A0A087Y5P4_POEFO Loading...

Integrin subunit alpha 1

AlphaFold DB , UniProt , Accession A0A087Y5P4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,179 aa.

						>A0A087Y5P4_POEFO|A0A087Y5P4
MLRLSQFSTLTAAAVVVLLTCVLSFNVDQKNGLSFSGPLDDMFGYTVQQFENSEGKWVLIGSPHSGQPAKRTGDVYKCPVGRGDNTCIKLELPTNTTVPNLHEIKENMTMGTTLVTNPTGGFMACGPQYGYMCGQQQYISGVCTNVSPSFQILNSIAPGVQNCTSNMDIVFVLDGSNSIYPWKNIVDFLIRFLERVQVGPKQAQVGIVSYGEDVKHHVNLSQFNNNKELLTFVKKIPQHLGTKTHTFLAIDTARKEAFTQERGARSDAKKVMVILTDGESHDHYLQKEVIGECDQDHIERFGIAVLGYYKRENKSEGEVKKFIDEIKSISSKPTQDHFFNVSDEVFLVNLADTLGRKIFALEATSGNLTSSFDMEMSQAGFSAHAFKDGLLLGAVGAYDWNGTVVMQTAESTINPEKDEFYDPKDRKTRRGLAEYLGYDVQSASTPEGVLYITGAPRYNHTGRVVIYRLTKDSRVETVQILRGEQIGSYFGSVLQTVDVNNDSFTDLLLVGAPMYMGPERDEQGKVYVYKLNERGKFVHKFDLNPMNQSCCSVNSDGCTMKNEPCGARFGTAIAAVSDLNLDGLNDVVIGAPFENDHRGAVYIYHGHQSNRYLKLVQHIPAGGDGEKVKFFGQSIHGIMDLNGDGIVDVTIGGLGGASLFWSRDVAELTSNMTLEPAKINLQHSQFQCEHKGHKSVCVNTTVCFQYRVKSEKRDASFTEMRYNITLDLPRAKARASFIDQDLDKSDRRVTKTFSISNGQTICKKERFIMSARLDFKDPINVTLEFGLTDEDKGPVLDASLPTSITKTIPLVDCGDQLKCITDLSLTAEASEKSMLIHVNSKDKLDVKIDISNKRDNAYNTKVILSFTPNINYVKVEPEKECTPDNTKVECAVGYPFLGSKAKESFKVRFETDSSHIHENIYINVTTVSDSEENPNTLHDNSKEIFIPVKYEAGVIFSVSHSQNYITIEDGEQSSVKDSDFGRMIEEVNISYTVEKAGNTLTPALDLNVIYPYRSPLFNVLLFPTRIVYSTEVKCKEPPAPKHNKPKKETLTPFLLECGQSLCDSFTCSIPETNKSQVNVTFKAWKPTFTVGEFSSLKMMVNASLTFKQNHLFELGSNAKTRNVTILISKGTIEGIPLWIIILLSTLAGLLILALIILIFWKLGFFKRKTMDYSKEEMSD
					

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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	37.3	Very low	30.2	Very low	247 Å²	247	157.9 Å²	157.9	100%	1.217	81%	0.809	S	S	*	*				0	54.3	0	-146.3	-179.1	-132.7	0	0	109.9
2	L	30	Very low	30.2	Very low	173 Å²	173	149.4 Å²	149.4	91%	0.906	78%	0.78	S	S	*	*			trans	-162.7	71.6	-175.1	-106.7	151.1	0	0	0	106.9
3	R	25.3	Very low	30.1	Very low	250 Å²	250	142.8 Å²	142.8	94%	0.943	76%	0.76	S	S	*	*	S	Bend	trans	-174.4	22.2	170.4	-111.9	177.2	-166.6	-159.2	3.9	115.9
4	L	27.4	Very low	30	Very low	174 Å²	174	136.9 Å²	136.9	91%	0.911	74%	0.741	S	S	*	*	S	Bend	trans	-125.2	4.9	-176	-102.6	149.5	0	0	0	115.3
5	S	28.9	Very low	29.9	Very low	102 Å²	102	133.8 Å²	133.8	71%	0.713	73%	0.728	S	S	*	*	S	Bend	trans	-96.5	-0.1	-177.9	64	0	0	0	0	115.7
6	Q	29.8	Very low	29.8	Very low	167 Å²	167	132.5 Å²	132.5	78%	0.78	73%	0.726	S	S	*	*	S	Bend	trans	-96.9	-2.6	-173.4	-91	-178.8	-24.6	0	0	115.8
7	F	28.1	Very low	29.7	Very low	198 Å²	198	131.6 Å²	131.6	87%	0.868	73%	0.725	S	S	*	*	S	Bend	trans	-105.5	-1.8	178.6	-94.1	-83.1	0	0	0	114.8
8	S	31.9	Very low	29.5	Very low	87 Å²	87	132.2 Å²	132.2	61%	0.608	73%	0.726	S	S	*	*	S	Bend	trans	-91.7	-15.9	179.2	-169.7	0	0	0	0	113.6
