContact O-OG1 3.42Å; F636-T730 HydrophobicContact CD2-CG2 3.27Å; F636-T730 HydrophobicContact CE2-CG2 3.19Å; F636-T730 HydrophobicContact CG-CG2 4.05Å; F636-T730 HydrophobicContact CZ-CG2 3.87Å; R717-T730 CarbonylContact C-O 3.56Å; R717-T730 WeakPolarHBondContact CA-O 3.39Å; L718-T730 PolarHBondContact N-O 3.43Å; L718-T730 PolarHBondContact O-N 3.03Å
731	V	86.8	Confident	75.9	Confident	74 Å²	74	57.9 Å²	57.9	45%	0.448	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	140.5	179.4	-175.3	0	0	0	0	110.9	V716 R717	V716-V731 CarbonylContact O-C 3.57Å; V716-V731 WeakPolarHBondContact O-CA 3.26Å; R717-V731 HydrophobicContact CB-CG2 4.14Å; R717-V731 HydrophobicContact CG-CG2 4.17Å
732	R	83.3	Confident	73.5	Confident	25 Å²	25	60.7 Å²	60.7	9%	0.094	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	137.4	175.6	167.9	176.7	-178.7	176	5	110.2	F636 Y637 Y638 V716 I734	F636-R732 HydrophobicContact CD2-CB 3.27Å; F636-R732 HydrophobicContact CD2-CG 4.26Å; F636-R732 HydrophobicContact CE2-CB 3.42Å; F636-R732 VanDerWaalsContact CE2-CB 3.42Å; F636-R732 HydrophobicContact CG-CB 4.07Å; F636-R732 HydrophobicContact CZ-CB 4.33Å; Y637-R732 PolarHBondContact O-NH1 2.94Å; Y638-R732 HydrophobicContact CE1-CG 4.01Å; V716-R732 PolarHBondContact N-O 3.4Å; V716-R732 PolarHBondContact O-N 3.05Å; R732-I734 HydrophobicContact CG-CG2 4.12Å
733	I	79.9	Confident	71.2	Confident	100 Å²	100	66.5 Å²	66.5	51%	0.513	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	130.4	163.3	-60.4	171.6	0	0	0	108	V679 Y714 E715 T735	V679-I733 HydrophobicContact CG2-CG2 4.15Å; Y714-I733 CarbonylContact O-C 3.54Å; Y714-I733 WeakPolarHBondContact O-CA 3.37Å; E715-I733 HydrophobicContact CG-CG1 3.99Å; I733-T735 HydrophobicContact CG2-CG2 4.24Å
734	I	80.8	Confident	69.6	Low	2 Å²	2	59.7 Å²	59.7	1%	0.01	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	139.3	167.8	67.3	171.7	0	0	0	108.5	F654 L705 L708 S713 Y714 V716 R732	F654-I734 HydrophobicContact CB-CD1 3.97Å; F654-I734 HydrophobicContact CD1-CB 4.4Å; F654-I734 HydrophobicContact CD1-CD1 3.97Å; F654-I734 HydrophobicContact CD1-CG2 4.04Å; F654-I734 HydrophobicContact CD2-CB 4.1Å; F654-I734 HydrophobicContact CD2-CD1 4.19Å; F654-I734 HydrophobicContact CE1-CB 4.16Å; F654-I734 HydrophobicContact CE1-CG2 3.52Å; F654-I734 HydrophobicContact CE2-CB 3.81Å; F654-I734 HydrophobicContact CE2-CG2 4.03Å; F654-I734 HydrophobicContact CG-CB 4.38Å; F654-I734 HydrophobicContact CG-CD1 3.78Å; F654-I734 HydrophobicContact CZ-CB 3.84Å; F654-I734 HydrophobicContact CZ-CG2 3.51Å; L705-I734 HydrophobicContact CD1-CD1 3.63Å; L708-I734 HydrophobicContact CD1-CD1 3.62Å; S713-I734 CarbonylContact C-O 3.5Å; S713-I734 WeakPolarHBondContact CA-O 3.38Å; Y714-I734 PolarHBondContact N-O 2.81Å; Y714-I734 WeakPolarHBondContact O-CG1 3.31Å; Y714-I734 PolarHBondContact O-N 2.94Å; V716-I734 HydrophobicContact CG2-CD1 3.71Å; V716-I734 HydrophobicContact CG2-CG1 3.89Å; V716-I734 HydrophobicContact CG2-CG2 4.06Å; R732-I734 HydrophobicContact CG-CG2 4.12Å
735	T	68.1	Low	67.9	Low	78 Å²	78	66.4 Å²	66.4	48%	0.479	36%	0.362	S	S	.	.			trans	-118.5	157.3	-177.8	59.2	0	0	0	0	109.8	I733 S737	I733-T735 HydrophobicContact CG2-CG2 4.24Å; T735-S737 PolarHBondContact O-N 2.73Å
736	Y	64.3	Low	66.5	Low	66 Å²	66	71.4 Å²	71.4	26%	0.259	38%	0.378	S	S	.	.			trans	-76.9	118	168.3	175.1	-111.3	0	0	0	110.3	Y652 K710 P711	Y652-Y736 AromaticContact CD1-CD2 3.74Å; Y652-Y736 HydrophobicContact CD1-CD2 3.74Å; Y652-Y736 HydrophobicContact CD1-CG 4.4Å; Y652-Y736 AromaticContact CD2-CD2 3.92Å; Y652-Y736 HydrophobicContact CD2-CD2 3.92Å; Y652-Y736 HydrophobicContact CE1-CD2 4.15Å; Y652-Y736 HydrophobicContact CE1-CG 4.45Å; Y652-Y736 HydrophobicContact CE2-CD2 4.32Å; Y652-Y736 AromaticContact CG-CD2 3.64Å; Y652-Y736 HydrophobicContact CG-CD2 3.64Å; Y652-Y736 HydrophobicContact CG-CE2 4.21Å; K710-Y736 HydrophobicContact CB-CD1 4.42Å; K710-Y736 HydrophobicContact CB-CE1 4.44Å; K710-Y736 HydrophobicContact CB-CG 4.49Å; K710-Y736 HydrophobicContact CD-CD2 4.41Å; K710-Y736 HydrophobicContact CD-CE1 4.26Å; K710-Y736 HydrophobicContact CD-CE2 3.75Å; K710-Y736 HydrophobicContact CG-CD1 4.4Å; K710-Y736 HydrophobicContact CG-CD2 3.84Å; K710-Y736 HydrophobicContact CG-CE1 4.26Å; K710-Y736 HydrophobicContact CG-CE2 3.69Å; K710-Y736 HydrophobicContact CG-CG 4.19Å; P711-Y736 HydrophobicContact CB-CD1 4.16Å
737	S	53.6	Low	65.7	Low	53 Å²	53	69 Å²	69	37%	0.371	37%	0.367	S	S	.	.			trans	-115	144.4	160.2	55.1	0	0	0	0	109.7	P643 T735 P739	P643-S737 VanDerWaalsContact CG-OG 3.23Å; P643-S737 WeakPolarHBondContact CG-OG 3.47Å; T735-S737 PolarHBondContact O-N 2.73Å; S737-P739 WeakPolarHBondContact O-CD 3.33Å
738	A	47.4	Very low	65.1	Low	66 Å²	66	73.6 Å²	73.6	55%	0.545	39%	0.386	S	S	.	.			trans	-67.7	129.4	-171.2	0	0	0	0	0	111.7	Y641 I740	Y641-A738 PolarHBondContact OH-O 3.47Å; A738-I740 PolarHBondContact O-N 2.89Å; A738-I740 VanDerWaalsContact O-N 3.15Å
739	P	44	Very low	64.7	Low	33 Å²	33	72 Å²	72	21%	0.214	38%	0.378	C	S	.	.			trans	-62.3	111.2	171.1	-24.9	36	0	0	0	111.9	Y641 P643 W645 S737 N741	Y641-P739 VanDerWaalsContact OH-CA 3.31Å; Y641-P739 WeakPolarHBondContact OH-CA 3.43Å; P643-P739 HydrophobicContact CB-CG 4.43Å; W645-P739 HydrophobicContact CB-CB 4.49Å; S737-P739 WeakPolarHBondContact O-CD 3.33Å; P739-N741 PolarHBondContact O-N 3.42Å
740	I	43	Very low	64.3	Low	117 Å²	117	71 Å²	71	60%	0.6	37%	0.371	S	S	*	.			trans	-63.1	119	161.7	-58.3	176.6	0	0	0	106.1	A738 P742 M758	A738-I740 PolarHBondContact O-N 2.89Å; A738-I740 VanDerWaalsContact O-N 3.15Å; I740-P742 WeakPolarHBondContact O-CD 3.33Å; I740-M758 HydrophobicContact CD1-CE 4.01Å; I740-M758 HydrophobicContact CD1-CG 4.45Å
741	N	39.8	Very low	64.2	Low	82 Å²	82	69.4 Å²	69.4	44%	0.439	36%	0.361	S	S	.	.			trans	-98.5	108.4	-165.2	-179.2	12.6	0	0	0	111.4	W645 P739 H743	W645-N741 VanDerWaalsContact NE1-CG 3.34Å; W645-N741 PolarHBondContact NE1-OD1 2.85Å; W645-N741 VanDerWaalsContact NE1-OD1 3.13Å; P739-N741 PolarHBondContact O-N 3.42Å; N741-H743 PolarHBondContact O-N 2.87Å; N741-H743 VanDerWaalsContact O-N 3.09Å; N741-H743 PolarHBondContact OD1-N 2.82Å
742	P	43	Very low	63.9	Low	82 Å²	82	69.8 Å²	69.8	53%	0.532	36%	0.358	S	S	.	.			trans	-81	20	-176.3	35.7	-37.7	0	0	0	114.1	I740 L744	I740-P742 WeakPolarHBondContact O-CD 3.33Å; P742-L744 PolarHBondContact O-N 2.77Å
743	H	44.1	Very low	63.1	Low	128 Å²	128	75.5 Å²	75.5	59%	0.593	39%	0.386	S	S	*	.			trans	-82.3	83.2	165.6	-84.2	-70.8	0	0	0	110.2	W645 N741 R745	W645-H743 AromaticContact CH2-CD2 3.96Å; W645-H743 AromaticContact CH2-NE2 3.99Å; W645-H743 AromaticContact CZ2-CD2 3.79Å; N741-H743 PolarHBondContact O-N 2.87Å; N741-H743 VanDerWaalsContact O-N 3.09Å; N741-H743 PolarHBondContact OD1-N 2.82Å; H743-R745 PolarHBondContact O-N 2.87Å
744	L	51.4	Low	61.9	Low	29 Å²	29	78 Å²	78	15%	0.152	40%	0.396	C	S	.	.			trans	-52	117.4	174	-80.1	165.9	0	0	0	111.7	P742 F747 F821 Y837 L916	P742-L744 PolarHBondContact O-N 2.77Å; L744-F747 HydrophobicContact CD2-CB 3.67Å; L744-F821 HydrophobicContact CD1-CB 3.95Å; L744-F821 HydrophobicContact CD1-CD1 3.84Å; L744-F821 HydrophobicContact CD1-CG 4.14Å; L744-F821 HydrophobicContact CD2-CD1 4.35Å; L744-F821 HydrophobicContact CG-CD1 4.34Å; L744-Y837 HydrophobicContact CB-CE1 4.42Å; L744-Y837 HydrophobicContact CD1-CD1 4.37Å; L744-Y837 HydrophobicContact CD1-CE1 3.92Å; L744-L916 HydrophobicContact CD1-CD2 4.08Å; L744-L916 HydrophobicContact CD2-CD2 4.28Å; L744-L916 HydrophobicContact CD2-CG 4.45Å
745	R	52.2	Low	61.2	Low	209 Å²	209	81.2 Å²	81.2	79%	0.789	42%	0.416	S	S	*	.	S	Bend	trans	-106.5	-36.9	133.7	-76.8	-174.6	169.2	-175.3	-3.6	110.3	H743 E917 E918	H743-R745 PolarHBondContact O-N 2.87Å; R745-E917 WeakPolarHBondContact O-CA 3.46Å; R745-E918 PolarHBondContact O-N 3.49Å
746	E	59.7	Low	61.6	Low	134 Å²	134	78.8 Å²	78.8	63%	0.626	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.3	137.8	-176.7	-174	174	-174	0	0	107.9	L916 E917	E746-L916 CarbonylContact C-O 3.57Å; E746-L916 WeakPolarHBondContact CA-O 3.17Å; E746-E917 HydrophobicContact CG-CG 4.4Å
747	F	77.3	Confident	62.3	Low	37 Å²	37	77.6 Å²	77.6	16%	0.162	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	142.5	167	162.1	-87	0	0	0	107.4	L744 C749 C757 F759 P819 F821 I914 T915 L916	L744-F747 HydrophobicContact CD2-CB 3.67Å; F747-C749 HydrophobicContact CE1-CB 4.01Å; F747-C749 HydrophobicContact CZ-CB 3.99Å; F747-C757 HydrophobicContact CZ-CB 4.17Å; F747-F759 HydrophobicContact CE1-CE2 4.16Å; F747-F759 AromaticContact CZ-CE2 3.97Å; F747-F759 HydrophobicContact CZ-CE2 3.97Å; F747-P819 HydrophobicContact CE2-CG 4.48Å; F747-F821 HydrophobicContact CB-CE1 4.38Å; F747-F821 HydrophobicContact CD1-CE1 4.33Å; F747-F821 HydrophobicContact CD1-CZ 4.08Å; F747-F821 HydrophobicContact CD2-CE1 4Å; F747-F821 HydrophobicContact CD2-CZ 4.38Å; F747-F821 HydrophobicContact CE1-CZ 4.14Å; F747-F821 HydrophobicContact CE2-CE1 4.35Å; F747-F821 HydrophobicContact CE2-CZ 4.43Å; F747-F821 AromaticContact CG-CE1 3.99Å; F747-F821 HydrophobicContact CG-CE1 3.99Å; F747-F821 HydrophobicContact CG-CZ 4.21Å; F747-F821 HydrophobicContact CZ-CZ 4.31Å; F747-I914 HydrophobicContact CE1-CG2 4.45Å; F747-T915 CarbonylContact O-C 3.57Å; F747-T915 VanDerWaalsContact O-CA 3.23Å; F747-T915 WeakPolarHBondContact O-CA 3.36Å; F747-L916 HydrophobicContact CB-CB 4.25Å; F747-L916 HydrophobicContact CD1-CB 4.31Å; F747-L916 PolarHBondContact N-O 2.76Å; F747-L916 PolarHBondContact O-N 2.87Å
748	H	79.8	Confident	63.1	Low	101 Å²	101	79.6 Å²	79.6	47%	0.468	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	140.8	-179.7	-164.2	-74.4	0	0	0	109.9	D913 I914	H748-D913 IonicContact CE1-OD1 3.77Å; H748-D913 PolarHBondContact CE1-OD1 3.48Å; H748-D913 VanDerWaalsContact CE1-OD1 3.25Å; H748-D913 IonicContact NE2-OD1 3.29Å; H748-I914 CarbonylContact C-O 3.59Å; H748-I914 WeakPolarHBondContact CA-O 3.3Å
749	C	83.9	Confident	64.8	Low	2 Å²	2	77 Å²	77	1%	0.014	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	105.3	174.8	-176.5	0	0	0	0	111.4	F747 C757 F759 D913 I914	F747-C749 HydrophobicContact CE1-CB 4.01Å; F747-C749 HydrophobicContact CZ-CB 3.99Å; C749-C757 WeakPolarHBondContact CA-SG 3.45Å; C749-C757 HydrophobicContact CB-CB 3.61Å; C749-C757 WeakPolarHBondContact CB-SG 3.35Å; C749-C757 WeakPolarHBondContact SG-CB 3.37Å; C749-C757 CovalentContact SG-SG 2.02Å; C749-C757 PolarHBondContact SG-SG 2.81Å; C749-F759 HydrophobicContact CB-CE2 4.27Å; C749-D913 CarbonylContact O-C 3.5Å; C749-D913 WeakPolarHBondContact O-CA 3.39Å; C749-I914 HydrophobicContact CB-CB 4.33Å; C749-I914 PolarHBondContact N-O 3.45Å; C749-I914 PolarHBondContact O-N 2.87Å
750	S	81.7	Confident	66.6	Low	40 Å²	40	79.1 Å²	79.1	28%	0.28	39%	0.394	S	S	.	.			trans	-96.8	15.9	175.5	64.8	0	0	0	0	112.9	E752 D913	S750-E752 PolarHBondContact O-N 3.45Å; S750-D913 WeakPolarHBondContact CA-OD1 3.27Å; S750-D913 WeakPolarHBondContact CB-OD1 3.2Å
751	F	83.6	Confident	68.7	Low	0 Å²	0	75.7 Å²	75.7	0%	0	38%	0.376	C	S	.	.	S	Bend	trans	50.5	5.5	-178.2	-57.4	-70.9	0	0	0	118.6	E753 I756 F759 R771 F798 M800 L816 I911 I914	F751-E753 PolarHBondContact O-N 3.23Å; F751-E753 VanDerWaalsContact O-N 3.13Å; F751-I756 HydrophobicContact CD1-CB 4.17Å; F751-I756 HydrophobicContact CD1-CG2 4.33Å; F751-F759 HydrophobicContact CE1-CD2 4.26Å; F751-R771 VanDerWaalsContact O-CZ 3.24Å; F751-R771 PolarHBondContact O-NE 3.06Å; F751-R771 PolarHBondContact O-NH2 3.06Å; F751-F798 WeakPolarHBondContact CB-O 3.49Å; F751-M800 HydrophobicContact CD1-CG 3.5Å; F751-M800 VanDerWaalsContact CD1-CG 3.5Å; F751-M800 HydrophobicContact CD1-SD 4.04Å; F751-M800 HydrophobicContact CD2-CG 3.86Å; F751-M800 HydrophobicContact CE1-CG 3.41Å; F751-M800 VanDerWaalsContact CE1-CG 3.41Å; F751-M800 HydrophobicContact CE1-SD 4.3Å; F751-M800 HydrophobicContact CE2-CB 4.34Å; F751-M800 HydrophobicContact CE2-CG 3.76Å; F751-M800 HydrophobicContact CG-CG 3.71Å; F751-M800 HydrophobicContact CG-SD 4.44Å; F751-M800 HydrophobicContact CZ-CB 4.34Å; F751-M800 HydrophobicContact CZ-CG 3.52Å; F751-L816 HydrophobicContact CE1-CD2 4.09Å; F751-L816 HydrophobicContact CZ-CD2 4.1Å; F751-I911 HydrophobicContact CE2-CG1 4.45Å; F751-I914 HydrophobicContact CE2-CD1 4.03Å; F751-I914 HydrophobicContact CE2-CG1 4.09Å; F751-I914 HydrophobicContact CZ-CD1 3.53Å; F751-I914 HydrophobicContact CZ-CG1 4.07Å
752	E	80.8	Confident	70.8	Confident	82 Å²	82	73.1 Å²	73.1	38%	0.383	36%	0.362	S	S	.	.			trans	-61.4	-19.7	-177	-74.8	-54.9	140.8	0	0	115.8	S750 R771 G797 F798	S750-E752 PolarHBondContact O-N 3.45Å; E752-R771 PolarHBondContact O-NH2 3.37Å; E752-G797 WeakPolarHBondContact OE1-CA 3.28Å; E752-F798 PolarHBondContact OE1-N 3.3Å
753	E	66.1	Low	72.6	Confident	145 Å²	145	78.5 Å²	78.5	68%	0.678	38%	0.377	S	S	*	.	S	Bend	trans	-103.1	144.7	176.7	-55.8	-172.9	174.1	0	0	112.5	F751 P755 I756	F751-E753 PolarHBondContact O-N 3.23Å; F751-E753 VanDerWaalsContact O-N 3.13Å; E753-P755 VanDerWaalsContact C-N 3.3Å; E753-I756 PolarHBondContact O-N 2.63Å; E753-I756 VanDerWaalsContact O-N 3.09Å
754	E	55.6	Low	74.4	Confident	153 Å²	153	78.5 Å²	78.5	72%	0.715	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-35.5	176.7	-76.1	-157.2	158.1	0	0	115.4	I756	E754-I756 PolarHBondContact O-N 3.46Å; E754-I756 VanDerWaalsContact O-N 3.07Å
755	P	65.8	Low	76	Confident	68 Å²	68	78.6 Å²	78.6	44%	0.442	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	0.6	179	-21.9	35.6	0	0	0	115.5	E753 C757 M758	E753-P755 VanDerWaalsContact C-N 3.3Å; P755-C757 PolarHBondContact O-N 3.45Å; P755-M758 HydrophobicContact CB-CE 4.18Å; P755-M758 PolarHBondContact O-N 2.78Å
756	I	77	Confident	77.9	Confident	28 Å²	28	72.9 Å²	72.9	14%	0.144	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	42.6	42.2	-179.5	60.3	171.6	0	0	0	113.4	F751 E753 E754 M758 F759 R771 M800 L816	F751-I756 HydrophobicContact CD1-CB 4.17Å; F751-I756 HydrophobicContact CD1-CG2 4.33Å; E753-I756 PolarHBondContact O-N 2.63Å; E753-I756 VanDerWaalsContact O-N 3.09Å; E754-I756 PolarHBondContact O-N 3.46Å; E754-I756 VanDerWaalsContact O-N 3.07Å; I756-M758 PolarHBondContact O-N 3.37Å; I756-M758 VanDerWaalsContact O-N 3.08Å; I756-F759 HydrophobicContact CD1-CB 4.26Å; I756-F759 WeakPolarHBondContact CD1-O 3.47Å; I756-F759 HydrophobicContact CG1-CB 4.35Å; I756-F759 WeakPolarHBondContact O-CB 3.37Å; I756-F759 WeakPolarHBondContact O-CD2 3.42Å; I756-F759 PolarHBondContact O-N 2.91Å; I756-R771 HydrophobicContact CG2-CG 4.4Å; I756-M800 HydrophobicContact CG2-SD 4.14Å; I756-L816 HydrophobicContact CD1-CD1 4.42Å
757	C	78.9	Confident	79.3	Confident	40 Å²	40	67.1 Å²	67.1	27%	0.27	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	54.1	28.3	179.9	-36.3	0	0	0	0	114.8	F747 C749 P755 F759	F747-C757 HydrophobicContact CZ-CB 4.17Å; C749-C757 WeakPolarHBondContact CA-SG 3.45Å; C749-C757 HydrophobicContact CB-CB 3.61Å; C749-C757 WeakPolarHBondContact CB-SG 3.35Å; C749-C757 WeakPolarHBondContact SG-CB 3.37Å; C749-C757 CovalentContact SG-SG 2.02Å; C749-C757 PolarHBondContact SG-SG 2.81Å; P755-C757 PolarHBondContact O-N 3.45Å; C757-F759 VanDerWaalsContact C-N 3.27Å; C757-F759 HydrophobicContact CB-CD2 4.3Å; C757-F759 PolarHBondContact O-N 2.83Å
758	M	71.2	Confident	80	Confident	96 Å²	96	69.8 Å²	69.8	47%	0.473	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	64.8	21.7	-174.4	-49.9	-66.6	165.7	0	0	114.8	I740 P755 I756 P819	I740-M758 HydrophobicContact CD1-CE 4.01Å; I740-M758 HydrophobicContact CD1-CG 4.45Å; P755-M758 HydrophobicContact CB-CE 4.18Å; P755-M758 PolarHBondContact O-N 2.78Å; I756-M758 PolarHBondContact O-N 3.37Å; I756-M758 VanDerWaalsContact O-N 3.08Å; M758-P819 HydrophobicContact CB-CB 4.33Å
759	F	81.6	Confident	80.6	Confident	11 Å²	11	65.2 Å²	65.2	5%	0.048	34%	0.335	C	S	.	.			trans	-65.2	148.7	160.5	-80.9	-95.8	0	0	0	110.3	F747 C749 F751 I756 C757 L816 V817 S818 I914	F747-F759 HydrophobicContact CE1-CE2 4.16Å; F747-F759 AromaticContact CZ-CE2 3.97Å; F747-F759 HydrophobicContact CZ-CE2 3.97Å; C749-F759 HydrophobicContact CB-CE2 4.27Å; F751-F759 HydrophobicContact CE1-CD2 4.26Å; I756-F759 HydrophobicContact CD1-CB 4.26Å; I756-F759 WeakPolarHBondContact CD1-O 3.47Å; I756-F759 HydrophobicContact CG1-CB 4.35Å; I756-F759 WeakPolarHBondContact O-CB 3.37Å; I756-F759 WeakPolarHBondContact O-CD2 3.42Å; I756-F759 PolarHBondContact O-N 2.91Å; C757-F759 VanDerWaalsContact C-N 3.27Å; C757-F759 HydrophobicContact CB-CD2 4.3Å; C757-F759 PolarHBondContact O-N 2.83Å; F759-L816 HydrophobicContact CB-CD1 4.03Å; F759-L816 HydrophobicContact CB-CD2 4.4Å; F759-L816 HydrophobicContact CB-CG 4.04Å; F759-L816 HydrophobicContact CD1-CD2 4.12Å; F759-L816 HydrophobicContact CD1-CG 3.79Å; F759-L816 HydrophobicContact CG-CD2 4.35Å; F759-L816 HydrophobicContact CG-CG 4.22Å; F759-V817 CarbonylContact C-O 3.42Å; F759-V817 WeakPolarHBondContact CA-O 3.37Å; F759-V817 VanDerWaalsContact CD1-C 3.49Å; F759-V817 WeakPolarHBondContact CD1-O 3.41Å; F759-S818 VanDerWaalsContact CD1-CA 3.45Å; F759-S818 VanDerWaalsContact CE1-CA 3.47Å; F759-I914 HydrophobicContact CE1-CD1 4.09Å; F759-I914 HydrophobicContact CE2-CD1 4.09Å; F759-I914 HydrophobicContact CZ-CD1 3.58Å; F759-I914 HydrophobicContact CZ-CG2 4.21Å
760	T	81.8	Confident	80.8	Confident	77 Å²	77	68 Å²	68	47%	0.472	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	140.9	177	56.8	0	0	0	0	109.7	V817	T760-V817 PolarHBondContact N-O 2.71Å; T760-V817 WeakPolarHBondContact O-CA 3.48Å; T760-V817 WeakPolarHBondContact O-CB 3.21Å; T760-V817 PolarHBondContact O-N 3.06Å
761	Q	88	Confident	81.1	Confident	46 Å²	46	69.2 Å²	69.2	22%	0.215	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	148.9	164.6	-47.4	-66.4	-8.5	0	0	109.3	D768 W769	Q761-D768 VanDerWaalsContact CB-OD1 3.32Å; Q761-D768 WeakPolarHBondContact CB-OD1 3.32Å; Q761-D768 HydrophobicContact CG-CB 3.98Å; Q761-D768 VanDerWaalsContact CG-OD1 3.28Å; Q761-D768 WeakPolarHBondContact CG-OD1 3.34Å; Q761-W769 PolarHBondContact NE2-O 2.73Å
762	D	82.6	Confident	81.1	Confident	28 Å²	28	70.4 Å²	70.4	15%	0.15	36%	0.356	C	S	.	.			trans	-64.3	174	159	-161	-7.6	0	0	0	109.4	N764 R815 V817	D762-N764 PolarHBondContact OD1-N 3.18Å; D762-N764 PolarHBondContact OD1-ND2 2.77Å; D762-R815 HydrophobicContact CB-CB 3.78Å; D762-R815 PolarHBondContact N-O 2.68Å; D762-R815 IonicContact OD2-CZ 2.65Å; D762-R815 IonicContact OD2-NH1 3.19Å; D762-R815 PolarHBondContact OD2-NH1 3.28Å; D762-V817 HydrophobicContact CB-CG2 4.27Å
763	K	82.3	Confident	81.2	Confident	194 Å²	194	66.6 Å²	66.6	84%	0.843	34%	0.338	S	S	*	.	S	Bend	trans	-130.7	15.7	172	-61.7	-173.6	178.9	-177.3	0	111.6
764	N	80.9	Confident	81.5	Confident	128 Å²	128	60.8 Å²	60.8	68%	0.684	32%	0.315	S	S	*	.	S	Bend	trans	-132.1	28.9	-171.7	-48.8	-84	0	0	0	110.2	D762 R815	D762-N764 PolarHBondContact OD1-N 3.18Å; D762-N764 PolarHBondContact OD1-ND2 2.77Å; N764-R815 PolarHBondContact O-NH1 3.03Å
765	D	85.3	Confident	82	Confident	31 Å²	31	56.5 Å²	56.5	17%	0.166	31%	0.306	C	S	.	.	S	Bend	trans	-129.2	178.7	177.8	57.6	-22.5	0	0	0	109.1	R815	D765-R815 HydrophobicContact CB-CG 4.27Å; D765-R815 PolarHBondContact OD2-N 3.26Å
766	D	92	Very high	81.7	Confident	90 Å²	90	57.5 Å²	57.5	48%	0.481	31%	0.311	S	S	.	.	S	Bend	trans	-92.3	-22.8	-170.1	-55.6	-74.5	0	0	0	113.2	R808 D812 Q813	D766-R808 PolarHBondContact O-NH1 3.31Å; D766-R808 VanDerWaalsContact O-NH1 3.17Å; D766-D812 HydrophobicContact CB-CB 4.01Å; D766-D812 WeakPolarHBondContact OD2-CA 3.25Å; D766-Q813 PolarHBondContact N-O 2.8Å; D766-Q813 PolarHBondContact OD2-N 2.84Å
767	F	90.3	Very high	80.6	Confident	13 Å²	13	62.2 Å²	62.2	6%	0.057	33%	0.327	C	S	.	.			trans	-163.4	155.3	178.3	70.4	-70.9	0	0	0	115.6	I802 D812 Q813 A814	F767-I802 HydrophobicContact CE2-CB 3.67Å; F767-I802 HydrophobicContact CE2-CG2 3.78Å; F767-I802 HydrophobicContact CZ-CB 3.9Å; F767-I802 HydrophobicContact CZ-CD1 4.31Å; F767-I802 HydrophobicContact CZ-CG2 4.01Å; F767-D812 HydrophobicContact CD1-CB 4.18Å; F767-D812 HydrophobicContact CE1-CB 3.96Å; F767-Q813 VanDerWaalsContact CD1-O 3.32Å; F767-Q813 WeakPolarHBondContact CD1-O 3.46Å; F767-Q813 PolarHBondContact N-O 2.83Å; F767-Q813 VanDerWaalsContact N-O 3.17Å; F767-A814 HydrophobicContact CD1-CB 3.9Å; F767-A814 HydrophobicContact CD2-CB 4.02Å; F767-A814 HydrophobicContact CE1-CB 3.84Å; F767-A814 HydrophobicContact CE2-CB 4Å; F767-A814 HydrophobicContact CG-CB 3.98Å; F767-A814 HydrophobicContact CZ-CB 3.9Å; F767-A814 WeakPolarHBondContact O-CA 3.31Å; F767-A814 WeakPolarHBondContact O-CB 3.42Å
768	D	91.5	Very high	79.3	Confident	93 Å²	93	65 Å²	65	50%	0.497	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-76.7	148.9	177.4	-56.3	-60.2	0	0	0	113.4	Q761	Q761-D768 VanDerWaalsContact CB-OD1 3.32Å; Q761-D768 WeakPolarHBondContact CB-OD1 3.32Å; Q761-D768 HydrophobicContact CG-CB 3.98Å; Q761-D768 VanDerWaalsContact CG-OD1 3.28Å; Q761-D768 WeakPolarHBondContact CG-OD1 3.34Å
769	W	91.8	Very high	78.1	Confident	5 Å²	5	67 Å²	67	2%	0.019	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-68.5	136.8	160.1	-76.3	77.4	0	0	0	110.7	Q761 M800 I802 A814 L816 L853 L897 I909 I911	Q761-W769 PolarHBondContact NE2-O 2.73Å; W769-M800 HydrophobicContact CB-CE 3.69Å; W769-M800 HydrophobicContact CE3-CB 4.05Å; W769-M800 WeakPolarHBondContact O-CE 3.33Å; W769-I802 HydrophobicContact CD2-CG2 3.68Å; W769-I802 HydrophobicContact CE3-CG2 3.89Å; W769-I802 HydrophobicContact CG-CG2 4.06Å; W769-I802 HydrophobicContact CH2-CG2 4.4Å; W769-I802 HydrophobicContact CZ2-CG2 4.23Å; W769-I802 HydrophobicContact CZ3-CG2 4.24Å; W769-A814 HydrophobicContact CG-CB 4.5Å; W769-A814 PolarHBondContact NE1-O 3.12Å; W769-L816 HydrophobicContact CB-CB 4.46Å; W769-L816 HydrophobicContact CB-CD1 4.44Å; W769-L816 HydrophobicContact CD2-CB 4.48Å; W769-L816 HydrophobicContact CG-CB 3.97Å; W769-L853 HydrophobicContact CH2-CD1 3.67Å; W769-L853 HydrophobicContact CZ2-CD1 3.79Å; W769-L897 PolarHBondContact NE1-O 3.02Å; W769-I909 HydrophobicContact CH2-CG2 4.34Å; W769-I911 HydrophobicContact CD2-CD1 4.36Å; W769-I911 HydrophobicContact CE3-CD1 3.97Å; W769-I911 HydrophobicContact CE3-CG1 4.05Å; W769-I911 HydrophobicContact CH2-CD1 3.87Å; W769-I911 HydrophobicContact CH2-CG1 4.06Å; W769-I911 HydrophobicContact CH2-CG2 3.82Å; W769-I911 HydrophobicContact CZ2-CD1 4.23Å; W769-I911 HydrophobicContact CZ3-CB 4.33Å; W769-I911 HydrophobicContact CZ3-CD1 3.73Å; W769-I911 HydrophobicContact CZ3-CG1 3.6Å; W769-I911 HydrophobicContact CZ3-CG2 4.05Å
770	T	88.9	Confident	76.6	Confident	61 Å²	61	73.5 Å²	73.5	37%	0.374	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	128.9	-178.6	-60.9	0	0	0	0	111.7	M800 Y801	T770-M800 CarbonylContact O-C 3.43Å; T770-M800 WeakPolarHBondContact O-CA 3.19Å; T770-Y801 HydrophobicContact CG2-CD1 4.41Å; T770-Y801 HydrophobicContact CG2-CE1 3.88Å; T770-Y801 PolarHBondContact N-O 2.91Å; T770-Y801 WeakPolarHBondContact O-CD1 3.47Å; T770-Y801 PolarHBondContact O-N 2.92Å
771	R	88.3	Confident	75.5	Confident	64 Å²	64	76.5 Å²	76.5	24%	0.242	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	125.2	168.8	-171.7	-173.7	-178.8	-97.2	-5	109.4	F751 E752 I756 F798 Y799 M800	F751-R771 VanDerWaalsContact O-CZ 3.24Å; F751-R771 PolarHBondContact O-NE 3.06Å; F751-R771 PolarHBondContact O-NH2 3.06Å; E752-R771 PolarHBondContact O-NH2 3.37Å; I756-R771 HydrophobicContact CG2-CG 4.4Å; R771-F798 HydrophobicContact CG-CB 4.37Å; R771-F798 HydrophobicContact CG-CD1 4.18Å; R771-F798 VanDerWaalsContact NH1-CE1 3.3Å; R771-F798 VanDerWaalsContact NH2-CD2 3.29Å; R771-Y799 WeakPolarHBondContact CA-O 3.3Å; R771-M800 VanDerWaalsContact CA-SD 3.59Å; R771-M800 HydrophobicContact CB-CE 4.36Å; R771-M800 HydrophobicContact CB-SD 3.57Å; R771-M800 VanDerWaalsContact CB-SD 3.57Å; R771-M800 HydrophobicContact CG-SD 4.01Å
772	H	82.1	Confident	74.1	Confident	25 Å²	25	74.8 Å²	74.8	12%	0.116	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	155.9	-171.3	-167.6	54.6	0	0	0	113.1	F798 Y799 Y801	H772-F798 VanDerWaalsContact O-CA 3.3Å; H772-F798 WeakPolarHBondContact O-CA 3.12Å; H772-Y799 HydrophobicContact CB-CE2 4.34Å; H772-Y799 PolarHBondContact N-O 2.97Å; H772-Y799 PolarHBondContact O-N 3.49Å; H772-Y801 HydrophobicContact CB-CD1 3.56Å; H772-Y801 HydrophobicContact CB-CE1 3.53Å; H772-Y801 AromaticContact CD2-CE1 3.93Å; H772-Y801 AromaticContact CG-CE1 3.73Å
773	S	83.1	Confident	73.1	Confident	3 Å²	3	77.3 Å²	77.3	2%	0.021	40%	0.399	C	S	.	.			trans	-135.7	141.5	172.8	56.8	0	0	0	0	110.3	A775 T776 G797 F798	S773-A775 PolarHBondContact O-N 3.48Å; S773-A775 VanDerWaalsContact O-N 3.09Å; S773-T776 PolarHBondContact O-N 2.79Å; S773-T776 PolarHBondContact O-OG1 2.75Å; S773-T776 PolarHBondContact OG-OG1 3.47Å; S773-G797 WeakPolarHBondContact CA-O 3.45Å; S773-G797 WeakPolarHBondContact CB-O 3.46Å; S773-F798 VanDerWaalsContact OG-CE1 3.28Å; S773-F798 WeakPolarHBondContact OG-CE1 3.09Å
774	A	73.1	Confident	72.4	Confident	22 Å²	22	74.2 Å²	74.2	18%	0.182	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-61.4	-23.5	-174.5	0	0	0	0	0	113.7	T776 R777 S788 K795	A774-T776 VanDerWaalsContact C-N 3.28Å; A774-T776 PolarHBondContact O-N 2.77Å; A774-R777 WeakPolarHBondContact O-CB 3.34Å; A774-S788 VanDerWaalsContact CB-O 3.29Å; A774-S788 WeakPolarHBondContact CB-O 3.32Å; A774-K795 CarbonylContact C-O 3.6Å; A774-K795 HydrophobicContact CB-CB 4.36Å; A774-K795 PolarHBondContact N-O 2.81Å
775	A	65.2	Low	72.1	Confident	63 Å²	63	68.4 Å²	68.4	52%	0.521	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-69.8	-18.8	173.7	0	0	0	0	0	114.1	S773 K795 Q796	S773-A775 PolarHBondContact O-N 3.48Å; S773-A775 VanDerWaalsContact O-N 3.09Å; A775-K795 VanDerWaalsContact CB-O 3.28Å; A775-K795 WeakPolarHBondContact CB-O 3.29Å; A775-K795 PolarHBondContact N-O 2.84Å; A775-Q796 HydrophobicContact CB-CG 4.31Å
776	T	60.5	Low	71.9	Confident	89 Å²	89	67.6 Å²	67.6	55%	0.546	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-102.4	9.9	179.9	60.4	0	0	0	0	113.6	S773 A774 D778	S773-T776 PolarHBondContact O-N 2.79Å; S773-T776 PolarHBondContact O-OG1 2.75Å; S773-T776 PolarHBondContact OG-OG1 3.47Å; A774-T776 VanDerWaalsContact C-N 3.28Å; A774-T776 PolarHBondContact O-N 2.77Å; T776-D778 PolarHBondContact O-N 3.37Å
777	R	52.5	Low	71.6	Confident	128 Å²	128	63.4 Å²	63.4	48%	0.483	34%	0.338	S	S	.	.			trans	-80.4	102.2	-169.7	-160.7	172.6	96.8	148.1	9.6	113.3	A774 T785	A774-R777 WeakPolarHBondContact O-CB 3.34Å; R777-T785 PolarHBondContact NH1-O 3.02Å
778	D	52.9	Low	71.3	Confident	98 Å²	98	66.8 Å²	66.8	52%	0.524	36%	0.363	S	S	.	.			trans	-58.3	138.1	166.1	-178.9	22.7	0	0	0	110.4	T776 K780	T776-D778 PolarHBondContact O-N 3.37Å; D778-K780 PolarHBondContact O-N 3.23Å; D778-K780 WeakPolarHBondContact OD2-CB 3.18Å
779	T	45.4	Very low	70.8	Confident	139 Å²	139	63 Å²	63	85%	0.853	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	29.5	-169.8	63.4	0	0	0	0	113.2
780	K	50.7	Low	70.5	Confident	147 Å²	147	63 Å²	63	64%	0.639	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.1	-2.5	-163.6	-146.3	167	-161.6	153.2	0	115.1	D778	D778-K780 PolarHBondContact O-N 3.23Å; D778-K780 WeakPolarHBondContact OD2-CB 3.18Å
781	Y	58.1	Low	70.3	Confident	139 Å²	139	63 Å²	63	55%	0.545	34%	0.34	S	S	.	.	S	Bend	trans	-111.4	-175.4	179.1	-65.3	-84.5	0	0	0	110.7	S805	Y781-S805 WeakPolarHBondContact CD1-OG 3.27Å
782	T	59	Low	70	Confident	10 Å²	10	64.7 Å²	64.7	6%	0.061	36%	0.358	C	S	.	.			trans	-58.5	121.2	-151.3	27	0	0	0	0	114.5	T785 I905 D908	T782-T785 WeakPolarHBondContact CB-OG1 3.46Å; T782-T785 PolarHBondContact O-OG1 2.98Å; T782-T785 PolarHBondContact OG1-OG1 3.24Å; T782-I905 HydrophobicContact CG2-CB 3.82Å; T782-I905 HydrophobicContact CG2-CD1 3.93Å; T782-I905 HydrophobicContact CG2-CG1 3.85Å; T782-I905 WeakPolarHBondContact CG2-O 3.44Å; T782-D908 PolarHBondContact OG1-OD2 3.07Å
783	P	61.5	Low	69.8	Low	81 Å²	81	66.1 Å²	66.1	53%	0.526	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	137.2	-177.5	28.8	-33.7	0	0	0	111
784	N	67.8	Low	69.5	Low	130 Å²	130	67.9 Å²	67.9	70%	0.695	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	26.7	178.5	-41.9	-49.7	0	0	0	115.5	Y846	N784-Y846 WeakPolarHBondContact O-CD1 3.47Å; N784-Y846 WeakPolarHBondContact O-CE1 3.45Å
785	T	74.3	Confident	69.7	Low	6 Å²	6	72.9 Å²	72.9	4%	0.037	41%	0.409	C	S	.	.			trans	-134.1	164.5	172.2	52.3	0	0	0	0	113.2	R777 T782 Y846 G847 E906 D908	R777-T785 PolarHBondContact NH1-O 3.02Å; T782-T785 WeakPolarHBondContact CB-OG1 3.46Å; T782-T785 PolarHBondContact O-OG1 2.98Å; T782-T785 PolarHBondContact OG1-OG1 3.24Å; T785-Y846 WeakPolarHBondContact CB-O 3.42Å; T785-Y846 VanDerWaalsContact CG2-O 3.32Å; T785-Y846 WeakPolarHBondContact CG2-O 3.23Å; T785-G847 VanDerWaalsContact CG2-CA 3.49Å; T785-E906 HydrophobicContact CG2-CB 3.71Å; T785-D908 VanDerWaalsContact CB-OD2 3.25Å; T785-D908 WeakPolarHBondContact CB-OD2 3.08Å; T785-D908 PolarHBondContact OG1-OD2 2.91Å
786	G	81.1	Confident	70.1	Confident	14 Å²	14	76.1 Å²	76.1	14%	0.144	41%	0.414	C	S	.	.	S	Bend	trans	72.6	164.2	-172.9	0	0	0	0	0	114.1	H844	G786-H844 PolarHBondContact O-CE1 2.79Å
787	P	86.4	Confident	70.9	Confident	2 Å²	2	72 Å²	72	1%	0.013	39%	0.389	C	S	.	.			trans	-74.4	159.9	178	31.9	-36.4	0	0	0	112.2	A789 Y799 H844 W880 A910	P787-A789 WeakPolarHBondContact CB-O 3.36Å; P787-Y799 HydrophobicContact CG-CD2 4.1Å; P787-Y799 HydrophobicContact CG-CE1 4.16Å; P787-Y799 HydrophobicContact CG-CE2 3.59Å; P787-H844 HydrophobicContact CB-CB 4.22Å; P787-H844 HydrophobicContact CG-CB 4.42Å; P787-W880 HydrophobicContact CB-CZ2 3.68Å; P787-W880 HydrophobicContact CG-CH2 4.11Å; P787-W880 HydrophobicContact CG-CZ2 3.59Å; P787-A910 HydrophobicContact CG-CB 3.82Å
788	S	82.7	Confident	72.4	Confident	83 Å²	83	68.3 Å²	68.3	58%	0.58	38%	0.377	S	S	*	.	S	Bend	trans	-103.8	0.7	-178.3	59.3	0	0	0	0	114.7	A774	A774-S788 VanDerWaalsContact CB-O 3.29Å; A774-S788 WeakPolarHBondContact CB-O 3.32Å
789	A	80.8	Confident	74.1	Confident	13 Å²	13	63.9 Å²	63.9	11%	0.107	35%	0.352	C	S	.	.	S	Bend	trans	-162.1	171.1	176.7	0	0	0	0	0	108	P787 S794 K795 W880	P787-A789 WeakPolarHBondContact CB-O 3.36Å; A789-S794 WeakPolarHBondContact CA-O 3.36Å; A789-S794 WeakPolarHBondContact CB-O 3.46Å; A789-K795 HydrophobicContact CB-CG 4.5Å; A789-W880 PolarHBondContact O-NE1 2.8Å
790	D	86.4	Confident	76.3	Confident	6 Å²	6	57.3 Å²	57.3	3%	0.032	31%	0.312	C	S	.	.			trans	-61.3	-176.8	163	74.3	-15.7	0	0	0	111.8	T792 G793 S794 Y799 W880	D790-T792 VanDerWaalsContact C-N 3.29Å; D790-T792 VanDerWaalsContact CG-N 3.35Å; D790-T792 VanDerWaalsContact CG-OG1 3.25Å; D790-T792 PolarHBondContact O-N 2.96Å; D790-T792 PolarHBondContact OD1-N 3.17Å; D790-T792 PolarHBondContact OD1-OG1 2.94Å; D790-T792 VanDerWaalsContact OD1-OG1 3.09Å; D790-T792 WeakPolarHBondContact OD2-CB 3.48Å; D790-T792 PolarHBondContact OD2-OG1 3.09Å; D790-G793 PolarHBondContact O-N 3.35Å; D790-G793 PolarHBondContact OD1-N 2.91Å; D790-S794 PolarHBondContact N-O 3.03Å; D790-S794 WeakPolarHBondContact OD1-CA 3.14Å; D790-S794 WeakPolarHBondContact OD1-CB 3.37Å; D790-S794 PolarHBondContact OD1-N 2.76Å; D790-S794 VanDerWaalsContact OD1-O 3.08Å; D790-S794 WeakPolarHBondContact OD2-CB 3.48Å; D790-Y799 HydrophobicContact CB-CD1 4.3Å; D790-W880 PolarHBondContact O-NE1 2.71Å