9	T	31.8	Very low	29.5	Very low	96 Å²	96	132.6 Å²	132.6	59%	0.589	73%	0.726	S	S	*	*	H	α-helix	trans	-90	-18.3	-172.7	46.2	0	0	0	0	114.4
10	L	30	Very low	29.4	Very low	147 Å²	147	131.9 Å²	131.9	77%	0.77	73%	0.726	S	S	*	*	H	α-helix	trans	-85.9	-21.5	178.9	-105.3	96	0	0	0	114.4
11	T	31.8	Very low	29.4	Very low	96 Å²	96	130.8 Å²	130.8	59%	0.589	73%	0.726	S	S	*	*	H	α-helix	trans	-88.9	-24.4	176.4	40.2	0	0	0	0	112.9	V15	T11-V15 WeakPolarHBondContact O-CG2 3.44Å; T11-V15 PolarHBondContact O-N 3.36Å
12	A	30.2	Very low	29.5	Very low	56 Å²	56	122.2 Å²	122.2	46%	0.463	69%	0.688	S	S	.	*	H	α-helix	trans	-71.1	-35.2	173.8	0	0	0	0	0	112.5	A14 V15 V16	A12-A14 PolarHBondContact O-N 3.22Å; A12-V15 PolarHBondContact O-N 3.09Å; A12-V16 WeakPolarHBondContact O-CG2 3.04Å; A12-V16 PolarHBondContact O-N 3.04Å; A12-V16 VanDerWaalsContact O-N 3.14Å
13	A	28.7	Very low	30.1	Very low	63 Å²	63	120.5 Å²	120.5	52%	0.521	68%	0.679	S	S	.	*	H	α-helix	trans	-69	-31.1	178.7	0	0	0	0	0	113.2	V17	A13-V17 WeakPolarHBondContact O-CG2 3.48Å
14	A	28.2	Very low	31.4	Very low	60 Å²	60	111.7 Å²	111.7	50%	0.496	66%	0.656	S	S	.	*	H	α-helix	trans	-77.5	-24.3	176.3	0	0	0	0	0	113.1	A12	A12-A14 PolarHBondContact O-N 3.22Å
15	V	29.2	Very low	33.4	Very low	91 Å²	91	104.5 Å²	104.5	55%	0.552	62%	0.617	S	S	*	*	H	α-helix	trans	-86.1	-25.3	178.2	175.8	0	0	0	0	111.9	T11 A12	T11-V15 WeakPolarHBondContact O-CG2 3.44Å; T11-V15 PolarHBondContact O-N 3.36Å; A12-V15 PolarHBondContact O-N 3.09Å
16	V	28.6	Very low	35.9	Very low	113 Å²	113	99.7 Å²	99.7	69%	0.685	58%	0.584	S	S	*	*	H	α-helix	trans	-78.6	-23.5	176.6	174.1	0	0	0	0	112.9	A12 L18	A12-V16 WeakPolarHBondContact O-CG2 3.04Å; A12-V16 PolarHBondContact O-N 3.04Å; A12-V16 VanDerWaalsContact O-N 3.14Å; V16-L18 VanDerWaalsContact C-N 3.31Å; V16-L18 PolarHBondContact O-N 3.12Å
17	V	27.2	Very low	38.4	Very low	118 Å²	118	91.9 Å²	91.9	72%	0.715	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-9.5	176.3	177.4	0	0	0	0	112.9	A13	A13-V17 WeakPolarHBondContact O-CG2 3.48Å
18	L	27.2	Very low	41	Very low	141 Å²	141	83.3 Å²	83.3	74%	0.738	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	8.3	-178.5	-88.6	156.9	0	0	0	114.5	V16	V16-L18 VanDerWaalsContact C-N 3.31Å; V16-L18 PolarHBondContact O-N 3.12Å
19	L	28.4	Very low	43.3	Very low	141 Å²	141	82.5 Å²	82.5	74%	0.738	50%	0.497	S	S	*	.			trans	-118.2	20	-175.9	-106.9	150.1	0	0	0	115.1
20	T	27.8	Very low	45.4	Very low	118 Å²	118	84.4 Å²	84.4	72%	0.724	50%	0.497	S	S	*	.			trans	-101.1	59.3	155.2	58.2	0	0	0	0	109.1	V22	T20-V22 PolarHBondContact O-N 2.82Å
21	C	29.7	Very low	47.6	Very low	108 Å²	108	82.1 Å²	82.1	73%	0.73	49%	0.486	S	S	*	.			trans	-68.1	93.5	155.2	-86.1	0	0	0	0	105.6	L23	C21-L23 PolarHBondContact O-N 2.81Å