791	H	84	Confident	78.2	Confident	60 Å²	60	51.9 Å²	51.9	28%	0.278	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-34.7	173.2	172	-126.2	0	0	0	112.9	G793 F842 W880 D912 D913	H791-G793 VanDerWaalsContact C-N 3.28Å; H791-G793 PolarHBondContact O-N 2.03Å; H791-F842 AromaticContact CD2-CD1 3.54Å; H791-F842 AromaticContact CD2-CE1 3.85Å; H791-F842 AromaticContact CD2-CG 3.91Å; H791-F842 AromaticContact CE1-CD1 3.71Å; H791-F842 AromaticContact CE1-CD2 3.78Å; H791-F842 AromaticContact CE1-CE1 3.43Å; H791-F842 VanDerWaalsContact CE1-CE1 3.43Å; H791-F842 WeakPolarHBondContact CE1-CE1 3.46Å; H791-F842 AromaticContact CE1-CE2 3.48Å; H791-F842 VanDerWaalsContact CE1-CE2 3.48Å; H791-F842 WeakPolarHBondContact CE1-CE2 3.39Å; H791-F842 AromaticContact CE1-CG 3.87Å; H791-F842 AromaticContact CE1-CZ 3.3Å; H791-F842 WeakPolarHBondContact CE1-CZ 3.34Å; H791-F842 AromaticContact CG-CD1 3.99Å; H791-F842 AromaticContact CG-CG 3.87Å; H791-F842 AromaticContact ND1-CD2 3.76Å; H791-F842 AromaticContact ND1-CE2 3.89Å; H791-F842 AromaticContact ND1-CG 3.84Å; H791-F842 AromaticContact NE2-CD1 3.36Å; H791-F842 WeakPolarHBondContact NE2-CD1 3.26Å; H791-F842 AromaticContact NE2-CE1 3.13Å; H791-F842 WeakPolarHBondContact NE2-CE1 3.13Å; H791-F842 AromaticContact NE2-CG 3.93Å; H791-F842 AromaticContact NE2-CZ 3.54Å; H791-W880 HydrophobicContact CB-CD2 4.27Å; H791-W880 HydrophobicContact CB-CG 4.31Å; H791-D912 HydrophobicContact CB-CB 4.04Å; H791-D912 WeakPolarHBondContact CB-OD2 3.28Å; H791-D912 PolarHBondContact N-OD2 2.76Å; H791-D913 IonicContact CE1-OD2 2.69Å; H791-D913 IonicContact CG-OD2 2.76Å; H791-D913 IonicContact ND1-OD2 3.49Å; H791-D913 PolarHBondContact ND1-OD2 2.83Å
792	T	83.3	Confident	79.7	Confident	100 Å²	100	45.3 Å²	45.3	61%	0.613	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-15.2	-177.8	80.9	0	0	0	0	114.4	D790	D790-T792 VanDerWaalsContact C-N 3.29Å; D790-T792 VanDerWaalsContact CG-N 3.35Å; D790-T792 VanDerWaalsContact CG-OG1 3.25Å; D790-T792 PolarHBondContact O-N 2.96Å; D790-T792 PolarHBondContact OD1-N 3.17Å; D790-T792 PolarHBondContact OD1-OG1 2.94Å; D790-T792 VanDerWaalsContact OD1-OG1 3.09Å; D790-T792 WeakPolarHBondContact OD2-CB 3.48Å; D790-T792 PolarHBondContact OD2-OG1 3.09Å
793	G	77.6	Confident	81	Confident	55 Å²	55	46.4 Å²	46.4	57%	0.567	27%	0.266	S	S	*	.	S	Bend	trans	94.5	3.7	-174.6	0	0	0	0	0	114.4	D790 H791	D790-G793 PolarHBondContact O-N 3.35Å; D790-G793 PolarHBondContact OD1-N 2.91Å; H791-G793 VanDerWaalsContact C-N 3.28Å; H791-G793 PolarHBondContact O-N 2.03Å
794	S	75.3	Confident	82.1	Confident	40 Å²	40	42.5 Å²	42.5	28%	0.28	24%	0.241	S	C	.	.			trans	-73.5	133.2	170.7	-175.6	0	0	0	0	111.5	A789 D790 Q796 G797	A789-S794 WeakPolarHBondContact CA-O 3.36Å; A789-S794 WeakPolarHBondContact CB-O 3.46Å; D790-S794 PolarHBondContact N-O 3.03Å; D790-S794 WeakPolarHBondContact OD1-CA 3.14Å; D790-S794 WeakPolarHBondContact OD1-CB 3.37Å; D790-S794 PolarHBondContact OD1-N 2.76Å; D790-S794 VanDerWaalsContact OD1-O 3.08Å; D790-S794 WeakPolarHBondContact OD2-CB 3.48Å; S794-Q796 VanDerWaalsContact C-N 3.33Å; S794-Q796 PolarHBondContact OG-N 2.81Å; S794-G797 PolarHBondContact OG-N 2.88Å
795	K	77.1	Confident	82.8	Confident	127 Å²	127	37 Å²	37	55%	0.552	21%	0.213	S	C	*	.	S	Bend	trans	-81.8	-19.9	172	-67.1	-173.8	175.7	-177.8	0	112.3	A774 A775 A789	A774-K795 CarbonylContact C-O 3.6Å; A774-K795 HydrophobicContact CB-CB 4.36Å; A774-K795 PolarHBondContact N-O 2.81Å; A775-K795 VanDerWaalsContact CB-O 3.28Å; A775-K795 WeakPolarHBondContact CB-O 3.29Å; A775-K795 PolarHBondContact N-O 2.84Å; A789-K795 HydrophobicContact CB-CG 4.5Å
796	Q	75.1	Confident	82.9	Confident	131 Å²	131	47.3 Å²	47.3	61%	0.612	25%	0.251	S	S	*	.	S	Bend	trans	-90.5	-20.7	179.9	-68	81.3	-5.9	0	0	112.2	A775 S794 F798	A775-Q796 HydrophobicContact CB-CG 4.31Å; S794-Q796 VanDerWaalsContact C-N 3.33Å; S794-Q796 PolarHBondContact OG-N 2.81Å; Q796-F798 WeakPolarHBondContact O-CD2 3.45Å; Q796-F798 WeakPolarHBondContact O-CE2 3.35Å
797	G	77.4	Confident	83	Confident	2 Å²	2	51.5 Å²	51.5	2%	0.021	28%	0.276	C	S	.	.	S	Bend	trans	-66.2	158.7	175.3	0	0	0	0	0	112.5	E752 S773 S794	E752-G797 WeakPolarHBondContact OE1-CA 3.28Å; S773-G797 WeakPolarHBondContact CA-O 3.45Å; S773-G797 WeakPolarHBondContact CB-O 3.46Å; S794-G797 PolarHBondContact OG-N 2.88Å
798	F	83.1	Confident	83.1	Confident	52 Å²	52	55.5 Å²	55.5	23%	0.228	29%	0.291	C	S	.	.			trans	-121	128.7	-167.3	-73.7	-89.7	0	0	0	112.8	F751 E752 R771 H772 S773 Q796	F751-F798 WeakPolarHBondContact CB-O 3.49Å; E752-F798 PolarHBondContact OE1-N 3.3Å; R771-F798 HydrophobicContact CG-CB 4.37Å; R771-F798 HydrophobicContact CG-CD1 4.18Å; R771-F798 VanDerWaalsContact NH1-CE1 3.3Å; R771-F798 VanDerWaalsContact NH2-CD2 3.29Å; H772-F798 VanDerWaalsContact O-CA 3.3Å; H772-F798 WeakPolarHBondContact O-CA 3.12Å; S773-F798 VanDerWaalsContact OG-CE1 3.28Å; S773-F798 WeakPolarHBondContact OG-CE1 3.09Å; Q796-F798 WeakPolarHBondContact O-CD2 3.45Å; Q796-F798 WeakPolarHBondContact O-CE2 3.35Å
799	Y	89	Confident	83.5	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.016	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	167.9	175	52.4	-89.6	0	0	0	110.3	R771 H772 P787 D790 Y801 W880 A910	R771-Y799 WeakPolarHBondContact CA-O 3.3Å; H772-Y799 HydrophobicContact CB-CE2 4.34Å; H772-Y799 PolarHBondContact N-O 2.97Å; H772-Y799 PolarHBondContact O-N 3.49Å; P787-Y799 HydrophobicContact CG-CD2 4.1Å; P787-Y799 HydrophobicContact CG-CE1 4.16Å; P787-Y799 HydrophobicContact CG-CE2 3.59Å; D790-Y799 HydrophobicContact CB-CD1 4.3Å; Y799-Y801 HydrophobicContact CE2-CD1 4.41Å; Y799-Y801 HydrophobicContact CE2-CG 4.36Å; Y799-W880 HydrophobicContact CD1-CZ2 4.27Å; Y799-W880 HydrophobicContact CD2-CH2 4.34Å; Y799-W880 HydrophobicContact CG-CH2 4.07Å; Y799-W880 HydrophobicContact CG-CZ2 4.09Å; Y799-A910 HydrophobicContact CD2-CB 3.83Å; Y799-A910 HydrophobicContact CE2-CB 4.21Å
800	M	92.4	Very high	84	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.01	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	136.1	170.9	-60.9	-64.4	-60.6	0	0	109.5	F751 I756 W769 T770 R771 L816 A910 I911	F751-M800 HydrophobicContact CD1-CG 3.5Å; F751-M800 VanDerWaalsContact CD1-CG 3.5Å; F751-M800 HydrophobicContact CD1-SD 4.04Å; F751-M800 HydrophobicContact CD2-CG 3.86Å; F751-M800 HydrophobicContact CE1-CG 3.41Å; F751-M800 VanDerWaalsContact CE1-CG 3.41Å; F751-M800 HydrophobicContact CE1-SD 4.3Å; F751-M800 HydrophobicContact CE2-CB 4.34Å; F751-M800 HydrophobicContact CE2-CG 3.76Å; F751-M800 HydrophobicContact CG-CG 3.71Å; F751-M800 HydrophobicContact CG-SD 4.44Å; F751-M800 HydrophobicContact CZ-CB 4.34Å; F751-M800 HydrophobicContact CZ-CG 3.52Å; I756-M800 HydrophobicContact CG2-SD 4.14Å; W769-M800 HydrophobicContact CB-CE 3.69Å; W769-M800 HydrophobicContact CE3-CB 4.05Å; W769-M800 WeakPolarHBondContact O-CE 3.33Å; T770-M800 CarbonylContact O-C 3.43Å; T770-M800 WeakPolarHBondContact O-CA 3.19Å; R771-M800 VanDerWaalsContact CA-SD 3.59Å; R771-M800 HydrophobicContact CB-CE 4.36Å; R771-M800 HydrophobicContact CB-SD 3.57Å; R771-M800 VanDerWaalsContact CB-SD 3.57Å; R771-M800 HydrophobicContact CG-SD 4.01Å; M800-L816 HydrophobicContact CB-CD2 4.33Å; M800-L816 HydrophobicContact CE-CD1 4.17Å; M800-L816 HydrophobicContact CE-CD2 4.17Å; M800-L816 HydrophobicContact CG-CD2 3.92Å; M800-A910 CarbonylContact O-C 3.46Å; M800-A910 VanDerWaalsContact O-CA 3.25Å; M800-A910 WeakPolarHBondContact O-CA 3.26Å; M800-I911 HydrophobicContact CB-CD1 4.23Å; M800-I911 HydrophobicContact CB-CG1 3.78Å; M800-I911 PolarHBondContact N-O 2.94Å; M800-I911 PolarHBondContact O-N 2.93Å
801	Y	89.8	Confident	84.2	Confident	33 Å²	33	66 Å²	66	13%	0.129	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	158.2	175.5	91.8	-69.3	0	0	0	113.6	T770 H772 Y799 E803 I909	T770-Y801 HydrophobicContact CG2-CD1 4.41Å; T770-Y801 HydrophobicContact CG2-CE1 3.88Å; T770-Y801 PolarHBondContact N-O 2.91Å; T770-Y801 WeakPolarHBondContact O-CD1 3.47Å; T770-Y801 PolarHBondContact O-N 2.92Å; H772-Y801 HydrophobicContact CB-CD1 3.56Å; H772-Y801 HydrophobicContact CB-CE1 3.53Å; H772-Y801 AromaticContact CD2-CE1 3.93Å; H772-Y801 AromaticContact CG-CE1 3.73Å; Y799-Y801 HydrophobicContact CE2-CD1 4.41Å; Y799-Y801 HydrophobicContact CE2-CG 4.36Å; Y801-E803 HydrophobicContact CE2-CB 3.79Å; Y801-E803 PolarHBondContact OH-OE2 3.16Å; Y801-I909 CarbonylContact C-O 3.51Å; Y801-I909 VanDerWaalsContact CA-O 3.24Å; Y801-I909 WeakPolarHBondContact CA-O 3.48Å; Y801-I909 WeakPolarHBondContact CB-O 3.35Å
802	I	89.6	Confident	84.6	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	125.6	167.6	52.7	153	0	0	0	110.9	F767 W769 T804 A814 I909	F767-I802 HydrophobicContact CE2-CB 3.67Å; F767-I802 HydrophobicContact CE2-CG2 3.78Å; F767-I802 HydrophobicContact CZ-CB 3.9Å; F767-I802 HydrophobicContact CZ-CD1 4.31Å; F767-I802 HydrophobicContact CZ-CG2 4.01Å; W769-I802 HydrophobicContact CD2-CG2 3.68Å; W769-I802 HydrophobicContact CE3-CG2 3.89Å; W769-I802 HydrophobicContact CG-CG2 4.06Å; W769-I802 HydrophobicContact CH2-CG2 4.4Å; W769-I802 HydrophobicContact CZ2-CG2 4.23Å; W769-I802 HydrophobicContact CZ3-CG2 4.24Å; I802-T804 HydrophobicContact CD1-CG2 4.05Å; I802-A814 HydrophobicContact CG2-CB 3.61Å; I802-I909 HydrophobicContact CD1-CB 4.01Å; I802-I909 HydrophobicContact CD1-CD1 4.21Å; I802-I909 HydrophobicContact CD1-CG1 4.17Å; I802-I909 HydrophobicContact CG1-CB 3.73Å; I802-I909 HydrophobicContact CG1-CG1 4.39Å; I802-I909 WeakPolarHBondContact CG1-O 3.44Å; I802-I909 PolarHBondContact N-O 2.89Å
803	E	86.5	Confident	85.1	Confident	33 Å²	33	62 Å²	62	15%	0.154	31%	0.311	C	S	.	.			trans	-88.6	116.2	175.3	171.1	53.2	-122.8	0	0	109.8	Y801 S805	Y801-E803 HydrophobicContact CE2-CB 3.79Å; Y801-E803 PolarHBondContact OH-OE2 3.16Å; E803-S805 WeakPolarHBondContact OE1-CB 3.48Å; E803-S805 PolarHBondContact OE1-N 2.92Å; E803-S805 PolarHBondContact OE1-OG 3.34Å
804	T	84	Confident	85.9	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	28%	0.284	C	S	.	.			trans	-102.8	7.8	-170.2	62.4	0	0	0	0	114.8	I802 R901 I905 G907 D908	I802-T804 HydrophobicContact CD1-CG2 4.05Å; T804-R901 HydrophobicContact CG2-CB 4.18Å; T804-R901 HydrophobicContact CG2-CG 3.91Å; T804-R901 PolarHBondContact O-NE 3.29Å; T804-R901 PolarHBondContact O-NH2 2.94Å; T804-I905 PolarHBondContact OG1-O 3.25Å; T804-G907 WeakPolarHBondContact CG2-O 3.14Å; T804-G907 VanDerWaalsContact OG1-C 3.22Å; T804-G907 WeakPolarHBondContact OG1-CA 3.19Å; T804-G907 PolarHBondContact OG1-N 2.77Å; T804-D908 WeakPolarHBondContact CB-OD1 3.19Å; T804-D908 PolarHBondContact N-OD1 3.34Å; T804-D908 PolarHBondContact OG1-N 2.95Å; T804-D908 PolarHBondContact OG1-OD1 2.93Å
805	S	82.9	Confident	86.8	Confident	15 Å²	15	59.2 Å²	59.2	11%	0.105	28%	0.277	C	S	.	.	S	Bend	trans	-71.8	-176.5	169.5	72.6	0	0	0	0	113.8	Y781 E803 R808	Y781-S805 WeakPolarHBondContact CD1-OG 3.27Å; E803-S805 WeakPolarHBondContact OE1-CB 3.48Å; E803-S805 PolarHBondContact OE1-N 2.92Å; E803-S805 PolarHBondContact OE1-OG 3.34Å; S805-R808 WeakPolarHBondContact O-CB 3.23Å; S805-R808 WeakPolarHBondContact O-CG 3.31Å; S805-R808 PolarHBondContact O-N 3.28Å; S805-R808 VanDerWaalsContact O-N 3.13Å
806	R	76.6	Confident	87.6	Confident	221 Å²	221	53.1 Å²	53.1	83%	0.834	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	136.1	-176.7	-65.8	-178.4	-179.8	-176.4	0.4	109.7
807	P	83.6	Confident	88.3	Confident	102 Å²	102	47.4 Å²	47.4	66%	0.662	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	cis	-95.4	4.7	26.3	36.3	-38.2	0	0	0	116.5
808	R	88.1	Confident	88.7	Confident	86 Å²	86	47.4 Å²	47.4	33%	0.325	22%	0.224	S	C	.	.			trans	-65.2	146.3	-171.5	-50.1	-59.7	167.5	-163.8	1.4	113.1	D766 S805 D812 R901	D766-R808 PolarHBondContact O-NH1 3.31Å; D766-R808 VanDerWaalsContact O-NH1 3.17Å; S805-R808 WeakPolarHBondContact O-CB 3.23Å; S805-R808 WeakPolarHBondContact O-CG 3.31Å; S805-R808 PolarHBondContact O-N 3.28Å; S805-R808 VanDerWaalsContact O-N 3.13Å; R808-D812 WeakPolarHBondContact CA-OD2 3.39Å; R808-D812 WeakPolarHBondContact CB-OD2 3.44Å; R808-R901 PolarHBondContact O-NE 2.77Å
809	K	90.3	Very high	88.3	Confident	149 Å²	149	46.5 Å²	46.5	65%	0.648	22%	0.223	S	C	*	.			trans	-113.7	174.1	-177.8	-50	169.7	-173.1	161.5	0	111.6	D812 R901	K809-D812 VanDerWaalsContact CB-OD1 3.31Å; K809-D812 WeakPolarHBondContact CB-OD1 3.38Å; K809-D812 PolarHBondContact N-OD1 2.94Å; K809-D812 PolarHBondContact N-OD2 2.95Å; K809-D812 PolarHBondContact O-N 2.74Å; K809-R901 WeakPolarHBondContact O-CD 3.43Å; K809-R901 WeakPolarHBondContact O-CG 3.27Å; K809-R901 PolarHBondContact O-NH1 2.89Å
810	E	91.8	Very high	87.7	Confident	138 Å²	138	51.2 Å²	51.2	65%	0.645	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.8	127.4	-178.2	-179.1	171.1	-173.3	0	0	109.9	R901 P903	E810-R901 VanDerWaalsContact N-NH1 3.16Å; E810-P903 VanDerWaalsContact CD-CA 3.46Å; E810-P903 WeakPolarHBondContact OE1-CB 3.36Å
811	G	89.7	Confident	86.8	Confident	35 Å²	35	51.9 Å²	51.9	36%	0.361	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.3	-8.1	-174.8	0	0	0	0	0	115.4	Q813 R901	G811-Q813 VanDerWaalsContact O-CG 3.23Å; G811-Q813 WeakPolarHBondContact O-CG 3.18Å; G811-R901 PolarHBondContact N-O 2.87Å
812	D	93.4	Very high	85.7	Confident	23 Å²	23	54.1 Å²	54.1	12%	0.123	26%	0.261	C	S	.	.			trans	-53.8	136.9	172.4	-72.8	20.5	0	0	0	110.4	D766 F767 R808 K809 I900 R901	D766-D812 HydrophobicContact CB-CB 4.01Å; D766-D812 WeakPolarHBondContact OD2-CA 3.25Å; F767-D812 HydrophobicContact CD1-CB 4.18Å; F767-D812 HydrophobicContact CE1-CB 3.96Å; R808-D812 WeakPolarHBondContact CA-OD2 3.39Å; R808-D812 WeakPolarHBondContact CB-OD2 3.44Å; K809-D812 VanDerWaalsContact CB-OD1 3.31Å; K809-D812 WeakPolarHBondContact CB-OD1 3.38Å; K809-D812 PolarHBondContact N-OD1 2.94Å; K809-D812 PolarHBondContact N-OD2 2.95Å; K809-D812 PolarHBondContact O-N 2.74Å; D812-I900 WeakPolarHBondContact O-CA 3.4Å; D812-R901 HydrophobicContact CB-CB 4.32Å; D812-R901 PolarHBondContact O-N 2.83Å
813	Q	93.2	Very high	84.6	Confident	55 Å²	55	56.3 Å²	56.3	26%	0.257	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	145.9	-173	-49.4	-175.3	-2.6	0	0	112	D766 F767 G811 E898 I900	D766-Q813 PolarHBondContact N-O 2.8Å; D766-Q813 PolarHBondContact OD2-N 2.84Å; F767-Q813 VanDerWaalsContact CD1-O 3.32Å; F767-Q813 WeakPolarHBondContact CD1-O 3.46Å; F767-Q813 PolarHBondContact N-O 2.83Å; F767-Q813 VanDerWaalsContact N-O 3.17Å; G811-Q813 VanDerWaalsContact O-CG 3.23Å; G811-Q813 WeakPolarHBondContact O-CG 3.18Å; Q813-E898 HydrophobicContact CB-CG 4.49Å; Q813-E898 PolarHBondContact OE1-OE2 3.28Å; Q813-I900 HydrophobicContact CG-CG1 4.29Å
814	A	94.1	Very high	82.9	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	128	172.3	0	0	0	0	0	110.4	F767 W769 I802 E898 G899	F767-A814 HydrophobicContact CD1-CB 3.9Å; F767-A814 HydrophobicContact CD2-CB 4.02Å; F767-A814 HydrophobicContact CE1-CB 3.84Å; F767-A814 HydrophobicContact CE2-CB 4Å; F767-A814 HydrophobicContact CG-CB 3.98Å; F767-A814 HydrophobicContact CZ-CB 3.9Å; F767-A814 WeakPolarHBondContact O-CA 3.31Å; F767-A814 WeakPolarHBondContact O-CB 3.42Å; W769-A814 HydrophobicContact CG-CB 4.5Å; W769-A814 PolarHBondContact NE1-O 3.12Å; I802-A814 HydrophobicContact CG2-CB 3.61Å; A814-E898 CarbonylContact O-C 3.47Å; A814-E898 VanDerWaalsContact O-CA 3.24Å; A814-E898 WeakPolarHBondContact O-CA 3.36Å; A814-G899 PolarHBondContact N-O 2.04Å; A814-G899 PolarHBondContact O-N 3.5Å