22	V	38.8	Very low	49.8	Very low	68 Å²	68	79 Å²	79	41%	0.412	47%	0.473	S	S	.	.			trans	-50.1	113	160.7	179.5	0	0	0	0	105.1	T20 S24	T20-V22 PolarHBondContact O-N 2.82Å; V22-S24 PolarHBondContact O-N 2.01Å
23	L	42.9	Very low	52.5	Low	137 Å²	137	77.7 Å²	77.7	72%	0.717	46%	0.458	S	S	*	.			trans	-70.7	79.3	176.4	-72	162	0	0	0	107.1	C21 Q617	C21-L23 PolarHBondContact O-N 2.81Å; L23-Q617 WeakPolarHBondContact O-CG 3.4Å
24	S	52.3	Low	55.3	Low	65 Å²	65	78.6 Å²	78.6	46%	0.455	46%	0.46	S	S	.	.			trans	-78	113.3	163.7	55.3	0	0	0	0	106.9	V22	V22-S24 PolarHBondContact O-N 2.01Å
25	F	69.8	Low	58.2	Low	23 Å²	23	76 Å²	76	10%	0.101	44%	0.438	C	S	.	.			trans	-90	-70.4	179.6	-179.6	-115.6	0	0	0	110.2	N580 H605 Q617 V665 V795 A798	F25-N580 HydrophobicContact CE1-CB 4.14Å; F25-H605 AromaticContact CD1-NE2 3.27Å; F25-H605 VanDerWaalsContact CD1-NE2 3.27Å; F25-H605 WeakPolarHBondContact CD1-NE2 3.24Å; F25-H605 AromaticContact CE1-NE2 3.38Å; F25-H605 WeakPolarHBondContact CE1-NE2 3.38Å; F25-Q617 VanDerWaalsContact N-OE1 3.1Å; F25-V665 HydrophobicContact CE1-CG2 4.37Å; F25-V665 HydrophobicContact CZ-CG1 4.25Å; F25-V665 HydrophobicContact CZ-CG2 4.41Å; F25-V795 VanDerWaalsContact O-CB 3.28Å; F25-V795 WeakPolarHBondContact O-CB 3.45Å; F25-V795 WeakPolarHBondContact O-CG1 3.49Å; F25-V795 VanDerWaalsContact O-CG2 3.28Å; F25-V795 WeakPolarHBondContact O-CG2 3.32Å; F25-A798 HydrophobicContact CD2-CB 3.71Å; F25-A798 HydrophobicContact CE2-CB 3.4Å; F25-A798 VanDerWaalsContact CE2-N 3.34Å; F25-A798 HydrophobicContact CZ-CB 4.29Å
26	N	82.5	Confident	61	Low	1 Å²	1	76.7 Å²	76.7	1%	0.005	45%	0.447	C	S	.	.	S	Bend	trans	-130.3	-21	-176.9	60.6	-26.8	0	0	0	113.5	D28 L579 R663 V665	N26-D28 PolarHBondContact O-N 3.43Å; N26-L579 VanDerWaalsContact ND2-CB 3.34Å; N26-L579 WeakPolarHBondContact ND2-CB 3.44Å; N26-L579 PolarHBondContact ND2-O 2.79Å; N26-R663 WeakPolarHBondContact O-CB 3.05Å; N26-R663 PolarHBondContact O-N 2.98Å; N26-V665 HydrophobicContact CB-CG2 4.15Å
27	V	81.9	Confident	63.8	Low	3 Å²	3	72.5 Å²	72.5	2%	0.018	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	119.4	176.2	179.2	0	0	0	0	110.2	Q29 L579 I603 Q617 I619 F660	V27-Q29 PolarHBondContact O-N 2.78Å; V27-L579 HydrophobicContact CG2-CD1 4.43Å; V27-I603 HydrophobicContact CB-CD1 3.88Å; V27-I603 HydrophobicContact CG1-CD1 4.41Å; V27-I603 HydrophobicContact CG2-CD1 3.51Å; V27-Q617 PolarHBondContact O-NE2 2.87Å; V27-I619 HydrophobicContact CB-CD1 4.22Å; V27-I619 HydrophobicContact CG1-CD1 3.8Å; V27-F660 HydrophobicContact CG1-CB 3.39Å; V27-F660 HydrophobicContact CG1-CD1 4.42Å; V27-F660 HydrophobicContact CG1-CG 4.1Å