815	R	94.2	Very high	81.3	Confident	35 Å²	35	63.5 Å²	63.5	13%	0.132	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	112.9	-173	-63.8	-165.7	-159.4	104.6	12.4	112.9	D762 N764 D765 V896 L897 E898	D762-R815 HydrophobicContact CB-CB 3.78Å; D762-R815 PolarHBondContact N-O 2.68Å; D762-R815 IonicContact OD2-CZ 2.65Å; D762-R815 IonicContact OD2-NH1 3.19Å; D762-R815 PolarHBondContact OD2-NH1 3.28Å; N764-R815 PolarHBondContact O-NH1 3.03Å; D765-R815 HydrophobicContact CB-CG 4.27Å; D765-R815 PolarHBondContact OD2-N 3.26Å; R815-V896 HydrophobicContact CB-CG1 3.86Å; R815-V896 HydrophobicContact CG-CG1 4.21Å; R815-L897 WeakPolarHBondContact CA-O 3.42Å; R815-E898 HydrophobicContact CG-CB 4.05Å; R815-E898 HydrophobicContact CG-CG 3.93Å; R815-E898 IonicContact CZ-OE2 2.66Å; R815-E898 IonicContact NE-OE2 3.42Å; R815-E898 PolarHBondContact NE-OE2 3.23Å; R815-E898 IonicContact NH2-OE2 3.03Å
816	L	94.1	Very high	79.6	Confident	0 Å²	0	70 Å²	70	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	117.8	171	-164.5	66.1	0	0	0	109.6	F751 I756 F759 W769 M800 V896 L897 I911	F751-L816 HydrophobicContact CE1-CD2 4.09Å; F751-L816 HydrophobicContact CZ-CD2 4.1Å; I756-L816 HydrophobicContact CD1-CD1 4.42Å; F759-L816 HydrophobicContact CB-CD1 4.03Å; F759-L816 HydrophobicContact CB-CD2 4.4Å; F759-L816 HydrophobicContact CB-CG 4.04Å; F759-L816 HydrophobicContact CD1-CD2 4.12Å; F759-L816 HydrophobicContact CD1-CG 3.79Å; F759-L816 HydrophobicContact CG-CD2 4.35Å; F759-L816 HydrophobicContact CG-CG 4.22Å; W769-L816 HydrophobicContact CB-CB 4.46Å; W769-L816 HydrophobicContact CB-CD1 4.44Å; W769-L816 HydrophobicContact CD2-CB 4.48Å; W769-L816 HydrophobicContact CG-CB 3.97Å; M800-L816 HydrophobicContact CB-CD2 4.33Å; M800-L816 HydrophobicContact CE-CD1 4.17Å; M800-L816 HydrophobicContact CE-CD2 4.17Å; M800-L816 HydrophobicContact CG-CD2 3.92Å; L816-V896 WeakPolarHBondContact O-CA 3.39Å; L816-L897 PolarHBondContact N-O 2.79Å; L816-L897 PolarHBondContact O-N 3.25Å; L816-I911 HydrophobicContact CD2-CD1 4.05Å
817	V	90.8	Very high	78.1	Confident	10 Å²	10	66.1 Å²	66.1	6%	0.061	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127.9	-172.1	-177.5	0	0	0	0	110.2	F759 T760 D762 Q894 V896	F759-V817 CarbonylContact C-O 3.42Å; F759-V817 WeakPolarHBondContact CA-O 3.37Å; F759-V817 VanDerWaalsContact CD1-C 3.49Å; F759-V817 WeakPolarHBondContact CD1-O 3.41Å; T760-V817 PolarHBondContact N-O 2.71Å; T760-V817 WeakPolarHBondContact O-CA 3.48Å; T760-V817 WeakPolarHBondContact O-CB 3.21Å; T760-V817 PolarHBondContact O-N 3.06Å; D762-V817 HydrophobicContact CB-CG2 4.27Å; V817-Q894 HydrophobicContact CG1-CB 4.34Å; V817-Q894 VanDerWaalsContact CG1-NE2 3.3Å; V817-V896 HydrophobicContact CG1-CG2 4.19Å; V817-V896 HydrophobicContact CG2-CG1 4.07Å; V817-V896 HydrophobicContact CG2-CG2 4.12Å
818	S	85.2	Confident	76.4	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.014	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-69.2	161.1	179.5	82.8	0	0	0	0	113.3	F759 F821 Q894 V895	F759-S818 VanDerWaalsContact CD1-CA 3.45Å; F759-S818 VanDerWaalsContact CE1-CA 3.47Å; S818-F821 VanDerWaalsContact OG-CE2 3.32Å; S818-F821 WeakPolarHBondContact OG-CE2 3.22Å; S818-Q894 PolarHBondContact O-NE2 2.96Å; S818-Q894 WeakPolarHBondContact OG-CA 3.49Å; S818-V895 WeakPolarHBondContact CB-O 3.04Å; S818-V895 PolarHBondContact N-O 2.96Å; S818-V895 PolarHBondContact OG-N 2.91Å; S818-V895 PolarHBondContact OG-O 2.76Å
819	P	75.4	Confident	74.6	Confident	33 Å²	33	72.5 Å²	72.5	21%	0.214	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-56.8	160.4	159.9	26.5	-35.5	0	0	0	111.5	F747 M758 F821	F747-P819 HydrophobicContact CE2-CG 4.48Å; M758-P819 HydrophobicContact CB-CB 4.33Å; P819-F821 HydrophobicContact CG-CE1 4.4Å; P819-F821 HydrophobicContact CG-CZ 4.19Å; P819-F821 PolarHBondContact O-N 3.15Å
820	F	75.3	Confident	72.4	Confident	104 Å²	104	68.7 Å²	68.7	46%	0.456	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-72.7	119.6	176.1	-88.7	-79.6	0	0	0	111.9	K860 F893 Q894	F820-K860 HydrophobicContact CE1-CB 4.2Å; F820-F893 WeakPolarHBondContact CA-O 3.04Å; F820-Q894 HydrophobicContact CD1-CG 3.63Å; F820-Q894 HydrophobicContact CD2-CG 4.05Å; F820-Q894 HydrophobicContact CE1-CG 3.7Å; F820-Q894 HydrophobicContact CE2-CG 4.11Å; F820-Q894 HydrophobicContact CG-CG 3.81Å; F820-Q894 HydrophobicContact CZ-CG 3.94Å; F820-Q894 VanDerWaalsContact CZ-OE1 3.25Å
821	F	74.4	Confident	70	Confident	16 Å²	16	69.9 Å²	69.9	7%	0.07	39%	0.387	C	S	.	.	B	Isolated β-bridge	trans	-90.3	138.7	170.2	-58.4	-65	0	0	0	110.3	L744 F747 S818 P819 S892 F893 L916	L744-F821 HydrophobicContact CD1-CB 3.95Å; L744-F821 HydrophobicContact CD1-CD1 3.84Å; L744-F821 HydrophobicContact CD1-CG 4.14Å; L744-F821 HydrophobicContact CD2-CD1 4.35Å; L744-F821 HydrophobicContact CG-CD1 4.34Å; F747-F821 HydrophobicContact CB-CE1 4.38Å; F747-F821 HydrophobicContact CD1-CE1 4.33Å; F747-F821 HydrophobicContact CD1-CZ 4.08Å; F747-F821 HydrophobicContact CD2-CE1 4Å; F747-F821 HydrophobicContact CD2-CZ 4.38Å; F747-F821 HydrophobicContact CE1-CZ 4.14Å; F747-F821 HydrophobicContact CE2-CE1 4.35Å; F747-F821 HydrophobicContact CE2-CZ 4.43Å; F747-F821 AromaticContact CG-CE1 3.99Å; F747-F821 HydrophobicContact CG-CE1 3.99Å; F747-F821 HydrophobicContact CG-CZ 4.21Å; F747-F821 HydrophobicContact CZ-CZ 4.31Å; S818-F821 VanDerWaalsContact OG-CE2 3.32Å; S818-F821 WeakPolarHBondContact OG-CE2 3.22Å; P819-F821 HydrophobicContact CG-CE1 4.4Å; P819-F821 HydrophobicContact CG-CZ 4.19Å; P819-F821 PolarHBondContact O-N 3.15Å; F821-S892 CarbonylContact O-C 3.57Å; F821-S892 VanDerWaalsContact O-CA 3.22Å; F821-S892 WeakPolarHBondContact O-CA 3.32Å; F821-S892 WeakPolarHBondContact O-CB 3.3Å; F821-F893 HydrophobicContact CB-CD1 4.1Å; F821-F893 HydrophobicContact CB-CD2 4.3Å; F821-F893 HydrophobicContact CB-CE1 3.67Å; F821-F893 HydrophobicContact CB-CE2 3.9Å; F821-F893 HydrophobicContact CB-CG 4.4Å; F821-F893 HydrophobicContact CB-CZ 3.58Å; F821-F893 HydrophobicContact CD2-CD2 4.17Å; F821-F893 AromaticContact CD2-CE2 3.76Å; F821-F893 HydrophobicContact CD2-CE2 3.76Å; F821-F893 HydrophobicContact CD2-CZ 4.23Å; F821-F893 HydrophobicContact CG-CE2 4.19Å; F821-F893 HydrophobicContact CG-CZ 4.2Å; F821-F893 PolarHBondContact N-O 2.84Å; F821-F893 PolarHBondContact O-N 3.41Å; F821-L916 HydrophobicContact CB-CD2 4.49Å; F821-L916 HydrophobicContact CD1-CD2 3.93Å; F821-L916 HydrophobicContact CD2-CD2 3.56Å; F821-L916 HydrophobicContact CE1-CD2 3.98Å; F821-L916 HydrophobicContact CE2-CD2 3.61Å; F821-L916 HydrophobicContact CG-CD2 3.72Å; F821-L916 HydrophobicContact CZ-CD2 3.82Å
822	N	66.7	Low	68.2	Low	80 Å²	80	73.8 Å²	73.8	43%	0.428	40%	0.404	S	S	.	.			trans	-108.6	132.2	180	-68.6	-60.4	0	0	0	110.5	S892	N822-S892 WeakPolarHBondContact OD1-CB 3.43Å; N822-S892 PolarHBondContact OD1-OG 2.88Å
823	I	65.8	Low	66.2	Low	46 Å²	46	80.1 Å²	80.1	24%	0.236	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-72	130.7	169.2	-59.4	177.1	0	0	0	108.7	P835 P889 S891 F893	I823-P835 HydrophobicContact CD1-CG 4.01Å; I823-P835 HydrophobicContact CG1-CG 4.41Å; I823-P835 HydrophobicContact CG2-CB 4.32Å; I823-P835 HydrophobicContact CG2-CG 3.78Å; I823-P889 HydrophobicContact CD1-CB 4.08Å; I823-P889 HydrophobicContact CD1-CG 4.16Å; I823-P889 WeakPolarHBondContact CD1-O 3.37Å; I823-P889 HydrophobicContact CG1-CG 4.4Å; I823-S891 VanDerWaalsContact CD1-O 3.29Å; I823-S891 WeakPolarHBondContact CD1-O 3.42Å; I823-F893 HydrophobicContact CG1-CD1 4.43Å; I823-F893 HydrophobicContact CG1-CE1 4.43Å
824	A	51.9	Low	64.6	Low	52 Å²	52	81.1 Å²	81.1	43%	0.43	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-75.7	129.7	175	0	0	0	0	0	111.1	K826	A824-K826 PolarHBondContact O-N 2.88Å
825	P	48.9	Very low	63.4	Low	131 Å²	131	82.9 Å²	82.9	85%	0.851	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-68.4	119.3	173.7	28.2	-33	0	0	0	109.8
826	K	47.5	Very low	62.6	Low	153 Å²	153	81.8 Å²	81.8	67%	0.665	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-94.4	164.7	174.9	-73.5	178.4	-179.5	171.3	0	111.4	A824 E918	A824-K826 PolarHBondContact O-N 2.88Å; K826-E918 IonicContact NZ-OE1 3.9Å; K826-E918 PolarHBondContact NZ-OE1 2.92Å
827	N	46.8	Very low	62.1	Low	139 Å²	139	82.2 Å²	82.2	74%	0.743	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-54.3	147.8	-157.9	-138.7	11.5	0	0	0	115	Y829	N827-Y829 PolarHBondContact O-N 2.8Å
828	P	46.8	Very low	62	Low	111 Å²	111	81.9 Å²	81.9	72%	0.721	46%	0.459	S	S	*	.	S	Bend	trans	-65	-0.4	-177.2	-22.7	34.5	0	0	0	117
829	Y	50.5	Low	62.4	Low	211 Å²	211	82 Å²	82	83%	0.827	46%	0.46	S	S	*	.	S	Bend	trans	-138.3	89.9	-175.6	-62	-80.6	0	0	0	109.9	N827	N827-Y829 PolarHBondContact O-N 2.8Å
830	G	43.9	Very low	63.1	Low	69 Å²	69	80.4 Å²	80.4	71%	0.711	45%	0.449	S	S	*	.			trans	176.1	139.5	176.6	0	0	0	0	0	114.4
831	I	41.8	Very low	64	Low	163 Å²	163	75.5 Å²	75.5	84%	0.836	43%	0.428	S	S	*	.			trans	-139.7	127.3	-175.2	-71.6	177.8	0	0	0	107.6
832	T	50.6	Low	65	Low	117 Å²	117	76.3 Å²	76.3	72%	0.718	43%	0.431	S	S	*	.			cis	-155	151.1	-10.9	17.8	0	0	0	0	108.6
833	N	53.2	Low	66.4	Low	156 Å²	156	73.4 Å²	73.4	83%	0.834	41%	0.414	S	S	*	.			trans	-163.7	146	147.4	-102.4	-8.6	0	0	0	109.3
834	P	58.8	Low	67.7	Low	76 Å²	76	71.4 Å²	71.4	49%	0.494	40%	0.404	S	S	.	.			trans	-65.3	151.5	168.9	29.8	-34.2	0	0	0	110.3	A836	P834-A836 PolarHBondContact O-N 2.98Å; P834-A836 VanDerWaalsContact O-N 3.09Å
835	P	68.3	Low	69.7	Low	37 Å²	37	68.9 Å²	68.9	24%	0.24	38%	0.383	C	S	.	.			trans	-72.2	104.3	176.2	30.3	-32.9	0	0	0	109.8	I823 Y837	I823-P835 HydrophobicContact CD1-CG 4.01Å; I823-P835 HydrophobicContact CG1-CG 4.41Å; I823-P835 HydrophobicContact CG2-CB 4.32Å; I823-P835 HydrophobicContact CG2-CG 3.78Å; P835-Y837 HydrophobicContact CB-CE2 3.99Å
836	A	77.8	Confident	71.7	Confident	12 Å²	12	66.3 Å²	66.3	10%	0.099	36%	0.357	C	S	.	.			trans	-77.8	141.3	167.9	0	0	0	0	0	110.3	P834 I887 G919 E920	P834-A836 PolarHBondContact O-N 2.98Å; P834-A836 VanDerWaalsContact O-N 3.09Å; A836-I887 WeakPolarHBondContact CA-O 3.35Å; A836-G919 CarbonylContact C-O 3.57Å; A836-G919 WeakPolarHBondContact O-CA 3.45Å; A836-G919 PolarHBondContact O-N 2.74Å; A836-E920 HydrophobicContact CB-CG 4.05Å; A836-E920 WeakPolarHBondContact CB-OE1 3.38Å
837	Y	84.4	Confident	73.6	Confident	8 Å²	8	59.3 Å²	59.3	3%	0.031	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	142.7	165.8	-61.1	-95	0	0	0	109.6	L744 P835 S886 I887 P889 F893 E917 E918 G919	L744-Y837 HydrophobicContact CB-CE1 4.42Å; L744-Y837 HydrophobicContact CD1-CD1 4.37Å; L744-Y837 HydrophobicContact CD1-CE1 3.92Å; P835-Y837 HydrophobicContact CB-CE2 3.99Å; Y837-S886 WeakPolarHBondContact O-CA 3.27Å; Y837-I887 PolarHBondContact N-O 2.93Å; Y837-I887 WeakPolarHBondContact O-CG1 3.31Å; Y837-I887 PolarHBondContact O-N 3.48Å; Y837-P889 HydrophobicContact CD2-CG 3.73Å; Y837-P889 HydrophobicContact CE2-CG 3.79Å; Y837-F893 HydrophobicContact CD2-CE1 4.23Å; Y837-F893 HydrophobicContact CD2-CZ 4.02Å; Y837-F893 AromaticContact CE2-CE1 3.97Å; Y837-F893 HydrophobicContact CE2-CE1 3.97Å; Y837-F893 HydrophobicContact CE2-CZ 4.18Å; Y837-F893 HydrophobicContact CG-CZ 4.31Å; Y837-E917 CarbonylContact C-O 3.59Å; Y837-E917 WeakPolarHBondContact CA-O 3.41Å; Y837-E917 WeakPolarHBondContact CB-O 3.27Å; Y837-E918 HydrophobicContact CD1-CB 4.36Å; Y837-E918 HydrophobicContact CE1-CB 4.32Å; Y837-E918 HydrophobicContact CE1-CG 4.29Å; Y837-G919 CarbonylContact C-O 3.44Å; Y837-G919 VanDerWaalsContact CA-O 3.25Å; Y837-G919 WeakPolarHBondContact CA-O 3.44Å; Y837-G919 PolarHBondContact N-O 2.93Å
838	C	88.6	Confident	75.6	Confident	4 Å²	4	60.4 Å²	60.4	3%	0.027	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	107.1	172.4	-175.1	0	0	0	0	108.9	L916 E917 G919 C921	C838-L916 WeakPolarHBondContact O-CA 3.43Å; C838-E917 HydrophobicContact CB-CB 4.38Å; C838-E917 PolarHBondContact N-O 3.13Å; C838-E917 PolarHBondContact O-N 2.72Å; C838-G919 PolarHBondContact N-O 2.81Å; C838-C921 WeakPolarHBondContact CA-SG 3.36Å; C838-C921 HydrophobicContact CB-CB 3.98Å; C838-C921 WeakPolarHBondContact CB-SG 3.45Å; C838-C921 WeakPolarHBondContact SG-CA 3.41Å; C838-C921 WeakPolarHBondContact SG-CB 3.39Å; C838-C921 CovalentContact SG-SG 2.04Å; C838-C921 PolarHBondContact SG-SG 2.78Å
839	F	91.9	Very high	77.7	Confident	4 Å²	4	57 Å²	57	2%	0.018	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	115.3	172.5	176.4	-115.8	0	0	0	109.3	F841 A855 K884 V885 I887 V895 L897 I914 L916	F839-F841 AromaticContact CD1-CD1 3.94Å; F839-F841 HydrophobicContact CD1-CD1 3.94Å; F839-F841 HydrophobicContact CD1-CE1 4.02Å; F839-F841 AromaticContact CE1-CD1 3.31Å; F839-F841 HydrophobicContact CE1-CD1 3.31Å; F839-F841 AromaticContact CE1-CE1 3.45Å; F839-F841 HydrophobicContact CE1-CE1 3.45Å; F839-F841 VanDerWaalsContact CE1-CE1 3.45Å; F839-F841 HydrophobicContact CE1-CG 4.41Å; F839-F841 AromaticContact CZ-CD1 3.73Å; F839-F841 HydrophobicContact CZ-CD1 3.73Å; F839-F841 HydrophobicContact CZ-CE1 4.26Å; F839-F841 HydrophobicContact CZ-CG 4.48Å; F839-A855 HydrophobicContact CE1-CB 4.09Å; F839-K884 CarbonylContact O-C 3.43Å; F839-K884 WeakPolarHBondContact O-CA 3.45Å; F839-V885 HydrophobicContact CD1-CB 4.48Å; F839-V885 HydrophobicContact CD1-CG2 4.49Å; F839-V885 PolarHBondContact N-O 2.89Å; F839-V885 PolarHBondContact O-N 2.81Å; F839-I887 HydrophobicContact CB-CD1 4.24Å; F839-I887 HydrophobicContact CB-CG1 4.49Å; F839-V895 HydrophobicContact CD1-CG1 4.12Å; F839-V895 HydrophobicContact CD2-CG1 4.31Å; F839-V895 HydrophobicContact CD2-CG2 4.15Å; F839-V895 HydrophobicContact CE1-CG1 3.66Å; F839-V895 HydrophobicContact CE2-CB 4.19Å; F839-V895 HydrophobicContact CE2-CG1 3.87Å; F839-V895 HydrophobicContact CE2-CG2 4.27Å; F839-V895 HydrophobicContact CG-CG1 4.42Å; F839-V895 HydrophobicContact CG-CG2 4.48Å; F839-V895 HydrophobicContact CZ-CB 4.32Å; F839-V895 HydrophobicContact CZ-CG1 3.54Å; F839-L897 HydrophobicContact CE1-CD2 4.03Å; F839-L897 HydrophobicContact CZ-CD1 4.19Å; F839-L897 HydrophobicContact CZ-CD2 4.03Å; F839-L897 HydrophobicContact CZ-CG 4.23Å; F839-I914 HydrophobicContact CD2-CG2 4.4Å; F839-I914 HydrophobicContact CE2-CG2 3.54Å; F839-I914 HydrophobicContact CZ-CG2 4.2Å; F839-L916 HydrophobicContact CB-CD1 3.97Å; F839-L916 HydrophobicContact CD2-CD1 4.31Å
840	G	90.9	Very high	79.7	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	151.5	176.2	0	0	0	0	0	111.7	A883 I914 T915	G840-A883 VanDerWaalsContact CA-O 3.32Å; G840-A883 WeakPolarHBondContact CA-O 3.3Å; G840-I914 CarbonylContact O-C 3.6Å; G840-I914 WeakPolarHBondContact O-CA 3.36Å; G840-T915 WeakPolarHBondContact CA-OG1 3.39Å; G840-T915 PolarHBondContact N-O 2.95Å; G840-T915 PolarHBondContact O-N 2.83Å; G840-T915 VanDerWaalsContact O-O 3.12Å