28	D	82.3	Confident	66.6	Low	18 Å²	18	70.2 Å²	70.2	10%	0.096	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	107.9	-173.8	-172	-3.9	0	0	0	112.2	N26 K30 N31 F660 W661 R663	N26-D28 PolarHBondContact O-N 3.43Å; D28-K30 PolarHBondContact OD1-N 2.82Å; D28-N31 PolarHBondContact OD1-N 2.84Å; D28-N31 VanDerWaalsContact OD2-CB 3.28Å; D28-N31 WeakPolarHBondContact OD2-CB 2.98Å; D28-N31 PolarHBondContact OD2-ND2 2.94Å; D28-F660 WeakPolarHBondContact O-CD1 3.29Å; D28-W661 WeakPolarHBondContact CB-O 3.15Å; D28-W661 PolarHBondContact N-O 2.93Å; D28-R663 HydrophobicContact CB-CG 3.98Å
29	Q	79.9	Confident	69.4	Low	69 Å²	69	66.6 Å²	66.6	32%	0.322	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-20.1	177.2	-163.1	177.7	16.3	0	0	113.5	V27 I619 F660	V27-Q29 PolarHBondContact O-N 2.78Å; Q29-I619 HydrophobicContact CG-CG2 4.43Å; Q29-F660 HydrophobicContact CG-CE1 4.36Å
30	K	76.1	Confident	72.1	Confident	137 Å²	137	65.7 Å²	65.7	60%	0.596	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	-40	-171	-71.6	179.7	175.9	172.8	0	112.9	D28 D791	D28-K30 PolarHBondContact OD1-N 2.82Å; K30-D791 IonicContact NZ-OD1 2.8Å; K30-D791 PolarHBondContact NZ-OD1 3.05Å; K30-D791 IonicContact NZ-OD2 3.43Å; K30-D791 PolarHBondContact NZ-OD2 3.17Å
31	N	75.3	Confident	75	Confident	98 Å²	98	61.1 Å²	61.1	52%	0.524	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	23.2	-172.1	-53.3	-60.8	0	0	0	114.5	D28 W661	D28-N31 PolarHBondContact OD1-N 2.84Å; D28-N31 VanDerWaalsContact OD2-CB 3.28Å; D28-N31 WeakPolarHBondContact OD2-CB 2.98Å; D28-N31 PolarHBondContact OD2-ND2 2.94Å; N31-W661 PolarHBondContact O-NE1 2.84Å
32	G	78.6	Confident	78	Confident	32 Å²	32	57.9 Å²	57.9	33%	0.33	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	165.7	179.7	0	0	0	0	0	114.6	L659	G32-L659 CarbonylContact C-O 3.57Å; G32-L659 VanDerWaalsContact CA-O 3.25Å; G32-L659 WeakPolarHBondContact CA-O 3.25Å
33	L	86.6	Confident	80.6	Confident	27 Å²	27	54.8 Å²	54.8	14%	0.141	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	127.8	177	-156.6	121.3	0	0	0	109.6	F35 N85 S658 L659 W661	L33-F35 HydrophobicContact CD2-CD1 4.25Å; L33-F35 HydrophobicContact CD2-CE1 3.38Å; L33-F35 HydrophobicContact CD2-CE2 3.85Å; L33-F35 HydrophobicContact CD2-CZ 3.16Å; L33-N85 HydrophobicContact CD2-CB 4.43Å; L33-S658 CarbonylContact O-C 3.39Å; L33-S658 WeakPolarHBondContact O-CA 3.48Å; L33-L659 HydrophobicContact CB-CB 4.26Å; L33-L659 PolarHBondContact N-O 2.82Å; L33-L659 PolarHBondContact O-N 2.79Å; L33-W661 HydrophobicContact CB-CZ2 4.19Å; L33-W661 HydrophobicContact CD1-CZ2 4.36Å
34	S	88	Confident	82.9	Confident	82 Å²	82	48.3 Å²	48.3	57%	0.573	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.6	136	-178	-56.4	0	0	0	0	111.7	S658	S34-S658 PolarHBondContact OG-OG 2.73Å
35	F	89.4	Confident	84.9	Confident	5 Å²	5	49.2 Å²	49.2	2%	0.022	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	133.8	173	-53	-73.9	0	0	0	108.7	L33 F43 V58 I60 C78 V80 N85 G656 A657 L659	L33-F35 HydrophobicContact CD2-CD1 4.25Å; L33-F35 HydrophobicContact CD2-CE1 3.38Å; L33-F35 HydrophobicContact CD2-CE2 3.85Å; L33-F35 HydrophobicContact CD2-CZ 3.16Å; F35-F43 HydrophobicContact CB-CE1 4.35Å; F35-V58 HydrophobicContact CE2-CB 4.04Å; F35-V58 HydrophobicContact CE2-CG1 4.39Å; F35-V58 HydrophobicContact CE2-CG2 3.98Å; F35-V58 HydrophobicContact CZ-CB 4.39Å; F35-V58 HydrophobicContact CZ-CG2 4.32Å; F35-I60 HydrophobicContact CB-CD1 3.93Å; F35-I60 HydrophobicContact CD2-CD1 4.17Å; F35-I60 HydrophobicContact CG-CD1 4.2Å; F35-C78 HydrophobicContact CD1-CB 3.6Å; F35-C78 HydrophobicContact CE1-CB 3.44Å; F35-C78 VanDerWaalsContact CE1-CB 3.44Å; F35-C78 HydrophobicContact CE2-CB 4.4Å; F35-C78 HydrophobicContact CG-CB 4.14Å; F35-C78 HydrophobicContact CZ-CB 3.85Å; F35-V80 HydrophobicContact CZ-CG2 4.49Å; F35-N85 HydrophobicContact CE1-CB 4.44Å; F35-G656 CarbonylContact O-C 3.52Å; F35-G656 WeakPolarHBondContact O-CA 3.37Å; F35-A657 HydrophobicContact CD2-CB 4.46Å; F35-A657 PolarHBondContact N-O 3.2Å; F35-A657 PolarHBondContact O-N 3.2Å; F35-L659 HydrophobicContact CE2-CB 4.44Å
36	S	88.6	Confident	86.1	Confident	107 Å²	107	49.2 Å²	49.2	75%	0.748	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.9	147.1	179.5	58.8	0	0	0	0	110.7
37	G	86.7	Confident	86.7	Confident	25 Å²	25	49.5 Å²	49.5	26%	0.258	28%	0.282	S	S	.	.			trans	-152.9	176	177.8	0	0	0	0	0	111.6	L39 G655	G37-L39 PolarHBondContact O-N 2.98Å; G37-G655 PolarHBondContact N-O 3.35Å; G37-G655 VanDerWaalsContact O-O 3.12Å
38	P	86.2	Confident	87.3	Confident	70 Å²	70	50.3 Å²	50.3	46%	0.455	29%	0.285	S	S	.	.			trans	-66.1	134.3	-179.2	-15.6	28.8	0	0	0	111.5	D41	P38-D41 HydrophobicContact CB-CB 4.03Å; P38-D41 HydrophobicContact CG-CB 4.42Å; P38-D41 PolarHBondContact O-N 2.98Å
39	L	85.3	Confident	87.8	Confident	65 Å²	65	49.7 Å²	49.7	34%	0.34	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-37.5	-179.5	-169.3	139.5	0	0	0	112	G37 D41 M42 K629	G37-L39 PolarHBondContact O-N 2.98Å; L39-D41 PolarHBondContact O-N 3.02Å; L39-M42 PolarHBondContact O-N 2.91Å; L39-K629 HydrophobicContact CD1-CG 4.43Å
40	D	86.3	Confident	88.4	Confident	122 Å²	122	47 Å²	47	65%	0.652	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-30.9	176.4	-63.2	-32.8	0	0	0	112.6	M42 H64	D40-M42 PolarHBondContact O-N 2.97Å; D40-H64 WeakPolarHBondContact O-CB 3.4Å