841	F	94.9	Very high	82	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	155.5	166.6	58.9	-80.5	0	0	0	110	F839 Y843 L853 W870 Q882 A883 L897 I911 I914	F839-F841 AromaticContact CD1-CD1 3.94Å; F839-F841 HydrophobicContact CD1-CD1 3.94Å; F839-F841 HydrophobicContact CD1-CE1 4.02Å; F839-F841 AromaticContact CE1-CD1 3.31Å; F839-F841 HydrophobicContact CE1-CD1 3.31Å; F839-F841 AromaticContact CE1-CE1 3.45Å; F839-F841 HydrophobicContact CE1-CE1 3.45Å; F839-F841 VanDerWaalsContact CE1-CE1 3.45Å; F839-F841 HydrophobicContact CE1-CG 4.41Å; F839-F841 AromaticContact CZ-CD1 3.73Å; F839-F841 HydrophobicContact CZ-CD1 3.73Å; F839-F841 HydrophobicContact CZ-CE1 4.26Å; F839-F841 HydrophobicContact CZ-CG 4.48Å; F841-Y843 HydrophobicContact CD2-CD1 4.42Å; F841-Y843 HydrophobicContact CE2-CD1 4.07Å; F841-Y843 HydrophobicContact CE2-CG 4.48Å; F841-L853 HydrophobicContact CE2-CD2 3.92Å; F841-W870 HydrophobicContact CE2-CH2 4.2Å; F841-W870 HydrophobicContact CE2-CZ3 4.15Å; F841-W870 HydrophobicContact CZ-CD2 4.17Å; F841-W870 AromaticContact CZ-CE3 3.79Å; F841-W870 HydrophobicContact CZ-CE3 3.79Å; F841-W870 AromaticContact CZ-CH2 3.97Å; F841-W870 HydrophobicContact CZ-CH2 3.97Å; F841-W870 HydrophobicContact CZ-CZ2 4.36Å; F841-W870 AromaticContact CZ-CZ3 3.69Å; F841-W870 HydrophobicContact CZ-CZ3 3.69Å; F841-Q882 WeakPolarHBondContact O-CA 3.33Å; F841-A883 HydrophobicContact CD1-CB 4.08Å; F841-A883 HydrophobicContact CD2-CB 4.35Å; F841-A883 HydrophobicContact CE1-CB 3.62Å; F841-A883 HydrophobicContact CE2-CB 3.91Å; F841-A883 HydrophobicContact CG-CB 4.43Å; F841-A883 HydrophobicContact CZ-CB 3.53Å; F841-A883 PolarHBondContact N-O 3.28Å; F841-A883 PolarHBondContact O-N 3.25Å; F841-L897 HydrophobicContact CE1-CD2 4.25Å; F841-L897 HydrophobicContact CE2-CD2 4.45Å; F841-L897 HydrophobicContact CZ-CD2 4.2Å; F841-I911 HydrophobicContact CD2-CG2 4.33Å; F841-I914 HydrophobicContact CB-CB 4.48Å; F841-I914 HydrophobicContact CB-CG1 3.94Å
842	F	94.7	Very high	84.6	Confident	33 Å²	33	41.8 Å²	41.8	15%	0.145	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	147.9	166.8	-73.1	-95.1	0	0	0	110.5	H791 W880 K881 Q882 I911 D912 D913	H791-F842 AromaticContact CD2-CD1 3.54Å; H791-F842 AromaticContact CD2-CE1 3.85Å; H791-F842 AromaticContact CD2-CG 3.91Å; H791-F842 AromaticContact CE1-CD1 3.71Å; H791-F842 AromaticContact CE1-CD2 3.78Å; H791-F842 AromaticContact CE1-CE1 3.43Å; H791-F842 VanDerWaalsContact CE1-CE1 3.43Å; H791-F842 WeakPolarHBondContact CE1-CE1 3.46Å; H791-F842 AromaticContact CE1-CE2 3.48Å; H791-F842 VanDerWaalsContact CE1-CE2 3.48Å; H791-F842 WeakPolarHBondContact CE1-CE2 3.39Å; H791-F842 AromaticContact CE1-CG 3.87Å; H791-F842 AromaticContact CE1-CZ 3.3Å; H791-F842 WeakPolarHBondContact CE1-CZ 3.34Å; H791-F842 AromaticContact CG-CD1 3.99Å; H791-F842 AromaticContact CG-CG 3.87Å; H791-F842 AromaticContact ND1-CD2 3.76Å; H791-F842 AromaticContact ND1-CE2 3.89Å; H791-F842 AromaticContact ND1-CG 3.84Å; H791-F842 AromaticContact NE2-CD1 3.36Å; H791-F842 WeakPolarHBondContact NE2-CD1 3.26Å; H791-F842 AromaticContact NE2-CE1 3.13Å; H791-F842 WeakPolarHBondContact NE2-CE1 3.13Å; H791-F842 AromaticContact NE2-CG 3.93Å; H791-F842 AromaticContact NE2-CZ 3.54Å; F842-W880 HydrophobicContact CB-CE3 4.19Å; F842-K881 CarbonylContact C-O 3.48Å; F842-K881 VanDerWaalsContact CA-O 3.29Å; F842-K881 WeakPolarHBondContact CA-O 3.4Å; F842-Q882 HydrophobicContact CD1-CB 3.94Å; F842-Q882 HydrophobicContact CD1-CG 4.25Å; F842-Q882 HydrophobicContact CD2-CG 4.12Å; F842-Q882 HydrophobicContact CE1-CB 3.56Å; F842-Q882 HydrophobicContact CE1-CG 3.9Å; F842-Q882 HydrophobicContact CE2-CB 4.39Å; F842-Q882 HydrophobicContact CE2-CG 3.79Å; F842-Q882 VanDerWaalsContact CE2-NE2 3.25Å; F842-Q882 HydrophobicContact CG-CG 4.37Å; F842-Q882 HydrophobicContact CZ-CB 3.82Å; F842-Q882 HydrophobicContact CZ-CG 3.66Å; F842-I911 CarbonylContact O-C 3.59Å; F842-I911 VanDerWaalsContact O-CA 3.24Å; F842-I911 WeakPolarHBondContact O-CA 3.49Å; F842-D912 HydrophobicContact CB-CB 4.41Å; F842-D912 PolarHBondContact N-O 2.95Å; F842-D912 PolarHBondContact O-N 3.24Å; F842-D913 HydrophobicContact CD2-CB 3.62Å; F842-D913 HydrophobicContact CE2-CB 4.24Å
843	Y	95.5	Very high	86.8	Confident	20 Å²	20	36.2 Å²	36.2	8%	0.078	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	149.9	178	66.7	-88.4	0	0	0	111.9	F841 M845 L853 W870 L872 Q876 W880 K881 A883 A910	F841-Y843 HydrophobicContact CD2-CD1 4.42Å; F841-Y843 HydrophobicContact CE2-CD1 4.07Å; F841-Y843 HydrophobicContact CE2-CG 4.48Å; Y843-M845 HydrophobicContact CD2-CB 4.49Å; Y843-M845 HydrophobicContact CD2-CG 4Å; Y843-M845 HydrophobicContact CD2-SD 3.82Å; Y843-M845 HydrophobicContact CE2-SD 4.2Å; Y843-L853 HydrophobicContact CG-CD2 4.38Å; Y843-W870 HydrophobicContact CD1-CH2 4.26Å; Y843-W870 HydrophobicContact CD1-CZ2 4.46Å; Y843-W870 HydrophobicContact CE1-CH2 4.19Å; Y843-W870 HydrophobicContact CE1-CZ2 4.01Å; Y843-L872 HydrophobicContact CD2-CD2 4.39Å; Y843-L872 HydrophobicContact CE2-CD2 3.49Å; Y843-L872 VanDerWaalsContact CE2-CD2 3.49Å; Y843-L872 WeakPolarHBondContact OH-CD2 3.43Å; Y843-Q876 HydrophobicContact CE2-CB 4.48Å; Y843-Q876 HydrophobicContact CE2-CG 4.14Å; Y843-W880 VanDerWaalsContact C-CE3 3.41Å; Y843-W880 WeakPolarHBondContact O-CA 3.4Å; Y843-K881 HydrophobicContact CD1-CB 4.38Å; Y843-K881 VanDerWaalsContact CD1-O 3.28Å; Y843-K881 WeakPolarHBondContact CD1-O 3.38Å; Y843-K881 HydrophobicContact CD2-CB 4.44Å; Y843-K881 HydrophobicContact CE1-CB 3.79Å; Y843-K881 HydrophobicContact CE2-CB 3.86Å; Y843-K881 HydrophobicContact CE2-CD 3.91Å; Y843-K881 HydrophobicContact CE2-CG 4.41Å; Y843-K881 VanDerWaalsContact CZ-CB 3.5Å; Y843-K881 PolarHBondContact N-O 3.06Å; Y843-K881 PolarHBondContact O-N 3.21Å; Y843-K881 WeakPolarHBondContact OH-CD 3.32Å; Y843-A883 HydrophobicContact CD1-CB 4Å; Y843-A883 HydrophobicContact CE1-CB 3.85Å; Y843-A910 CarbonylContact C-O 3.6Å; Y843-A910 VanDerWaalsContact CA-O 3.25Å; Y843-A910 WeakPolarHBondContact CA-O 3.13Å
844	H	94.6	Very high	88.8	Confident	3 Å²	3	29.2 Å²	29.2	1%	0.014	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	129.1	171.5	-173.7	-78.1	0	0	0	108.3	G786 P787 Y846 D878 W880 I909 A910	G786-H844 PolarHBondContact O-CE1 2.79Å; P787-H844 HydrophobicContact CB-CB 4.22Å; P787-H844 HydrophobicContact CG-CB 4.42Å; H844-Y846 VanDerWaalsContact CE1-CB 3.43Å; H844-Y846 WeakPolarHBondContact CE1-CB 3.43Å; H844-D878 IonicContact CD2-OD1 3.75Å; H844-D878 IonicContact CE1-OD1 3.75Å; H844-D878 PolarHBondContact CE1-OD1 3.24Å; H844-D878 IonicContact NE2-OD1 3.69Å; H844-D878 PolarHBondContact NE2-OD1 2.9Å; H844-W880 HydrophobicContact CB-CD2 3.94Å; H844-W880 HydrophobicContact CB-CE3 3.73Å; H844-W880 HydrophobicContact CB-CH2 4.24Å; H844-W880 HydrophobicContact CB-CZ2 4.43Å; H844-W880 HydrophobicContact CB-CZ3 3.88Å; H844-I909 WeakPolarHBondContact O-CA 3.3Å; H844-A910 HydrophobicContact CB-CB 4.31Å; H844-A910 PolarHBondContact N-O 2.95Å; H844-A910 PolarHBondContact O-N 3.29Å
845	M	93.4	Very high	90.4	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	66.6	-170.8	-76.9	178.5	72	0	0	109.2	Y843 I850 L853 L872 N875 Q876 I909	Y843-M845 HydrophobicContact CD2-CB 4.49Å; Y843-M845 HydrophobicContact CD2-CG 4Å; Y843-M845 HydrophobicContact CD2-SD 3.82Å; Y843-M845 HydrophobicContact CE2-SD 4.2Å; M845-I850 HydrophobicContact CB-CG2 4.16Å; M845-I850 HydrophobicContact CE-CG2 3.53Å; M845-I850 HydrophobicContact CG-CG2 4.49Å; M845-L853 HydrophobicContact CE-CB 4.24Å; M845-L853 HydrophobicContact SD-CB 3.89Å; M845-L853 HydrophobicContact SD-CD2 4.26Å; M845-L872 HydrophobicContact CE-CG 4.49Å; M845-L872 HydrophobicContact SD-CD2 4.11Å; M845-L872 HydrophobicContact SD-CG 4.38Å; M845-N875 PolarHBondContact O-OD1 2.91Å; M845-Q876 HydrophobicContact CB-CB 3.87Å; M845-Q876 HydrophobicContact CB-CG 3.64Å; M845-Q876 HydrophobicContact CG-CG 4.47Å; M845-Q876 PolarHBondContact O-N 3.12Å; M845-Q876 HydrophobicContact SD-CG 4.17Å; M845-I909 HydrophobicContact CE-CD1 4.03Å; M845-I909 HydrophobicContact CG-CB 4.32Å; M845-I909 HydrophobicContact CG-CD1 4.36Å; M845-I909 HydrophobicContact CG-CG1 4.04Å; M845-I909 HydrophobicContact CG-CG2 3.68Å; M845-I909 HydrophobicContact SD-CG2 4.47Å
846	Y	90.9	Very high	91.6	Very high	77 Å²	77	24.7 Å²	24.7	30%	0.302	11%	0.114	S	C	.	.			trans	-114.5	120.6	-176.7	-179.9	-115.1	0	0	0	112.4	N784 T785 H844 N875 D878	N784-Y846 WeakPolarHBondContact O-CD1 3.47Å; N784-Y846 WeakPolarHBondContact O-CE1 3.45Å; T785-Y846 WeakPolarHBondContact CB-O 3.42Å; T785-Y846 VanDerWaalsContact CG2-O 3.32Å; T785-Y846 WeakPolarHBondContact CG2-O 3.23Å; H844-Y846 VanDerWaalsContact CE1-CB 3.43Å; H844-Y846 WeakPolarHBondContact CE1-CB 3.43Å; Y846-N875 WeakPolarHBondContact CD2-OD1 3.39Å; Y846-D878 HydrophobicContact CD1-CB 3.77Å; Y846-D878 HydrophobicContact CD2-CB 3.88Å; Y846-D878 VanDerWaalsContact CD2-N 3.34Å; Y846-D878 HydrophobicContact CE1-CB 3.97Å; Y846-D878 HydrophobicContact CE2-CB 4.07Å; Y846-D878 HydrophobicContact CG-CB 3.72Å
847	G	87.9	Confident	92.1	Very high	5 Å²	5	25.3 Å²	25.3	5%	0.052	12%	0.115	C	C	.	.	S	Bend	trans	163.9	168.8	179.3	0	0	0	0	0	112.5	T785 N875 E906	T785-G847 VanDerWaalsContact CG2-CA 3.49Å; G847-N875 WeakPolarHBondContact O-CB 3.36Å; G847-N875 PolarHBondContact O-ND2 2.77Å; G847-E906 CarbonylContact C-O 3.57Å; G847-E906 WeakPolarHBondContact CA-O 3.31Å
848	K	87.4	Confident	92.2	Very high	162 Å²	162	27.8 Å²	27.8	70%	0.704	13%	0.127	S	C	*	.	S	Bend	trans	-78.3	-27.2	-180	-179	-179.5	163	-159.2	0	113.1	E906	K848-E906 HydrophobicContact CB-CB 4.35Å; K848-E906 WeakPolarHBondContact CB-OE2 3.26Å; K848-E906 WeakPolarHBondContact CD-OE2 3.41Å; K848-E906 PolarHBondContact N-O 3.15Å; K848-E906 VanDerWaalsContact N-O 3.1Å
849	H	91.9	Very high	91.9	Very high	41 Å²	41	29.3 Å²	29.3	19%	0.19	13%	0.133	C	C	.	.	S	Bend	trans	-121.8	25.8	-171.1	-49.1	104.8	0	0	0	112.5	G851 G902 P903 E906	H849-G851 PolarHBondContact O-N 2.9Å; H849-G902 WeakPolarHBondContact O-CA 3.37Å; H849-P903 HydrophobicContact CB-CG 4.35Å; H849-E906 WeakPolarHBondContact CA-O 3.36Å; H849-E906 IonicContact CE1-OE2 3.52Å; H849-E906 PolarHBondContact CE1-OE2 2.88Å; H849-E906 PolarHBondContact N-O 2.79Å; H849-E906 IonicContact ND1-OE2 2.72Å; H849-E906 PolarHBondContact ND1-OE2 3.45Å
850	I	92.3	Very high	90.8	Very high	13 Å²	13	35.9 Å²	35.9	7%	0.067	16%	0.162	C	C	.	.			trans	-53	123.7	174.1	-62.7	-71.8	0	0	0	109.7	M845 G874 D908 I909	M845-I850 HydrophobicContact CB-CG2 4.16Å; M845-I850 HydrophobicContact CE-CG2 3.53Å; M845-I850 HydrophobicContact CG-CG2 4.49Å; I850-G874 WeakPolarHBondContact CG2-O 3.15Å; I850-D908 WeakPolarHBondContact CD1-O 3.35Å; I850-I909 HydrophobicContact CD1-CG1 4.28Å; I850-I909 HydrophobicContact CG2-CD1 4.18Å; I850-I909 HydrophobicContact CG2-CG1 4.25Å
851	G	92.4	Very high	89.4	Confident	11 Å²	11	39.6 Å²	39.6	11%	0.113	20%	0.2	C	C	.	.			trans	-82.1	-113.2	176.9	0	0	0	0	0	111.9	H849 S873 G874 I900	H849-G851 PolarHBondContact O-N 2.9Å; G851-S873 VanDerWaalsContact O-CA 3.28Å; G851-S873 WeakPolarHBondContact O-CA 3.38Å; G851-G874 PolarHBondContact O-N 2.92Å; G851-I900 WeakPolarHBondContact CA-O 3.39Å
852	K	95.4	Very high	88.3	Confident	98 Å²	98	41.6 Å²	41.6	43%	0.426	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	151.5	-179.5	-54.2	-162.7	175.9	-176.8	0	112.6	L872 I900 I909	K852-L872 CarbonylContact C-O 3.58Å; K852-L872 VanDerWaalsContact CA-O 3.31Å; K852-L872 WeakPolarHBondContact CA-O 3.43Å; K852-I900 HydrophobicContact CB-CB 4.2Å; K852-I900 HydrophobicContact CB-CD1 4.37Å; K852-I900 HydrophobicContact CB-CG1 4.42Å; K852-I900 PolarHBondContact N-O 2.88Å; K852-I900 VanDerWaalsContact N-O 3.07Å; K852-I900 PolarHBondContact O-N 2.9Å; K852-I909 WeakPolarHBondContact O-CD1 3.28Å
853	L	96.6	Very high	86.5	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	122.4	163.2	-175.4	59.9	0	0	0	108	W769 F841 Y843 M845 W870 S871 L872 E898 I909 I911	W769-L853 HydrophobicContact CH2-CD1 3.67Å; W769-L853 HydrophobicContact CZ2-CD1 3.79Å; F841-L853 HydrophobicContact CE2-CD2 3.92Å; Y843-L853 HydrophobicContact CG-CD2 4.38Å; M845-L853 HydrophobicContact CE-CB 4.24Å; M845-L853 HydrophobicContact SD-CB 3.89Å; M845-L853 HydrophobicContact SD-CD2 4.26Å; L853-W870 HydrophobicContact CB-CZ3 4.1Å; L853-W870 HydrophobicContact CD2-CH2 4.33Å; L853-W870 HydrophobicContact CD2-CZ3 4.08Å; L853-W870 HydrophobicContact CG-CZ3 3.94Å; L853-W870 WeakPolarHBondContact O-CZ3 3.26Å; L853-S871 WeakPolarHBondContact O-CA 3.47Å; L853-L872 PolarHBondContact N-O 2.85Å; L853-L872 PolarHBondContact O-N 3.28Å; L853-E898 WeakPolarHBondContact CA-O 3.41Å; L853-I909 HydrophobicContact CB-CD1 4.42Å; L853-I909 HydrophobicContact CB-CG2 4.27Å; L853-I909 HydrophobicContact CD1-CG2 4.18Å; L853-I909 HydrophobicContact CD2-CG2 4Å; L853-I909 HydrophobicContact CG-CG2 4.38Å; L853-I911 HydrophobicContact CD1-CG2 4.21Å; L853-I911 HydrophobicContact CD2-CG2 3.79Å
854	N	95.7	Very high	85.1	Confident	10 Å²	10	52.8 Å²	52.8	5%	0.053	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	147.7	178.5	-54.3	-40.1	0	0	0	110.1	F856 P868 W870 S871 L897 E898 I900	N854-F856 HydrophobicContact CB-CD2 4.23Å; N854-F856 HydrophobicContact CB-CE2 3.56Å; N854-F856 HydrophobicContact CB-CZ 3.99Å; N854-P868 HydrophobicContact CB-CB 4.15Å; N854-W870 CarbonylContact C-O 3.59Å; N854-W870 WeakPolarHBondContact CA-O 3.27Å; N854-S871 WeakPolarHBondContact OD1-CB 3.48Å; N854-S871 PolarHBondContact OD1-OG 3.09Å; N854-L897 WeakPolarHBondContact O-CA 3.22Å; N854-E898 HydrophobicContact CB-CB 4.25Å; N854-E898 PolarHBondContact N-O 3.12Å; N854-E898 PolarHBondContact ND2-OE1 3.1Å; N854-E898 PolarHBondContact O-N 2.91Å; N854-I900 WeakPolarHBondContact ND2-CD1 3.48Å
855	A	93.6	Very high	83.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	129.7	164.8	0	0	0	0	0	109.2	F839 P868 V869 W870 V896 L897	F839-A855 HydrophobicContact CE1-CB 4.09Å; A855-P868 CarbonylContact O-C 3.57Å; A855-P868 VanDerWaalsContact O-CA 3.31Å; A855-P868 WeakPolarHBondContact O-CA 3.31Å; A855-P868 WeakPolarHBondContact O-CB 3.38Å; A855-V869 HydrophobicContact CB-CG2 4.25Å; A855-V869 VanDerWaalsContact O-CG2 3.29Å; A855-V869 WeakPolarHBondContact O-CG2 3.04Å; A855-V869 PolarHBondContact O-N 3.49Å; A855-W870 HydrophobicContact CB-CB 4.21Å; A855-W870 PolarHBondContact N-O 3.34Å; A855-W870 PolarHBondContact O-N 3.07Å; A855-V896 CarbonylContact C-O 3.59Å; A855-V896 WeakPolarHBondContact CA-O 3.28Å; A855-L897 HydrophobicContact CB-CD2 3.76Å
856	F	92.7	Very high	83	Confident	18 Å²	18	61.6 Å²	61.6	8%	0.079	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	145.3	177.4	-59.4	-94.2	0	0	0	111.2	N854 L865 E866 P868 V895 V896 E898	N854-F856 HydrophobicContact CB-CD2 4.23Å; N854-F856 HydrophobicContact CB-CE2 3.56Å; N854-F856 HydrophobicContact CB-CZ 3.99Å; F856-L865 HydrophobicContact CB-CD2 4.06Å; F856-L865 HydrophobicContact CD1-CB 4.17Å; F856-L865 HydrophobicContact CD2-CD1 4.33Å; F856-L865 HydrophobicContact CG-CD1 4.28Å; F856-E866 VanDerWaalsContact CD1-O 3.26Å; F856-E866 WeakPolarHBondContact CD1-O 3.17Å; F856-E866 WeakPolarHBondContact CE1-O 3.25Å; F856-P868 HydrophobicContact CD1-CB 3.86Å; F856-P868 HydrophobicContact CE1-CB 3.71Å; F856-P868 HydrophobicContact CE1-CG 4.16Å; F856-P868 HydrophobicContact CG-CB 4.37Å; F856-P868 HydrophobicContact CZ-CB 4.08Å; F856-V895 WeakPolarHBondContact O-CA 3.5Å; F856-V896 HydrophobicContact CB-CB 4.33Å; F856-V896 PolarHBondContact N-O 3.1Å; F856-V896 PolarHBondContact O-N 2.83Å; F856-E898 HydrophobicContact CD2-CB 4.34Å; F856-E898 HydrophobicContact CE2-CB 3.82Å; F856-E898 HydrophobicContact CE2-CG 4.4Å; F856-E898 WeakPolarHBondContact CE2-OE1 3.25Å
857	L	88.4	Confident	82.5	Confident	24 Å²	24	62 Å²	62	13%	0.126	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	122.8	167.7	-176.7	62	0	0	0	109.1	V869 I887 P889 F893	L857-V869 HydrophobicContact CB-CG1 3.84Å; L857-I887 HydrophobicContact CD1-CD1 4.09Å; L857-I887 HydrophobicContact CD2-CB 4.44Å; L857-P889 HydrophobicContact CD1-CB 4.42Å; L857-P889 HydrophobicContact CD2-CB 4.25Å; L857-F893 HydrophobicContact CD1-CB 3.83Å; L857-F893 HydrophobicContact CD1-CD2 3.52Å; L857-F893 HydrophobicContact CD1-CE2 4.36Å; L857-F893 HydrophobicContact CD1-CG 3.93Å
858	K	85.3	Confident	82.5	Confident	61 Å²	61	64.2 Å²	64.2	27%	0.265	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	116.1	179.6	-174.9	-179.8	-175.5	175.3	0	110	L865 F893 Q894 V896	K858-L865 HydrophobicContact CB-CD2 3.87Å; K858-L865 HydrophobicContact CD-CD2 4.06Å; K858-L865 HydrophobicContact CG-CD2 4.04Å; K858-F893 CarbonylContact O-C 3.58Å; K858-F893 VanDerWaalsContact O-CA 3.28Å; K858-F893 WeakPolarHBondContact O-CA 3.4Å; K858-Q894 HydrophobicContact CB-CB 4.45Å; K858-Q894 PolarHBondContact N-O 2.81Å; K858-Q894 PolarHBondContact O-N 3.34Å; K858-V896 HydrophobicContact CB-CG2 4.28Å; K858-V896 HydrophobicContact CD-CG2 4.35Å
859	Q	82.8	Confident	82.7	Confident	36 Å²	36	59.2 Å²	59.2	17%	0.168	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	152.6	-176.4	-65	-148.6	40.9	0	0	113.4	G861 Q862 T890 S891	Q859-G861 PolarHBondContact O-N 2.99Å; Q859-G861 VanDerWaalsContact O-N 3.12Å; Q859-Q862 HydrophobicContact CB-CB 4.31Å; Q859-Q862 WeakPolarHBondContact O-CB 3.43Å; Q859-Q862 PolarHBondContact O-N 2.91Å; Q859-T890 PolarHBondContact NE2-OG1 3.25Å; Q859-T890 PolarHBondContact OE1-OG1 2.67Å; Q859-T890 VanDerWaalsContact OE1-OG1 3.06Å; Q859-S891 PolarHBondContact OE1-OG 2.81Å
860	K	69.1	Low	82.8	Confident	142 Å²	142	59.7 Å²	59.7	62%	0.617	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	108.8	-176.4	-178.9	176.8	178.7	-178.8	0	111.5	F820 S892	F820-K860 HydrophobicContact CE1-CB 4.2Å; K860-S892 WeakPolarHBondContact CB-O 3.12Å; K860-S892 PolarHBondContact N-O 2.93Å
861	G	62.8	Low	82.9	Confident	77 Å²	77	61.9 Å²	61.9	79%	0.794	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.2	-9.3	-175.6	0	0	0	0	0	113.6	Q859	Q859-G861 PolarHBondContact O-N 2.99Å; Q859-G861 VanDerWaalsContact O-N 3.12Å
862	Q	70.8	Confident	83	Confident	42 Å²	42	63.3 Å²	63.3	20%	0.196	35%	0.352	C	S	.	.			trans	-81.4	122.8	176.1	-155.6	-179.3	18.5	0	0	109.6	Q859 E866	Q859-Q862 HydrophobicContact CB-CB 4.31Å; Q859-Q862 WeakPolarHBondContact O-CB 3.43Å; Q859-Q862 PolarHBondContact O-N 2.91Å; Q862-E866 PolarHBondContact NE2-OE1 2.83Å; Q862-E866 PolarHBondContact NE2-OE2 3.46Å
863	M	57.3	Low	82.9	Confident	186 Å²	186	62 Å²	62	92%	0.916	35%	0.354	S	S	*	.			trans	-88.7	-23.2	-177.6	-72.3	-174.6	65.4	0	0	114
864	T	64.8	Low	82.7	Confident	102 Å²	102	63.2 Å²	63.2	63%	0.626	37%	0.367	S	S	*	.	S	Bend	trans	-118.2	141.6	-178.5	49.5	0	0	0	0	110.3
865	L	70	Confident	82.5	Confident	56 Å²	56	66.8 Å²	66.8	29%	0.293	39%	0.386	S	S	.	.			trans	-69.2	136.5	167.9	-64.6	173	0	0	0	109.3	F856 K858 V896	F856-L865 HydrophobicContact CB-CD2 4.06Å; F856-L865 HydrophobicContact CD1-CB 4.17Å; F856-L865 HydrophobicContact CD2-CD1 4.33Å; F856-L865 HydrophobicContact CG-CD1 4.28Å; K858-L865 HydrophobicContact CB-CD2 3.87Å; K858-L865 HydrophobicContact CD-CD2 4.06Å; K858-L865 HydrophobicContact CG-CD2 4.04Å; L865-V896 HydrophobicContact CD2-CG2 4.25Å
866	E	74.4	Confident	82.5	Confident	133 Å²	133	69 Å²	69	62%	0.621	40%	0.397	S	S	*	.			trans	-83.1	-168.7	171.5	-82.6	171.1	-164	0	0	110.9	F856 Q862	F856-E866 VanDerWaalsContact CD1-O 3.26Å; F856-E866 WeakPolarHBondContact CD1-O 3.17Å; F856-E866 WeakPolarHBondContact CE1-O 3.25Å; Q862-E866 PolarHBondContact NE2-OE1 2.83Å; Q862-E866 PolarHBondContact NE2-OE2 3.46Å
867	A	80.2	Confident	82.3	Confident	85 Å²	85	69.4 Å²	69.4	70%	0.702	41%	0.406	S	S	*	.	S	Bend	trans	-57.7	145.3	172.7	0	0	0	0	0	111	V869	A867-V869 PolarHBondContact O-N 2.98Å
868	P	89.3	Confident	82.3	Confident	51 Å²	51	72.6 Å²	72.6	33%	0.331	42%	0.423	S	S	.	.			trans	-65.5	136.8	-179.5	27.4	-34	0	0	0	110.9	N854 A855 F856 W870	N854-P868 HydrophobicContact CB-CB 4.15Å; A855-P868 CarbonylContact O-C 3.57Å; A855-P868 VanDerWaalsContact O-CA 3.31Å; A855-P868 WeakPolarHBondContact O-CA 3.31Å; A855-P868 WeakPolarHBondContact O-CB 3.38Å; F856-P868 HydrophobicContact CD1-CB 3.86Å; F856-P868 HydrophobicContact CE1-CB 3.71Å; F856-P868 HydrophobicContact CE1-CG 4.16Å; F856-P868 HydrophobicContact CG-CB 4.37Å; F856-P868 HydrophobicContact CZ-CB 4.08Å; P868-W870 PolarHBondContact O-N 3.4Å
869	V	90.1	Very high	82.6	Confident	57 Å²	57	78.1 Å²	78.1	35%	0.345	44%	0.442	S	S	.	.	S	Bend	trans	-70.8	-19.7	174.5	-66.1	0	0	0	0	112	A855 L857 A867 V885 I887	A855-V869 HydrophobicContact CB-CG2 4.25Å; A855-V869 VanDerWaalsContact O-CG2 3.29Å; A855-V869 WeakPolarHBondContact O-CG2 3.04Å; A855-V869 PolarHBondContact O-N 3.49Å; L857-V869 HydrophobicContact CB-CG1 3.84Å; A867-V869 PolarHBondContact O-N 2.98Å; V869-V885 HydrophobicContact CB-CG1 4.26Å; V869-V885 HydrophobicContact CG2-CG1 4.23Å; V869-I887 HydrophobicContact CB-CG2 4.25Å; V869-I887 HydrophobicContact CG1-CG2 4.36Å; V869-I887 HydrophobicContact CG2-CG2 3.97Å
870	W	93.9	Very high	83.1	Confident	52 Å²	52	78.5 Å²	78.5	20%	0.197	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	142.7	170.2	-179	97.4	0	0	0	110.2	F841 Y843 L853 N854 A855 P868 L872 A883 V885	F841-W870 HydrophobicContact CE2-CH2 4.2Å; F841-W870 HydrophobicContact CE2-CZ3 4.15Å; F841-W870 HydrophobicContact CZ-CD2 4.17Å; F841-W870 AromaticContact CZ-CE3 3.79Å; F841-W870 HydrophobicContact CZ-CE3 3.79Å; F841-W870 AromaticContact CZ-CH2 3.97Å; F841-W870 HydrophobicContact CZ-CH2 3.97Å; F841-W870 HydrophobicContact CZ-CZ2 4.36Å; F841-W870 AromaticContact CZ-CZ3 3.69Å; F841-W870 HydrophobicContact CZ-CZ3 3.69Å; Y843-W870 HydrophobicContact CD1-CH2 4.26Å; Y843-W870 HydrophobicContact CD1-CZ2 4.46Å; Y843-W870 HydrophobicContact CE1-CH2 4.19Å; Y843-W870 HydrophobicContact CE1-CZ2 4.01Å; L853-W870 HydrophobicContact CB-CZ3 4.1Å; L853-W870 HydrophobicContact CD2-CH2 4.33Å; L853-W870 HydrophobicContact CD2-CZ3 4.08Å; L853-W870 HydrophobicContact CG-CZ3 3.94Å; L853-W870 WeakPolarHBondContact O-CZ3 3.26Å; N854-W870 CarbonylContact C-O 3.59Å; N854-W870 WeakPolarHBondContact CA-O 3.27Å; A855-W870 HydrophobicContact CB-CB 4.21Å; A855-W870 PolarHBondContact N-O 3.34Å; A855-W870 PolarHBondContact O-N 3.07Å; P868-W870 PolarHBondContact O-N 3.4Å; W870-L872 HydrophobicContact CH2-CB 3.37Å; W870-L872 HydrophobicContact CH2-CD2 3.79Å; W870-L872 HydrophobicContact CH2-CG 4.24Å; W870-L872 HydrophobicContact CZ2-CB 3.72Å; W870-L872 HydrophobicContact CZ2-CD2 3.83Å; W870-L872 HydrophobicContact CZ2-CG 4.38Å; W870-L872 HydrophobicContact CZ3-CB 3.79Å; W870-A883 HydrophobicContact CH2-CB 4.41Å; W870-A883 HydrophobicContact CZ2-CB 3.75Å; W870-V885 HydrophobicContact CB-CG1 4.12Å; W870-V885 HydrophobicContact CB-CG2 3.62Å; W870-V885 HydrophobicContact CG-CG2 3.76Å
871	S	94.4	Very high	84.2	Confident	58 Å²	58	74.2 Å²	74.2	41%	0.406	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	136.1	177.2	-177.6	0	0	0	0	110.1	L853 N854	L853-S871 WeakPolarHBondContact O-CA 3.47Å; N854-S871 WeakPolarHBondContact OD1-CB 3.48Å; N854-S871 PolarHBondContact OD1-OG 3.09Å
872	L	94.9	Very high	85.6	Confident	42 Å²	42	74.7 Å²	74.7	22%	0.22	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	149.1	175.6	-169.6	62.4	0	0	0	110.1	Y843 M845 K852 L853 W870 Q876	Y843-L872 HydrophobicContact CD2-CD2 4.39Å; Y843-L872 HydrophobicContact CE2-CD2 3.49Å; Y843-L872 VanDerWaalsContact CE2-CD2 3.49Å; Y843-L872 WeakPolarHBondContact OH-CD2 3.43Å; M845-L872 HydrophobicContact CE-CG 4.49Å; M845-L872 HydrophobicContact SD-CD2 4.11Å; M845-L872 HydrophobicContact SD-CG 4.38Å; K852-L872 CarbonylContact C-O 3.58Å; K852-L872 VanDerWaalsContact CA-O 3.31Å; K852-L872 WeakPolarHBondContact CA-O 3.43Å; L853-L872 PolarHBondContact N-O 2.85Å; L853-L872 PolarHBondContact O-N 3.28Å; W870-L872 HydrophobicContact CH2-CB 3.37Å; W870-L872 HydrophobicContact CH2-CD2 3.79Å; W870-L872 HydrophobicContact CH2-CG 4.24Å; W870-L872 HydrophobicContact CZ2-CB 3.72Å; W870-L872 HydrophobicContact CZ2-CD2 3.83Å; W870-L872 HydrophobicContact CZ2-CG 4.38Å; W870-L872 HydrophobicContact CZ3-CB 3.79Å; L872-Q876 HydrophobicContact CD2-CG 3.96Å
873	S	94.2	Very high	86.6	Confident	69 Å²	69	73 Å²	73	48%	0.483	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	150	-174.9	63.4	0	0	0	0	113	G851	G851-S873 VanDerWaalsContact O-CA 3.28Å; G851-S873 WeakPolarHBondContact O-CA 3.38Å
874	G	91.5	Very high	88.2	Confident	26 Å²	26	68.2 Å²	68.2	27%	0.268	37%	0.372	S	S	.	.	S	Bend	trans	72.2	173.4	177.6	0	0	0	0	0	114.5	I850 G851 Q876	I850-G874 WeakPolarHBondContact CG2-O 3.15Å; G851-G874 PolarHBondContact O-N 2.92Å; G874-Q876 WeakPolarHBondContact O-CG 3.38Å; G874-Q876 PolarHBondContact O-N 3.22Å; G874-Q876 PolarHBondContact O-NE2 3.32Å; G874-Q876 VanDerWaalsContact O-NE2 3.16Å
875	N	92.1	Very high	89.4	Confident	86 Å²	86	63.9 Å²	63.9	46%	0.46	35%	0.346	S	S	.	.			trans	-58.6	130.4	-171	-170	0.9	0	0	0	113.5	M845 Y846 G847 G877	M845-N875 PolarHBondContact O-OD1 2.91Å; Y846-N875 WeakPolarHBondContact CD2-OD1 3.39Å; G847-N875 WeakPolarHBondContact O-CB 3.36Å; G847-N875 PolarHBondContact O-ND2 2.77Å; N875-G877 PolarHBondContact OD1-N 3.12Å
876	Q	93.3	Very high	90.3	Very high	46 Å²	46	63 Å²	63	22%	0.215	34%	0.344	C	S	.	.			trans	-109.1	-6.6	-178.7	-63.8	-55.4	-42.4	0	0	113.9	Y843 M845 L872 G874 K881	Y843-Q876 HydrophobicContact CE2-CB 4.48Å; Y843-Q876 HydrophobicContact CE2-CG 4.14Å; M845-Q876 HydrophobicContact CB-CB 3.87Å; M845-Q876 HydrophobicContact CB-CG 3.64Å; M845-Q876 HydrophobicContact CG-CG 4.47Å; M845-Q876 PolarHBondContact O-N 3.12Å; M845-Q876 HydrophobicContact SD-CG 4.17Å; L872-Q876 HydrophobicContact CD2-CG 3.96Å; G874-Q876 WeakPolarHBondContact O-CG 3.38Å; G874-Q876 PolarHBondContact O-N 3.22Å; G874-Q876 PolarHBondContact O-NE2 3.32Å; G874-Q876 VanDerWaalsContact O-NE2 3.16Å; Q876-K881 HydrophobicContact CB-CD 4.36Å; Q876-K881 WeakPolarHBondContact O-CE 3.41Å; Q876-K881 PolarHBondContact O-NZ 2.67Å
877	G	87.8	Confident	90.9	Very high	26 Å²	26	56.9 Å²	56.9	27%	0.268	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	90.6	155.5	-173.9	0	0	0	0	0	113	N875 R879	N875-G877 PolarHBondContact OD1-N 3.12Å; G877-R879 VanDerWaalsContact C-N 3.29Å; G877-R879 PolarHBondContact O-N 2.79Å
878	D	90.3	Very high	91.2	Very high	92 Å²	92	56.6 Å²	56.6	49%	0.492	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	76.3	-177.6	-172	15.4	0	0	0	111.9	H844 Y846	H844-D878 IonicContact CD2-OD1 3.75Å; H844-D878 IonicContact CE1-OD1 3.75Å; H844-D878 PolarHBondContact CE1-OD1 3.24Å; H844-D878 IonicContact NE2-OD1 3.69Å; H844-D878 PolarHBondContact NE2-OD1 2.9Å; Y846-D878 HydrophobicContact CD1-CB 3.77Å; Y846-D878 HydrophobicContact CD2-CB 3.88Å; Y846-D878 VanDerWaalsContact CD2-N 3.34Å; Y846-D878 HydrophobicContact CE1-CB 3.97Å; Y846-D878 HydrophobicContact CE2-CB 4.07Å; Y846-D878 HydrophobicContact CG-CB 3.72Å
879	R	90.7	Very high	90.8	Very high	176 Å²	176	54.1 Å²	54.1	66%	0.664	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-164.8	150.5	165.9	58.8	-179.5	179.9	171.8	1.9	110.3	G877	G877-R879 VanDerWaalsContact C-N 3.29Å; G877-R879 PolarHBondContact O-N 2.79Å
880	W	92.6	Very high	90.2	Very high	44 Å²	44	57 Å²	57	17%	0.167	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	142	165	-66.8	105.2	0	0	0	110.9	P787 A789 D790 H791 Y799 F842 Y843 H844 A910 D912	P787-W880 HydrophobicContact CB-CZ2 3.68Å; P787-W880 HydrophobicContact CG-CH2 4.11Å; P787-W880 HydrophobicContact CG-CZ2 3.59Å; A789-W880 PolarHBondContact O-NE1 2.8Å; D790-W880 PolarHBondContact O-NE1 2.71Å; H791-W880 HydrophobicContact CB-CD2 4.27Å; H791-W880 HydrophobicContact CB-CG 4.31Å; Y799-W880 HydrophobicContact CD1-CZ2 4.27Å; Y799-W880 HydrophobicContact CD2-CH2 4.34Å; Y799-W880 HydrophobicContact CG-CH2 4.07Å; Y799-W880 HydrophobicContact CG-CZ2 4.09Å; F842-W880 HydrophobicContact CB-CE3 4.19Å; Y843-W880 VanDerWaalsContact C-CE3 3.41Å; Y843-W880 WeakPolarHBondContact O-CA 3.4Å; H844-W880 HydrophobicContact CB-CD2 3.94Å; H844-W880 HydrophobicContact CB-CE3 3.73Å; H844-W880 HydrophobicContact CB-CH2 4.24Å; H844-W880 HydrophobicContact CB-CZ2 4.43Å; H844-W880 HydrophobicContact CB-CZ3 3.88Å; W880-A910 HydrophobicContact CH2-CB 3.63Å; W880-A910 HydrophobicContact CZ2-CB 4.46Å; W880-A910 HydrophobicContact CZ3-CB 4.12Å; W880-D912 HydrophobicContact CE3-CB 4.31Å; W880-D912 HydrophobicContact CH2-CB 3.73Å; W880-D912 HydrophobicContact CZ2-CB 4.4Å; W880-D912 HydrophobicContact CZ3-CB 3.68Å
881	K	92.4	Very high	89.2	Confident	52 Å²	52	56.4 Å²	56.4	23%	0.226	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	148	173.8	-67.4	-177.6	-175.2	-179.5	0	108.9	F842 Y843 Q876	F842-K881 CarbonylContact C-O 3.48Å; F842-K881 VanDerWaalsContact CA-O 3.29Å; F842-K881 WeakPolarHBondContact CA-O 3.4Å; Y843-K881 HydrophobicContact CD1-CB 4.38Å; Y843-K881 VanDerWaalsContact CD1-O 3.28Å; Y843-K881 WeakPolarHBondContact CD1-O 3.38Å; Y843-K881 HydrophobicContact CD2-CB 4.44Å; Y843-K881 HydrophobicContact CE1-CB 3.79Å; Y843-K881 HydrophobicContact CE2-CB 3.86Å; Y843-K881 HydrophobicContact CE2-CD 3.91Å; Y843-K881 HydrophobicContact CE2-CG 4.41Å; Y843-K881 VanDerWaalsContact CZ-CB 3.5Å; Y843-K881 PolarHBondContact N-O 3.06Å; Y843-K881 PolarHBondContact O-N 3.21Å; Y843-K881 WeakPolarHBondContact OH-CD 3.32Å; Q876-K881 HydrophobicContact CB-CD 4.36Å; Q876-K881 WeakPolarHBondContact O-CE 3.41Å; Q876-K881 PolarHBondContact O-NZ 2.67Å
882	Q	93.2	Very high	88.3	Confident	88 Å²	88	54.8 Å²	54.8	41%	0.411	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	140.8	171.3	-154.1	174.5	35.4	0	0	111	F841 F842 K884	F841-Q882 WeakPolarHBondContact O-CA 3.33Å; F842-Q882 HydrophobicContact CD1-CB 3.94Å; F842-Q882 HydrophobicContact CD1-CG 4.25Å; F842-Q882 HydrophobicContact CD2-CG 4.12Å; F842-Q882 HydrophobicContact CE1-CB 3.56Å; F842-Q882 HydrophobicContact CE1-CG 3.9Å; F842-Q882 HydrophobicContact CE2-CB 4.39Å; F842-Q882 HydrophobicContact CE2-CG 3.79Å; F842-Q882 VanDerWaalsContact CE2-NE2 3.25Å; F842-Q882 HydrophobicContact CG-CG 4.37Å; F842-Q882 HydrophobicContact CZ-CB 3.82Å; F842-Q882 HydrophobicContact CZ-CG 3.66Å; Q882-K884 HydrophobicContact CG-CG 4.39Å
883	A	91.2	Very high	87.6	Confident	6 Å²	6	52.8 Å²	52.8	5%	0.05	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	143.5	157.7	0	0	0	0	0	108.8	G840 F841 Y843 W870	G840-A883 VanDerWaalsContact CA-O 3.32Å; G840-A883 WeakPolarHBondContact CA-O 3.3Å; F841-A883 HydrophobicContact CD1-CB 4.08Å; F841-A883 HydrophobicContact CD2-CB 4.35Å; F841-A883 HydrophobicContact CE1-CB 3.62Å; F841-A883 HydrophobicContact CE2-CB 3.91Å; F841-A883 HydrophobicContact CG-CB 4.43Å; F841-A883 HydrophobicContact CZ-CB 3.53Å; F841-A883 PolarHBondContact N-O 3.28Å; F841-A883 PolarHBondContact O-N 3.25Å; Y843-A883 HydrophobicContact CD1-CB 4Å; Y843-A883 HydrophobicContact CE1-CB 3.85Å; W870-A883 HydrophobicContact CH2-CB 4.41Å; W870-A883 HydrophobicContact CZ2-CB 3.75Å
884	K	91.1	Very high	87.3	Confident	85 Å²	85	50.5 Å²	50.5	37%	0.37	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	132.6	168.7	-73.5	-158.5	172.9	-144	0	108.6	F839 Q882 E917 C921	F839-K884 CarbonylContact O-C 3.43Å; F839-K884 WeakPolarHBondContact O-CA 3.45Å; Q882-K884 HydrophobicContact CG-CG 4.39Å; K884-E917 IonicContact NZ-OE1 3.02Å; K884-E917 PolarHBondContact NZ-OE1 3.05Å; K884-C921 HydrophobicContact CB-CB 4.32Å
885	V	89.9	Confident	87.2	Confident	12 Å²	12	49.4 Å²	49.4	7%	0.073	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	116.4	-169.9	-168.8	0	0	0	0	109.5	F839 V869 W870 I887 C921	F839-V885 HydrophobicContact CD1-CB 4.48Å; F839-V885 HydrophobicContact CD1-CG2 4.49Å; F839-V885 PolarHBondContact N-O 2.89Å; F839-V885 PolarHBondContact O-N 2.81Å; V869-V885 HydrophobicContact CB-CG1 4.26Å; V869-V885 HydrophobicContact CG2-CG1 4.23Å; W870-V885 HydrophobicContact CB-CG1 4.12Å; W870-V885 HydrophobicContact CB-CG2 3.62Å; W870-V885 HydrophobicContact CG-CG2 3.76Å; V885-I887 HydrophobicContact CG1-CG2 4.18Å; V885-I887 PolarHBondContact O-N 2.92Å; V885-C921 PolarHBondContact N-SG 3.33Å; V885-C921 PolarHBondContact O-SG 3.18Å