41	D	88.8	Confident	89	Confident	22 Å²	22	45.5 Å²	45.5	12%	0.118	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-3.5	177.3	-85.1	17	0	0	0	112.6	P38 L39 F43 S62 H64 S65	P38-D41 HydrophobicContact CB-CB 4.03Å; P38-D41 HydrophobicContact CG-CB 4.42Å; P38-D41 PolarHBondContact O-N 2.98Å; L39-D41 PolarHBondContact O-N 3.02Å; D41-F43 PolarHBondContact O-N 2.99Å; D41-S62 WeakPolarHBondContact CB-OG 3.41Å; D41-S62 CarbonylContact O-C 3.5Å; D41-S62 PolarHBondContact O-OG 3.48Å; D41-H64 PolarHBondContact O-N 2.83Å; D41-H64 VanDerWaalsContact O-N 3.12Å; D41-S65 VanDerWaalsContact CG-CA 3.48Å; D41-S65 WeakPolarHBondContact OD2-CA 3.23Å; D41-S65 WeakPolarHBondContact OD2-CB 3.34Å; D41-S65 PolarHBondContact OD2-OG 3.22Å
42	M	91.2	Very high	89.7	Confident	40 Å²	40	41.7 Å²	41.7	20%	0.197	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	39.6	-172.5	-67.9	-173.3	62.5	0	0	112.7	L39 D40 G44 Y45 H64 L654	L39-M42 PolarHBondContact O-N 2.91Å; D40-M42 PolarHBondContact O-N 2.97Å; M42-G44 PolarHBondContact O-N 2.94Å; M42-Y45 HydrophobicContact CE-CD2 3.41Å; M42-Y45 VanDerWaalsContact CE-CD2 3.41Å; M42-Y45 HydrophobicContact CE-CE2 3.72Å; M42-Y45 HydrophobicContact CE-CG 4.35Å; M42-Y45 WeakPolarHBondContact O-CB 3.22Å; M42-Y45 PolarHBondContact O-N 3.09Å; M42-H64 HydrophobicContact CG-CB 4.46Å; M42-H64 PolarHBondContact SD-CD2 3.07Å; M42-H64 PolarHBondContact SD-NE2 3.35Å; M42-L654 HydrophobicContact CB-CD2 3.79Å; M42-L654 HydrophobicContact CE-CD1 4.4Å; M42-L654 HydrophobicContact CE-CD2 3.65Å; M42-L654 HydrophobicContact CG-CD2 3.9Å
43	F	93.2	Very high	89.9	Confident	3 Å²	3	46.4 Å²	46.4	1%	0.013	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	130.3	175	-176	-89.3	0	0	0	110.3	F35 D41 I60 Y76 C87 G655 G656	F35-F43 HydrophobicContact CB-CE1 4.35Å; D41-F43 PolarHBondContact O-N 2.99Å; F43-I60 HydrophobicContact CD1-CG2 4.04Å; F43-I60 HydrophobicContact CD2-CG2 4.03Å; F43-I60 HydrophobicContact CE1-CD1 3.68Å; F43-I60 HydrophobicContact CE1-CG2 3.84Å; F43-I60 HydrophobicContact CE2-CB 4.14Å; F43-I60 HydrophobicContact CE2-CD1 4.43Å; F43-I60 HydrophobicContact CE2-CG2 3.83Å; F43-I60 HydrophobicContact CG-CG2 4.16Å; F43-I60 HydrophobicContact CZ-CB 4.01Å; F43-I60 HydrophobicContact CZ-CD1 3.49Å; F43-I60 VanDerWaalsContact CZ-CD1 3.49Å; F43-I60 HydrophobicContact CZ-CG1 4.32Å; F43-I60 HydrophobicContact CZ-CG2 3.74Å; F43-Y76 AromaticContact CD2-CD2 3.97Å; F43-Y76 HydrophobicContact CD2-CD2 3.97Å; F43-Y76 HydrophobicContact CD2-CE2 4.2Å; F43-Y76 HydrophobicContact CD2-CG 4.31Å; F43-Y76 HydrophobicContact CE2-CD1 4.24Å; F43-Y76 AromaticContact CE2-CD2 3.89Å; F43-Y76 HydrophobicContact CE2-CD2 3.89Å; F43-Y76 HydrophobicContact CE2-CE2 4.46Å; F43-Y76 AromaticContact CE2-CG 3.77Å; F43-Y76 HydrophobicContact CE2-CG 3.77Å; F43-C87 HydrophobicContact CZ-CB 4.37Å; F43-G655 PolarHBondContact O-N 2.75Å; F43-G656 PolarHBondContact O-N 3.15Å