886	S	88.7	Confident	87.3	Confident	38 Å²	38	45.4 Å²	45.4	27%	0.266	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	128.2	168.1	-76.9	0	0	0	0	109.7	Y837 E920 C921	Y837-S886 WeakPolarHBondContact O-CA 3.27Å; S886-E920 WeakPolarHBondContact CB-OE2 3.4Å; S886-E920 PolarHBondContact OG-OE2 3.09Å; S886-C921 PolarHBondContact N-SG 3.32Å; S886-C921 PolarHBondContact OG-N 2.92Å
887	I	87.9	Confident	87.4	Confident	3 Å²	3	43.2 Å²	43.2	2%	0.015	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	138.9	174.2	60	171.3	0	0	0	110.7	A836 Y837 F839 L857 V869 V885 P889 F893 V895 L916	A836-I887 WeakPolarHBondContact CA-O 3.35Å; Y837-I887 PolarHBondContact N-O 2.93Å; Y837-I887 WeakPolarHBondContact O-CG1 3.31Å; Y837-I887 PolarHBondContact O-N 3.48Å; F839-I887 HydrophobicContact CB-CD1 4.24Å; F839-I887 HydrophobicContact CB-CG1 4.49Å; L857-I887 HydrophobicContact CD1-CD1 4.09Å; L857-I887 HydrophobicContact CD2-CB 4.44Å; V869-I887 HydrophobicContact CB-CG2 4.25Å; V869-I887 HydrophobicContact CG1-CG2 4.36Å; V869-I887 HydrophobicContact CG2-CG2 3.97Å; V885-I887 HydrophobicContact CG1-CG2 4.18Å; V885-I887 PolarHBondContact O-N 2.92Å; I887-P889 WeakPolarHBondContact O-CD 3.39Å; I887-F893 HydrophobicContact CD1-CD2 4.28Å; I887-F893 HydrophobicContact CD1-CE2 3.69Å; I887-F893 HydrophobicContact CD1-CZ 4.38Å; I887-V895 HydrophobicContact CD1-CG2 4.07Å; I887-L916 HydrophobicContact CD1-CD1 4.02Å
888	H	86.3	Confident	87.8	Confident	79 Å²	79	42.5 Å²	42.5	37%	0.366	21%	0.212	S	C	.	.			trans	-120	67.6	-175.1	-55.9	90.2	0	0	0	111.4	E920	H888-E920 IonicContact CD2-OE1 2.71Å; H888-E920 IonicContact CE1-OE1 3.5Å; H888-E920 IonicContact CE1-OE2 2.84Å; H888-E920 IonicContact NE2-OE1 3.57Å; H888-E920 PolarHBondContact NE2-OE1 3.07Å; H888-E920 IonicContact NE2-OE2 3.19Å; H888-E920 PolarHBondContact NE2-OE2 2.83Å
889	P	81	Confident	88	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.188	C	C	.	.			trans	-64.4	143.3	179.4	29.4	-36.5	0	0	0	111.6	I823 Y837 L857 I887 F893	I823-P889 HydrophobicContact CD1-CB 4.08Å; I823-P889 HydrophobicContact CD1-CG 4.16Å; I823-P889 WeakPolarHBondContact CD1-O 3.37Å; I823-P889 HydrophobicContact CG1-CG 4.4Å; Y837-P889 HydrophobicContact CD2-CG 3.73Å; Y837-P889 HydrophobicContact CE2-CG 3.79Å; L857-P889 HydrophobicContact CD1-CB 4.42Å; L857-P889 HydrophobicContact CD2-CB 4.25Å; I887-P889 WeakPolarHBondContact O-CD 3.39Å; P889-F893 HydrophobicContact CB-CB 4.03Å; P889-F893 HydrophobicContact CB-CD1 3.46Å; P889-F893 VanDerWaalsContact CB-CD1 3.46Å; P889-F893 HydrophobicContact CB-CD2 4.46Å; P889-F893 HydrophobicContact CB-CE1 3.99Å; P889-F893 HydrophobicContact CB-CG 3.74Å; P889-F893 HydrophobicContact CG-CD1 3.53Å; P889-F893 HydrophobicContact CG-CE1 3.48Å; P889-F893 VanDerWaalsContact CG-CE1 3.48Å; P889-F893 HydrophobicContact CG-CE2 4.49Å; P889-F893 HydrophobicContact CG-CG 4.09Å; P889-F893 HydrophobicContact CG-CZ 3.97Å
890	T	75.9	Confident	88.2	Confident	116 Å²	116	31 Å²	31	71%	0.712	16%	0.163	S	C	*	.	S	Bend	trans	-106.2	-4.6	178.4	48.1	0	0	0	0	113.4	Q859	Q859-T890 PolarHBondContact NE2-OG1 3.25Å; Q859-T890 PolarHBondContact OE1-OG1 2.67Å; Q859-T890 VanDerWaalsContact OE1-OG1 3.06Å
891	S	73.5	Confident	88.1	Confident	40 Å²	40	29.7 Å²	29.7	28%	0.28	16%	0.158	S	C	.	.	S	Bend	trans	-150.1	178	172.1	68.1	0	0	0	0	110.4	I823 Q859 F893	I823-S891 VanDerWaalsContact CD1-O 3.29Å; I823-S891 WeakPolarHBondContact CD1-O 3.42Å; Q859-S891 PolarHBondContact OE1-OG 2.81Å; S891-F893 PolarHBondContact O-N 3.42Å
892	S	74.8	Confident	87.9	Confident	24 Å²	24	27.5 Å²	27.5	17%	0.168	15%	0.15	C	C	.	.	S	Bend	trans	-52.3	138.7	171.6	-55.4	0	0	0	0	110.9	F821 N822 K860	F821-S892 CarbonylContact O-C 3.57Å; F821-S892 VanDerWaalsContact O-CA 3.22Å; F821-S892 WeakPolarHBondContact O-CA 3.32Å; F821-S892 WeakPolarHBondContact O-CB 3.3Å; N822-S892 WeakPolarHBondContact OD1-CB 3.43Å; N822-S892 PolarHBondContact OD1-OG 2.88Å; K860-S892 WeakPolarHBondContact CB-O 3.12Å; K860-S892 PolarHBondContact N-O 2.93Å
893	F	81.3	Confident	87.7	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	165.1	-165	65.6	-81.7	0	0	0	113.1	F820 F821 I823 Y837 L857 K858 I887 P889 S891 V895 L916	F820-F893 WeakPolarHBondContact CA-O 3.04Å; F821-F893 HydrophobicContact CB-CD1 4.1Å; F821-F893 HydrophobicContact CB-CD2 4.3Å; F821-F893 HydrophobicContact CB-CE1 3.67Å; F821-F893 HydrophobicContact CB-CE2 3.9Å; F821-F893 HydrophobicContact CB-CG 4.4Å; F821-F893 HydrophobicContact CB-CZ 3.58Å; F821-F893 HydrophobicContact CD2-CD2 4.17Å; F821-F893 AromaticContact CD2-CE2 3.76Å; F821-F893 HydrophobicContact CD2-CE2 3.76Å; F821-F893 HydrophobicContact CD2-CZ 4.23Å; F821-F893 HydrophobicContact CG-CE2 4.19Å; F821-F893 HydrophobicContact CG-CZ 4.2Å; F821-F893 PolarHBondContact N-O 2.84Å; F821-F893 PolarHBondContact O-N 3.41Å; I823-F893 HydrophobicContact CG1-CD1 4.43Å; I823-F893 HydrophobicContact CG1-CE1 4.43Å; Y837-F893 HydrophobicContact CD2-CE1 4.23Å; Y837-F893 HydrophobicContact CD2-CZ 4.02Å; Y837-F893 AromaticContact CE2-CE1 3.97Å; Y837-F893 HydrophobicContact CE2-CE1 3.97Å; Y837-F893 HydrophobicContact CE2-CZ 4.18Å; Y837-F893 HydrophobicContact CG-CZ 4.31Å; L857-F893 HydrophobicContact CD1-CB 3.83Å; L857-F893 HydrophobicContact CD1-CD2 3.52Å; L857-F893 HydrophobicContact CD1-CE2 4.36Å; L857-F893 HydrophobicContact CD1-CG 3.93Å; K858-F893 CarbonylContact O-C 3.58Å; K858-F893 VanDerWaalsContact O-CA 3.28Å; K858-F893 WeakPolarHBondContact O-CA 3.4Å; I887-F893 HydrophobicContact CD1-CD2 4.28Å; I887-F893 HydrophobicContact CD1-CE2 3.69Å; I887-F893 HydrophobicContact CD1-CZ 4.38Å; P889-F893 HydrophobicContact CB-CB 4.03Å; P889-F893 HydrophobicContact CB-CD1 3.46Å; P889-F893 VanDerWaalsContact CB-CD1 3.46Å; P889-F893 HydrophobicContact CB-CD2 4.46Å; P889-F893 HydrophobicContact CB-CE1 3.99Å; P889-F893 HydrophobicContact CB-CG 3.74Å; P889-F893 HydrophobicContact CG-CD1 3.53Å; P889-F893 HydrophobicContact CG-CE1 3.48Å; P889-F893 VanDerWaalsContact CG-CE1 3.48Å; P889-F893 HydrophobicContact CG-CE2 4.49Å; P889-F893 HydrophobicContact CG-CG 4.09Å; P889-F893 HydrophobicContact CG-CZ 3.97Å; S891-F893 PolarHBondContact O-N 3.42Å; F893-V895 HydrophobicContact CD2-CG2 4.47Å; F893-V895 HydrophobicContact CE2-CG2 4.41Å; F893-L916 HydrophobicContact CE2-CD2 4Å; F893-L916 HydrophobicContact CZ-CD2 4Å
894	Q	87.3	Confident	87.3	Confident	21 Å²	21	27.4 Å²	27.4	10%	0.098	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	154	165.9	-58.4	177	-78.1	0	0	108.3	V817 S818 F820 K858	V817-Q894 HydrophobicContact CG1-CB 4.34Å; V817-Q894 VanDerWaalsContact CG1-NE2 3.3Å; S818-Q894 PolarHBondContact O-NE2 2.96Å; S818-Q894 WeakPolarHBondContact OG-CA 3.49Å; F820-Q894 HydrophobicContact CD1-CG 3.63Å; F820-Q894 HydrophobicContact CD2-CG 4.05Å; F820-Q894 HydrophobicContact CE1-CG 3.7Å; F820-Q894 HydrophobicContact CE2-CG 4.11Å; F820-Q894 HydrophobicContact CG-CG 3.81Å; F820-Q894 HydrophobicContact CZ-CG 3.94Å; F820-Q894 VanDerWaalsContact CZ-OE1 3.25Å; K858-Q894 HydrophobicContact CB-CB 4.45Å; K858-Q894 PolarHBondContact N-O 2.81Å; K858-Q894 PolarHBondContact O-N 3.34Å
895	V	90.1	Very high	86.9	Confident	3 Å²	3	26.8 Å²	26.8	2%	0.018	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	136.9	164.4	-172.6	0	0	0	0	108.2	S818 F839 F856 I887 F893	S818-V895 WeakPolarHBondContact CB-O 3.04Å; S818-V895 PolarHBondContact N-O 2.96Å; S818-V895 PolarHBondContact OG-N 2.91Å; S818-V895 PolarHBondContact OG-O 2.76Å; F839-V895 HydrophobicContact CD1-CG1 4.12Å; F839-V895 HydrophobicContact CD2-CG1 4.31Å; F839-V895 HydrophobicContact CD2-CG2 4.15Å; F839-V895 HydrophobicContact CE1-CG1 3.66Å; F839-V895 HydrophobicContact CE2-CB 4.19Å; F839-V895 HydrophobicContact CE2-CG1 3.87Å; F839-V895 HydrophobicContact CE2-CG2 4.27Å; F839-V895 HydrophobicContact CG-CG1 4.42Å; F839-V895 HydrophobicContact CG-CG2 4.48Å; F839-V895 HydrophobicContact CZ-CB 4.32Å; F839-V895 HydrophobicContact CZ-CG1 3.54Å; F856-V895 WeakPolarHBondContact O-CA 3.5Å; I887-V895 HydrophobicContact CD1-CG2 4.07Å; F893-V895 HydrophobicContact CD2-CG2 4.47Å; F893-V895 HydrophobicContact CE2-CG2 4.41Å
896	V	93.2	Very high	86.7	Confident	2 Å²	2	29.1 Å²	29.1	1%	0.012	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122	176.7	-174.7	0	0	0	0	108.8	R815 L816 V817 A855 F856 K858 L865	R815-V896 HydrophobicContact CB-CG1 3.86Å; R815-V896 HydrophobicContact CG-CG1 4.21Å; L816-V896 WeakPolarHBondContact O-CA 3.39Å; V817-V896 HydrophobicContact CG1-CG2 4.19Å; V817-V896 HydrophobicContact CG2-CG1 4.07Å; V817-V896 HydrophobicContact CG2-CG2 4.12Å; A855-V896 CarbonylContact C-O 3.59Å; A855-V896 WeakPolarHBondContact CA-O 3.28Å; F856-V896 HydrophobicContact CB-CB 4.33Å; F856-V896 PolarHBondContact N-O 3.1Å; F856-V896 PolarHBondContact O-N 2.83Å; K858-V896 HydrophobicContact CB-CG2 4.28Å; K858-V896 HydrophobicContact CD-CG2 4.35Å; L865-V896 HydrophobicContact CD2-CG2 4.25Å
897	L	96	Very high	86.5	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	118.3	173.8	-71	174.5	0	0	0	109.4	W769 R815 L816 F839 F841 N854 A855 I911 I914	W769-L897 PolarHBondContact NE1-O 3.02Å; R815-L897 WeakPolarHBondContact CA-O 3.42Å; L816-L897 PolarHBondContact N-O 2.79Å; L816-L897 PolarHBondContact O-N 3.25Å; F839-L897 HydrophobicContact CE1-CD2 4.03Å; F839-L897 HydrophobicContact CZ-CD1 4.19Å; F839-L897 HydrophobicContact CZ-CD2 4.03Å; F839-L897 HydrophobicContact CZ-CG 4.23Å; F841-L897 HydrophobicContact CE1-CD2 4.25Å; F841-L897 HydrophobicContact CE2-CD2 4.45Å; F841-L897 HydrophobicContact CZ-CD2 4.2Å; N854-L897 WeakPolarHBondContact O-CA 3.22Å; A855-L897 HydrophobicContact CB-CD2 3.76Å; L897-I911 HydrophobicContact CB-CD1 4.21Å; L897-I911 HydrophobicContact CD1-CD1 3.53Å; L897-I914 HydrophobicContact CD1-CD1 3.56Å; L897-I914 HydrophobicContact CD1-CG1 4.44Å
898	E	96.2	Very high	86.6	Confident	11 Å²	11	27.3 Å²	27.3	5%	0.051	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	117.8	-175.2	179.1	-176.5	80.1	0	0	110.9	Q813 A814 R815 L853 N854 F856 I900	Q813-E898 HydrophobicContact CB-CG 4.49Å; Q813-E898 PolarHBondContact OE1-OE2 3.28Å; A814-E898 CarbonylContact O-C 3.47Å; A814-E898 VanDerWaalsContact O-CA 3.24Å; A814-E898 WeakPolarHBondContact O-CA 3.36Å; R815-E898 HydrophobicContact CG-CB 4.05Å; R815-E898 HydrophobicContact CG-CG 3.93Å; R815-E898 IonicContact CZ-OE2 2.66Å; R815-E898 IonicContact NE-OE2 3.42Å; R815-E898 PolarHBondContact NE-OE2 3.23Å; R815-E898 IonicContact NH2-OE2 3.03Å; L853-E898 WeakPolarHBondContact CA-O 3.41Å; N854-E898 HydrophobicContact CB-CB 4.25Å; N854-E898 PolarHBondContact N-O 3.12Å; N854-E898 PolarHBondContact ND2-OE1 3.1Å; N854-E898 PolarHBondContact O-N 2.91Å; F856-E898 HydrophobicContact CD2-CB 4.34Å; F856-E898 HydrophobicContact CE2-CB 3.82Å; F856-E898 HydrophobicContact CE2-CG 4.4Å; F856-E898 WeakPolarHBondContact CE2-OE1 3.25Å; E898-I900 HydrophobicContact CG-CG1 4.06Å
899	G	94.9	Very high	86.9	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	123.4	169.3	0	0	0	0	0	109.5	A814	A814-G899 PolarHBondContact N-O 2.04Å; A814-G899 PolarHBondContact O-N 3.5Å
900	I	93.7	Very high	87.5	Confident	27 Å²	27	23.5 Å²	23.5	14%	0.138	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	126.1	175	-52.8	-176	0	0	0	108.9	D812 Q813 G851 K852 N854 E898	D812-I900 WeakPolarHBondContact O-CA 3.4Å; Q813-I900 HydrophobicContact CG-CG1 4.29Å; G851-I900 WeakPolarHBondContact CA-O 3.39Å; K852-I900 HydrophobicContact CB-CB 4.2Å; K852-I900 HydrophobicContact CB-CD1 4.37Å; K852-I900 HydrophobicContact CB-CG1 4.42Å; K852-I900 PolarHBondContact N-O 2.88Å; K852-I900 VanDerWaalsContact N-O 3.07Å; K852-I900 PolarHBondContact O-N 2.9Å; N854-I900 WeakPolarHBondContact ND2-CD1 3.48Å; E898-I900 HydrophobicContact CG-CG1 4.06Å
901	R	91.6	Very high	88.5	Confident	16 Å²	16	18 Å²	18	6%	0.06	11%	0.105	C	C	.	.			trans	-71.2	131.7	176.7	177.8	175.1	174	-56.6	-11.1	111.9	T804 R808 K809 E810 G811 D812 G904	T804-R901 HydrophobicContact CG2-CB 4.18Å; T804-R901 HydrophobicContact CG2-CG 3.91Å; T804-R901 PolarHBondContact O-NE 3.29Å; T804-R901 PolarHBondContact O-NH2 2.94Å; R808-R901 PolarHBondContact O-NE 2.77Å; K809-R901 WeakPolarHBondContact O-CD 3.43Å; K809-R901 WeakPolarHBondContact O-CG 3.27Å; K809-R901 PolarHBondContact O-NH1 2.89Å; E810-R901 VanDerWaalsContact N-NH1 3.16Å; G811-R901 PolarHBondContact N-O 2.87Å; D812-R901 HydrophobicContact CB-CB 4.32Å; D812-R901 PolarHBondContact O-N 2.83Å; R901-G904 VanDerWaalsContact NH2-C 3.29Å; R901-G904 PolarHBondContact NH2-O 3.1Å
902	G	89.1	Confident	89.4	Confident	5 Å²	5	16.2 Å²	16.2	5%	0.052	9%	0.092	C	C	.	.			trans	-82.8	-164.9	177.2	0	0	0	0	0	115.4	H849 G904	H849-G902 WeakPolarHBondContact O-CA 3.37Å; G902-G904 PolarHBondContact O-N 3.36Å; G902-G904 VanDerWaalsContact O-N 3.07Å
903	P	87.8	Confident	90	Very high	82 Å²	82	16 Å²	16	53%	0.532	9%	0.089	S	C	.	.	S	Bend	trans	-71.1	-2.7	-170.4	26.7	-35.5	0	0	0	115.6	E810 H849	E810-P903 VanDerWaalsContact CD-CA 3.46Å; E810-P903 WeakPolarHBondContact OE1-CB 3.36Å; H849-P903 HydrophobicContact CB-CG 4.35Å
904	G	83.4	Confident	90.5	Very high	11 Å²	11	16 Å²	16	11%	0.113	9%	0.089	C	C	.	.	S	Bend	trans	-156	176.4	-172.7	0	0	0	0	0	112	R901 G902	R901-G904 VanDerWaalsContact NH2-C 3.29Å; R901-G904 PolarHBondContact NH2-O 3.1Å; G902-G904 PolarHBondContact O-N 3.36Å; G902-G904 VanDerWaalsContact O-N 3.07Å
905	I	82.3	Confident	90.5	Very high	72 Å²	72	15.6 Å²	15.6	37%	0.369	9%	0.088	S	C	.	.	S	Bend	trans	-84	-16.9	-174	64.4	172	0	0	0	113.6	T782 T804 G907	T782-I905 HydrophobicContact CG2-CB 3.82Å; T782-I905 HydrophobicContact CG2-CD1 3.93Å; T782-I905 HydrophobicContact CG2-CG1 3.85Å; T782-I905 WeakPolarHBondContact CG2-O 3.44Å; T804-I905 PolarHBondContact OG1-O 3.25Å; I905-G907 PolarHBondContact O-N 3.3Å
906	E	85.9	Confident	90.2	Very high	60 Å²	60	15.5 Å²	15.5	28%	0.28	9%	0.087	S	C	.	.	S	Bend	trans	-84.7	58.3	176.2	-54.8	160	164.9	0	0	108.9	T785 G847 K848 H849	T785-E906 HydrophobicContact CG2-CB 3.71Å; G847-E906 CarbonylContact C-O 3.57Å; G847-E906 WeakPolarHBondContact CA-O 3.31Å; K848-E906 HydrophobicContact CB-CB 4.35Å; K848-E906 WeakPolarHBondContact CB-OE2 3.26Å; K848-E906 WeakPolarHBondContact CD-OE2 3.41Å; K848-E906 PolarHBondContact N-O 3.15Å; K848-E906 VanDerWaalsContact N-O 3.1Å; H849-E906 WeakPolarHBondContact CA-O 3.36Å; H849-E906 IonicContact CE1-OE2 3.52Å; H849-E906 PolarHBondContact CE1-OE2 2.88Å; H849-E906 PolarHBondContact N-O 2.79Å; H849-E906 IonicContact ND1-OE2 2.72Å; H849-E906 PolarHBondContact ND1-OE2 3.45Å
907	G	84.9	Confident	89.7	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.101	C	C	.	.			trans	-134.7	15	-164.6	0	0	0	0	0	115.7	T804 I905	T804-G907 WeakPolarHBondContact CG2-O 3.14Å; T804-G907 VanDerWaalsContact OG1-C 3.22Å; T804-G907 WeakPolarHBondContact OG1-CA 3.19Å; T804-G907 PolarHBondContact OG1-N 2.77Å; I905-G907 PolarHBondContact O-N 3.3Å
908	D	88.7	Confident	88.7	Confident	3 Å²	3	22.6 Å²	22.6	2%	0.016	12%	0.12	C	C	.	.			trans	-69.8	137.8	-170.6	-46.4	-53.2	0	0	0	112.7	T782 T785 T804 I850	T782-D908 PolarHBondContact OG1-OD2 3.07Å; T785-D908 VanDerWaalsContact CB-OD2 3.25Å; T785-D908 WeakPolarHBondContact CB-OD2 3.08Å; T785-D908 PolarHBondContact OG1-OD2 2.91Å; T804-D908 WeakPolarHBondContact CB-OD1 3.19Å; T804-D908 PolarHBondContact N-OD1 3.34Å; T804-D908 PolarHBondContact OG1-N 2.95Å; T804-D908 PolarHBondContact OG1-OD1 2.93Å; I850-D908 WeakPolarHBondContact CD1-O 3.35Å
909	I	93.4	Very high	87.8	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	133.3	-178.2	-58	178.6	0	0	0	108.4	W769 Y801 I802 H844 M845 I850 K852 L853	W769-I909 HydrophobicContact CH2-CG2 4.34Å; Y801-I909 CarbonylContact C-O 3.51Å; Y801-I909 VanDerWaalsContact CA-O 3.24Å; Y801-I909 WeakPolarHBondContact CA-O 3.48Å; Y801-I909 WeakPolarHBondContact CB-O 3.35Å; I802-I909 HydrophobicContact CD1-CB 4.01Å; I802-I909 HydrophobicContact CD1-CD1 4.21Å; I802-I909 HydrophobicContact CD1-CG1 4.17Å; I802-I909 HydrophobicContact CG1-CB 3.73Å; I802-I909 HydrophobicContact CG1-CG1 4.39Å; I802-I909 WeakPolarHBondContact CG1-O 3.44Å; I802-I909 PolarHBondContact N-O 2.89Å; H844-I909 WeakPolarHBondContact O-CA 3.3Å; M845-I909 HydrophobicContact CE-CD1 4.03Å; M845-I909 HydrophobicContact CG-CB 4.32Å; M845-I909 HydrophobicContact CG-CD1 4.36Å; M845-I909 HydrophobicContact CG-CG1 4.04Å; M845-I909 HydrophobicContact CG-CG2 3.68Å; M845-I909 HydrophobicContact SD-CG2 4.47Å; I850-I909 HydrophobicContact CD1-CG1 4.28Å; I850-I909 HydrophobicContact CG2-CD1 4.18Å; I850-I909 HydrophobicContact CG2-CG1 4.25Å; K852-I909 WeakPolarHBondContact O-CD1 3.28Å; L853-I909 HydrophobicContact CB-CD1 4.42Å; L853-I909 HydrophobicContact CB-CG2 4.27Å; L853-I909 HydrophobicContact CD1-CG2 4.18Å; L853-I909 HydrophobicContact CD2-CG2 4Å; L853-I909 HydrophobicContact CG-CG2 4.38Å
910	A	94.1	Very high	87.3	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	153.8	174.7	0	0	0	0	0	112	P787 Y799 M800 Y843 H844 W880	P787-A910 HydrophobicContact CG-CB 3.82Å; Y799-A910 HydrophobicContact CD2-CB 3.83Å; Y799-A910 HydrophobicContact CE2-CB 4.21Å; M800-A910 CarbonylContact O-C 3.46Å; M800-A910 VanDerWaalsContact O-CA 3.25Å; M800-A910 WeakPolarHBondContact O-CA 3.26Å; Y843-A910 CarbonylContact C-O 3.6Å; Y843-A910 VanDerWaalsContact CA-O 3.25Å; Y843-A910 WeakPolarHBondContact CA-O 3.13Å; H844-A910 HydrophobicContact CB-CB 4.31Å; H844-A910 PolarHBondContact N-O 2.95Å; H844-A910 PolarHBondContact O-N 3.29Å; W880-A910 HydrophobicContact CH2-CB 3.63Å; W880-A910 HydrophobicContact CZ2-CB 4.46Å; W880-A910 HydrophobicContact CZ3-CB 4.12Å
911	I	96	Very high	86.9	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	147.5	174.7	60.6	-179.9	0	0	0	110.1	F751 W769 M800 L816 F841 F842 L853 L897	F751-I911 HydrophobicContact CE2-CG1 4.45Å; W769-I911 HydrophobicContact CD2-CD1 4.36Å; W769-I911 HydrophobicContact CE3-CD1 3.97Å; W769-I911 HydrophobicContact CE3-CG1 4.05Å; W769-I911 HydrophobicContact CH2-CD1 3.87Å; W769-I911 HydrophobicContact CH2-CG1 4.06Å; W769-I911 HydrophobicContact CH2-CG2 3.82Å; W769-I911 HydrophobicContact CZ2-CD1 4.23Å; W769-I911 HydrophobicContact CZ3-CB 4.33Å; W769-I911 HydrophobicContact CZ3-CD1 3.73Å; W769-I911 HydrophobicContact CZ3-CG1 3.6Å; W769-I911 HydrophobicContact CZ3-CG2 4.05Å; M800-I911 HydrophobicContact CB-CD1 4.23Å; M800-I911 HydrophobicContact CB-CG1 3.78Å; M800-I911 PolarHBondContact N-O 2.94Å; M800-I911 PolarHBondContact O-N 2.93Å; L816-I911 HydrophobicContact CD2-CD1 4.05Å; F841-I911 HydrophobicContact CD2-CG2 4.33Å; F842-I911 CarbonylContact O-C 3.59Å; F842-I911 VanDerWaalsContact O-CA 3.24Å; F842-I911 WeakPolarHBondContact O-CA 3.49Å; L853-I911 HydrophobicContact CD1-CG2 4.21Å; L853-I911 HydrophobicContact CD2-CG2 3.79Å; L897-I911 HydrophobicContact CB-CD1 4.21Å; L897-I911 HydrophobicContact CD1-CD1 3.53Å
912	D	92.3	Very high	86.3	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.011	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	169.1	-176.5	-154.7	-5.4	0	0	0	110.9	H791 F842 W880 I914	H791-D912 HydrophobicContact CB-CB 4.04Å; H791-D912 WeakPolarHBondContact CB-OD2 3.28Å; H791-D912 PolarHBondContact N-OD2 2.76Å; F842-D912 HydrophobicContact CB-CB 4.41Å; F842-D912 PolarHBondContact N-O 2.95Å; F842-D912 PolarHBondContact O-N 3.24Å; W880-D912 HydrophobicContact CE3-CB 4.31Å; W880-D912 HydrophobicContact CH2-CB 3.73Å; W880-D912 HydrophobicContact CZ2-CB 4.4Å; W880-D912 HydrophobicContact CZ3-CB 3.68Å; D912-I914 PolarHBondContact O-N 2.9Å
913	D	88.4	Confident	84.8	Confident	19 Å²	19	45.4 Å²	45.4	10%	0.102	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	39.6	61.7	173	-83.2	-23.8	0	0	0	114.1	H748 C749 S750 H791 F842	H748-D913 IonicContact CE1-OD1 3.77Å; H748-D913 PolarHBondContact CE1-OD1 3.48Å; H748-D913 VanDerWaalsContact CE1-OD1 3.25Å; H748-D913 IonicContact NE2-OD1 3.29Å; C749-D913 CarbonylContact O-C 3.5Å; C749-D913 WeakPolarHBondContact O-CA 3.39Å; S750-D913 WeakPolarHBondContact CA-OD1 3.27Å; S750-D913 WeakPolarHBondContact CB-OD1 3.2Å; H791-D913 IonicContact CE1-OD2 2.69Å; H791-D913 IonicContact CG-OD2 2.76Å; H791-D913 IonicContact ND1-OD2 3.49Å; H791-D913 PolarHBondContact ND1-OD2 2.83Å; F842-D913 HydrophobicContact CD2-CB 3.62Å; F842-D913 HydrophobicContact CE2-CB 4.24Å
914	I	91.3	Very high	82.8	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	127.8	177.5	-59.3	-176.9	0	0	0	109.9	F747 H748 C749 F751 F759 F839 G840 F841 L897 D912	F747-I914 HydrophobicContact CE1-CG2 4.45Å; H748-I914 CarbonylContact C-O 3.59Å; H748-I914 WeakPolarHBondContact CA-O 3.3Å; C749-I914 HydrophobicContact CB-CB 4.33Å; C749-I914 PolarHBondContact N-O 3.45Å; C749-I914 PolarHBondContact O-N 2.87Å; F751-I914 HydrophobicContact CE2-CD1 4.03Å; F751-I914 HydrophobicContact CE2-CG1 4.09Å; F751-I914 HydrophobicContact CZ-CD1 3.53Å; F751-I914 HydrophobicContact CZ-CG1 4.07Å; F759-I914 HydrophobicContact CE1-CD1 4.09Å; F759-I914 HydrophobicContact CE2-CD1 4.09Å; F759-I914 HydrophobicContact CZ-CD1 3.58Å; F759-I914 HydrophobicContact CZ-CG2 4.21Å; F839-I914 HydrophobicContact CD2-CG2 4.4Å; F839-I914 HydrophobicContact CE2-CG2 3.54Å; F839-I914 HydrophobicContact CZ-CG2 4.2Å; G840-I914 CarbonylContact O-C 3.6Å; G840-I914 WeakPolarHBondContact O-CA 3.36Å; F841-I914 HydrophobicContact CB-CB 4.48Å; F841-I914 HydrophobicContact CB-CG1 3.94Å; L897-I914 HydrophobicContact CD1-CD1 3.56Å; L897-I914 HydrophobicContact CD1-CG1 4.44Å; D912-I914 PolarHBondContact O-N 2.9Å
915	T	87.5	Confident	80.4	Confident	12 Å²	12	51.2 Å²	51.2	7%	0.074	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	152.9	173.9	65.7	0	0	0	0	113.3	F747 G840	F747-T915 CarbonylContact O-C 3.57Å; F747-T915 VanDerWaalsContact O-CA 3.23Å; F747-T915 WeakPolarHBondContact O-CA 3.36Å; G840-T915 WeakPolarHBondContact CA-OG1 3.39Å; G840-T915 PolarHBondContact N-O 2.95Å; G840-T915 PolarHBondContact O-N 2.83Å; G840-T915 VanDerWaalsContact O-O 3.12Å
916	L	83.7	Confident	78.2	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	108.8	169.9	-175.7	67.7	0	0	0	110.3	L744 E746 F747 F821 C838 F839 I887 F893	L744-L916 HydrophobicContact CD1-CD2 4.08Å; L744-L916 HydrophobicContact CD2-CD2 4.28Å; L744-L916 HydrophobicContact CD2-CG 4.45Å; E746-L916 CarbonylContact C-O 3.57Å; E746-L916 WeakPolarHBondContact CA-O 3.17Å; F747-L916 HydrophobicContact CB-CB 4.25Å; F747-L916 HydrophobicContact CD1-CB 4.31Å; F747-L916 PolarHBondContact N-O 2.76Å; F747-L916 PolarHBondContact O-N 2.87Å; F821-L916 HydrophobicContact CB-CD2 4.49Å; F821-L916 HydrophobicContact CD1-CD2 3.93Å; F821-L916 HydrophobicContact CD2-CD2 3.56Å; F821-L916 HydrophobicContact CE1-CD2 3.98Å; F821-L916 HydrophobicContact CE2-CD2 3.61Å; F821-L916 HydrophobicContact CG-CD2 3.72Å; F821-L916 HydrophobicContact CZ-CD2 3.82Å; C838-L916 WeakPolarHBondContact O-CA 3.43Å; F839-L916 HydrophobicContact CB-CD1 3.97Å; F839-L916 HydrophobicContact CD2-CD1 4.31Å; I887-L916 HydrophobicContact CD1-CD1 4.02Å; F893-L916 HydrophobicContact CE2-CD2 4Å; F893-L916 HydrophobicContact CZ-CD2 4Å
917	E	82	Confident	75.6	Confident	65 Å²	65	58.4 Å²	58.4	30%	0.304	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	147.8	-174.8	-60.4	165.5	-127	0	0	110.9	R745 E746 Y837 C838 K884 G919	R745-E917 WeakPolarHBondContact O-CA 3.46Å; E746-E917 HydrophobicContact CG-CG 4.4Å; Y837-E917 CarbonylContact C-O 3.59Å; Y837-E917 WeakPolarHBondContact CA-O 3.41Å; Y837-E917 WeakPolarHBondContact CB-O 3.27Å; C838-E917 HydrophobicContact CB-CB 4.38Å; C838-E917 PolarHBondContact N-O 3.13Å; C838-E917 PolarHBondContact O-N 2.72Å; K884-E917 IonicContact NZ-OE1 3.02Å; K884-E917 PolarHBondContact NZ-OE1 3.05Å; E917-G919 PolarHBondContact O-N 2.89Å
918	E	75.8	Confident	73.1	Confident	87 Å²	87	66.5 Å²	66.5	41%	0.407	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	115.7	171.9	-170.8	-173.3	-176	0	0	111.3	R745 K826 Y837	R745-E918 PolarHBondContact O-N 3.49Å; K826-E918 IonicContact NZ-OE1 3.9Å; K826-E918 PolarHBondContact NZ-OE1 2.92Å; Y837-E918 HydrophobicContact CD1-CB 4.36Å; Y837-E918 HydrophobicContact CE1-CB 4.32Å; Y837-E918 HydrophobicContact CE1-CG 4.29Å
919	G	77.3	Confident	70.4	Confident	28 Å²	28	71.5 Å²	71.5	29%	0.289	39%	0.392	S	S	.	.	S	Bend	trans	139.4	174.9	179.1	0	0	0	0	0	113.7	A836 Y837 C838 E917	A836-G919 CarbonylContact C-O 3.57Å; A836-G919 WeakPolarHBondContact O-CA 3.45Å; A836-G919 PolarHBondContact O-N 2.74Å; Y837-G919 CarbonylContact C-O 3.44Å; Y837-G919 VanDerWaalsContact CA-O 3.25Å; Y837-G919 WeakPolarHBondContact CA-O 3.44Å; Y837-G919 PolarHBondContact N-O 2.93Å; C838-G919 PolarHBondContact N-O 2.81Å; E917-G919 PolarHBondContact O-N 2.89Å
920	E	84.5	Confident	67.4	Low	103 Å²	103	75 Å²	75	48%	0.481	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-69.5	143.6	166.7	-67.1	-65.5	167.6	0	0	110.7	A836 S886 H888 R922	A836-E920 HydrophobicContact CB-CG 4.05Å; A836-E920 WeakPolarHBondContact CB-OE1 3.38Å; S886-E920 WeakPolarHBondContact CB-OE2 3.4Å; S886-E920 PolarHBondContact OG-OE2 3.09Å; H888-E920 IonicContact CD2-OE1 2.71Å; H888-E920 IonicContact CE1-OE1 3.5Å; H888-E920 IonicContact CE1-OE2 2.84Å; H888-E920 IonicContact NE2-OE1 3.57Å; H888-E920 PolarHBondContact NE2-OE1 3.07Å; H888-E920 IonicContact NE2-OE2 3.19Å; H888-E920 PolarHBondContact NE2-OE2 2.83Å; E920-R922 PolarHBondContact O-N 3Å
921	C	84.9	Confident	64.2	Low	33 Å²	33	82.6 Å²	82.6	22%	0.223	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-62.1	121.6	167.8	-71.1	0	0	0	0	110.3	C838 K884 V885 S886	C838-C921 WeakPolarHBondContact CA-SG 3.36Å; C838-C921 HydrophobicContact CB-CB 3.98Å; C838-C921 WeakPolarHBondContact CB-SG 3.45Å; C838-C921 WeakPolarHBondContact SG-CA 3.41Å; C838-C921 WeakPolarHBondContact SG-CB 3.39Å; C838-C921 CovalentContact SG-SG 2.04Å; C838-C921 PolarHBondContact SG-SG 2.78Å; K884-C921 HydrophobicContact CB-CB 4.32Å; V885-C921 PolarHBondContact N-SG 3.33Å; V885-C921 PolarHBondContact O-SG 3.18Å; S886-C921 PolarHBondContact N-SG 3.32Å; S886-C921 PolarHBondContact OG-N 2.92Å
922	R	78.6	Confident	61	Low	222 Å²	222	86.7 Å²	86.7	84%	0.838	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-95.2	125.4	172.9	-58.8	-179.8	-172.7	177.9	2.6	108.9	E920	E920-R922 PolarHBondContact O-N 3Å
923	D	58.9	Low	57.9	Low	152 Å²	152	95 Å²	95	81%	0.813	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-58.8	142.8	161.1	-72.1	-47.8	0	0	0	109.6
924	P	44.6	Very low	55	Low	109 Å²	109	98.8 Å²	98.8	71%	0.708	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-61.3	138.7	167.5	28	-33.4	0	0	0	108.9
925	P	32.7	Very low	51.9	Low	107 Å²	107	104.9 Å²	104.9	70%	0.695	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-59.6	142.3	178.9	25.9	-34.3	0	0	0	110.2	N927	P925-N927 PolarHBondContact O-N 3.41Å; P925-N927 VanDerWaalsContact O-N 3.14Å
926	P	36.5	Very low	49	Very low	123 Å²	123	109.8 Å²	109.8	80%	0.799	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-59.9	121.9	177.1	25.2	-33.5	0	0	0	109.2	I928	P926-I928 PolarHBondContact O-N 3.48Å
927	N	31.6	Very low	46.4	Very low	160 Å²	160	114.6 Å²	114.6	86%	0.856	67%	0.673	S	S	*	*			trans	-54.1	113.8	-172.1	-85	-26	0	0	0	111.9	P925	P925-N927 PolarHBondContact O-N 3.41Å; P925-N927 VanDerWaalsContact O-N 3.14Å
928	I	32.8	Very low	44	Very low	170 Å²	170	121.1 Å²	121.1	87%	0.872	70%	0.703	S	S	*	*			trans	-59.9	135.4	151	-64.9	177.3	0	0	0	106.6	P926	P926-I928 PolarHBondContact O-N 3.48Å
929	S	32.5	Very low	41.9	Very low	107 Å²	107	123.6 Å²	123.6	75%	0.748	72%	0.717	S	S	*	*			trans	-86.5	175	-163.6	54	0	0	0	0	113.9
930	A	29.8	Very low	39.5	Very low	75 Å²	75	132.3 Å²	132.3	62%	0.62	74%	0.742	S	S	*	*			trans	90.8	109.9	155.2	0	0	0	0	0	119.6
931	N	27.2	Very low	36.8	Very low	158 Å²	158	133.2 Å²	133.2	85%	0.845	75%	0.749	S	S	*	*				85.3	140.9	126.2	-61.3	-10.4	0	0	0	122.2
932	A	28.4	Very low	34.2	Very low	86 Å²	86	137.9 Å²	137.9	71%	0.711	77%	0.771	S	S	*	*			trans	68.2	95.2	149	0	0	0	0	0	120.1
933	L	27.8	Very low	31.7	Very low	178 Å²	178	132.7 Å²	132.7	93%	0.932	77%	0.767	S	S	*	*				47.1	157.4	103.4	-71.8	161.5	0	0	0	121.3
934	S	25.9	Very low	30.3	Very low	97 Å²	97	131 Å²	131	68%	0.678	76%	0.763	S	S	*	*			trans	76.6	86.1	170.5	-174.1	0	0	0	0	116
935	T	27.9	Very low	29.7	Very low	130 Å²	130	131.4 Å²	131.4	80%	0.798	76%	0.763	S	S	*	*				58.5	115.4	81.5	68.3	0	0	0	0	116.7
936	S	26.1	Very low	29.5	Very low	114 Å²	114	133.6 Å²	133.6	80%	0.797	77%	0.769	S	S	*	*			trans	-168.6	161.7	140.6	61.2	0	0	0	0	109.8
937	S	29	Very low	29	Very low	102 Å²	102	133.3 Å²	133.3	71%	0.713	76%	0.764	S	S	*	*			cis	-165.6	140.6	-35.3	-90	0	0	0	0	107.8
938	H	31.7	Very low	28.9	Very low	203 Å²	203	133 Å²	133	94%	0.94	76%	0.762	S	S	*	*			trans	-76.6	146.4	164.7	-84.1	-83	0	0	0	111.1
939	I	30.8	Very low	28.8	Very low	138 Å²	138	130 Å²	130	71%	0.708	75%	0.752	S	S	*	*			trans	-128.2	133.7	-179.5	-81.4	173.3	0	0	0	104.7
940	W	27.3	Very low	28.7	Very low	211 Å²	211	132 Å²	132	80%	0.799	75%	0.753	S	S	*	*			cis	-159.6	164.4	8.4	-117.1	20.5	0	0	0	106.9
941	L	28.7	Very low	28.7	Very low	123 Å²	123	134.8 Å²	134.8	64%	0.644	76%	0.757	S	S	*	*			cis	-158.7	-150.6	-10.9	-158.8	54.5	0	0	0	103.9
942	L	29	Very low	28.8	Very low	131 Å²	131	135.9 Å²	135.9	69%	0.686	76%	0.757	S	S	*	*			cis	-161.4	100	-1	-159.4	176.1	0	0	0	110.6
943	C	26.7	Very low	28.8	Very low	112 Å²	112	135.5 Å²	135.5	76%	0.757	76%	0.761	S	S	*	*			trans	62.5	163.8	164.8	-72.5	0	0	0	0	118
944	T	30	Very low	29.1	Very low	116 Å²	116	136.1 Å²	136.1	71%	0.712	76%	0.759	S	S	*	*			cis	-150.8	158.7	4.2	-12.8	0	0	0	0	111.4
945	T	30.7	Very low	29.5	Very low	118 Å²	118	146.4 Å²	146.4	72%	0.724	78%	0.783	S	S	*	*			trans	61.5	124.2	155.8	45.3	0	0	0	0	120
946	L	28.3	Very low	29.6	Very low	154 Å²	154	147.2 Å²	147.2	81%	0.806	78%	0.782	S	S	*	*				77.2	124.8	76.3	-140.4	137.9	0	0	0	111.4
947	V	27.8	Very low	29.8	Very low	116 Å²	116	148.9 Å²	148.9	70%	0.703	78%	0.782	S	S	*	*			cis	-168.6	178.5	-5.7	85.1	0	0	0	0	111.6
948	L	27.9	Very low	29.8	Very low	153 Å²	153	151.6 Å²	151.6	80%	0.801	79%	0.785	S	S	*	*			trans	74.5	171.2	163.6	-94.7	163.2	0	0	0	118.8
949	T	31.4	Very low	29.7	Very low	109 Å²	109	148.5 Å²	148.5	67%	0.669	78%	0.776	S	S	*	*			trans	-129.3	179.7	-158.8	51.7	0	0	0	0	112.1
950	L	31	Very low	29.6	Very low	149 Å²	149	149.2 Å²	149.2	78%	0.78	78%	0.781	S	S	*	*			trans	88.3	141	150.3	-82	163.8	0	0	0	120.8
951	L	30	Very low	29.8	Very low	132 Å²	132	145.1 Å²	145.1	69%	0.691	78%	0.779	S	S	*	*			trans	78.5	128.1	152.3	-65.8	160.9	0	0	0	121.3
952	E	28.7	Very low	29.9	Very low	182 Å²	182	146.6 Å²	146.6	85%	0.85	79%	0.789	S	S	*	*			trans	48	146.6	132.3	-62.1	179.7	135.1	0	0	122.4
953	G	28.5	Very low	29.9	Very low	77 Å²	77	147.8 Å²	147.8	79%	0.794	80%	0.797	S	S	*	*			trans	166.3	90.8	163.8	0	0	0	0	0	114.2
954	Q	34.5	Very low	30.2	Very low	191 Å²	191	150.8 Å²	150.8	89%	0.893	80%	0.8	S	S	*	*			trans	-60.5	135.4	171.1	-62.2	169.3	-25.3	0	0	111.9
955	R	33.9	Very low	30.2	Very low	313 Å²	313	154 Å²	154	100%	1.181	81%	0.808	S	S	*	*				-169.8	0	109.2	-103.9	174.2	-178.7	-170.4	0.1	113.5

Retrieved 955 of 955 residues in 178.5 ms (Link to these results)

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