44	G	92.3	Very high	89.8	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.4	10	-176.8	0	0	0	0	0	114.3	M42 I60 G61 Q633 S634 G653	M42-G44 PolarHBondContact O-N 2.94Å; G44-I60 VanDerWaalsContact N-CG2 3.26Å; G44-G61 PolarHBondContact N-O 2.88Å; G44-Q633 VanDerWaalsContact C-NE2 3.28Å; G44-Q633 PolarHBondContact O-NE2 2.91Å; G44-S634 PolarHBondContact O-OG 2.64Å; G44-G653 CarbonylContact C-O 2.99Å; G44-G653 VanDerWaalsContact CA-O 3.29Å; G44-G653 WeakPolarHBondContact CA-O 3.09Å
45	Y	94.4	Very high	89.7	Confident	85 Å²	85	46.5 Å²	46.5	33%	0.333	27%	0.269	S	S	.	.	S	Bend	trans	-59.3	-48.1	176.5	-173.3	-102.1	0	0	0	112.1	M42 G61 P63 T112 S634	M42-Y45 HydrophobicContact CE-CD2 3.41Å; M42-Y45 VanDerWaalsContact CE-CD2 3.41Å; M42-Y45 HydrophobicContact CE-CE2 3.72Å; M42-Y45 HydrophobicContact CE-CG 4.35Å; M42-Y45 WeakPolarHBondContact O-CB 3.22Å; M42-Y45 PolarHBondContact O-N 3.09Å; Y45-G61 PolarHBondContact N-O 3.43Å; Y45-P63 HydrophobicContact CD1-CG 3.58Å; Y45-P63 HydrophobicContact CE1-CG 4.36Å; Y45-P63 HydrophobicContact CG-CG 3.73Å; Y45-T112 HydrophobicContact CE1-CG2 3.72Å; Y45-S634 WeakPolarHBondContact O-CB 3.05Å; Y45-S634 PolarHBondContact O-OG 2.95Å
46	T	95.2	Very high	89.7	Confident	23 Å²	23	48.4 Å²	48.4	14%	0.141	28%	0.277	C	S	.	.	S	Bend	trans	-123.2	148.1	169.3	50.8	0	0	0	0	110.3	I60 G61 G111 T112 L114	T46-I60 WeakPolarHBondContact O-CA 3.47Å; T46-G61 PolarHBondContact O-N 2.88Å; T46-G61 WeakPolarHBondContact OG1-CA 3.26Å; T46-G111 PolarHBondContact OG1-O 3.5Å; T46-T112 WeakPolarHBondContact CG2-O 3.48Å; T46-L114 WeakPolarHBondContact OG1-CD1 3.44Å
47	V	95.3	Very high	89.9	Confident	7 Å²	7	44 Å²	44	4%	0.042	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	139.9	175.4	-63.2	0	0	0	0	109.3	L59 I60 H636 T650 A657	V47-L59 WeakPolarHBondContact CA-O 3.42Å; V47-I60 HydrophobicContact CG1-CG1 4.47Å; V47-H636 HydrophobicContact CG2-CB 4.3Å; V47-T650 HydrophobicContact CB-CG2 4.04Å; V47-T650 HydrophobicContact CG1-CG2 4.4Å; V47-T650 HydrophobicContact CG2-CG2 4.17Å; V47-A657 HydrophobicContact CG1-CB 3.92Å
48	Q	94.1	Very high	90.2	Very high	19 Å²	19	42.8 Å²	42.8	9%	0.089	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	130.1	178.2	-172.3	73.5	23.4	0	0	109	L59 L114 T116 H636	Q48-L59 HydrophobicContact CB-CB 4.27Å; Q48-L59 PolarHBondContact N-O 3.46Å; Q48-L59 PolarHBondContact O-N 2.81Å; Q48-L114 HydrophobicContact CB-CB 4.41Å; Q48-L114 HydrophobicContact CB-CD1 4.45Å; Q48-T116 HydrophobicContact CG-CG2 4.13Å; Q48-H636 PolarHBondContact NE2-CD2 3.42Å; Q48-H636 PolarHBondContact NE2-CE1 2.97Å; Q48-H636 PolarHBondContact NE2-NE2 2.8Å; Q48-H636 PolarHBondContact OE1-CD2 2.69Å; Q48-H636 VanDerWaalsContact OE1-CD2 3.29Å
49	Q	93.3	Very high	90.6	Very high	6 Å²	6	39.4 Å²	39.4	3%	0.028	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	139.1	172.7	-62.4	171.9	-35.5	0	0	109.8	H636 M639 L641 D648 T650	Q49-H636 WeakPolarHBondContact CB-ND1 3.43Å; Q49-H636 WeakPolarHBondContact CG-ND1 3.42Å; Q49-H636 PolarHBondContact N-ND1 2.85Å; Q49-H636 PolarHBondContact OE1-ND1 2.81Å; Q49-M639 HydrophobicContact CB-CE 4Å; Q49-L641 HydrophobicContact CG-CD1 3.92Å; Q49-D648 PolarHBondContact NE2-O 2.77Å; Q49-T650 WeakPolarHBondContact CG-OG1 3.1Å; Q49-T650 PolarHBondContact NE2-OG1 2.77Å
50	F	91.6	Very high	91.1	Very high	13 Å²	13	36.3 Å²	36.3	6%	0.057	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	140.3	-174.6	-174.6	-104.9	0	0	0	112.2	N52 W57 L59 F122 P148 F150	F50-N52 HydrophobicContact CE1-CB 3.85Å; F50-N52 HydrophobicContact CZ-CB 4.28Å; F50-W57 PolarHBondContact N-O 2.91Å; F50-W57 PolarHBondContact O-N 2.84Å; F50-L59 HydrophobicContact CB-CD1 3.87Å; F50-L59 HydrophobicContact CB-CD2 4.49Å; F50-L59 HydrophobicContact CB-CG 3.87Å; F50-L59 HydrophobicContact CD2-CD1 4.43Å; F50-L59 HydrophobicContact CG-CD1 4.06Å; F50-L59 HydrophobicContact CG-CG 4.43Å; F50-F122 HydrophobicContact CE2-CD1 4.4Å; F50-P148 HydrophobicContact CZ-CB 4.48Å; F50-F150 HydrophobicContact CD1-CE1 4.09Å; F50-F150 HydrophobicContact CD1-CZ 4.13Å; F50-F150 AromaticContact CE1-CE1 3.99Å; F50-F150 HydrophobicContact CE1-CE1 3.99Å; F50-F150 HydrophobicContact CE1-CZ 4.01Å
51	E	89.6	Confident	91.5	Very high	105 Å²	105	30.5 Å²	30.5	49%	0.491	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	140.4	175.1	176.6	172.4	-139	0	0	110.6	K56 M639	E51-K56 HydrophobicContact CB-CG 4.38Å; E51-K56 HydrophobicContact CG-CG 4.1Å; E51-K56 VanDerWaalsContact OE1-CE 3.31Å; E51-K56 WeakPolarHBondContact OE1-CE 3.43Å; E51-M639 HydrophobicContact CB-CE 3.87Å; E51-M639 HydrophobicContact CB-SD 3.46Å; E51-M639 WeakPolarHBondContact CB-SD 3.44Å; E51-M639 HydrophobicContact CG-SD 4.46Å
52	N	88.6	Confident	91.8	Very high	18 Å²	18	29.5 Å²	29.5	10%	0.096	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	-177.3	172	69.4	1.4	0	0	0	110.8	F50 E54 G55 W57 P148 F150	F50-N52 HydrophobicContact CE1-CB 3.85Å; F50-N52 HydrophobicContact CZ-CB 4.28Å; N52-E54 PolarHBondContact O-N 2.94Å; N52-E54 VanDerWaalsContact O-N 3.15Å; N52-E54 WeakPolarHBondContact OD1-CA 3.19Å; N52-E54 VanDerWaalsContact OD1-CB 3.31Å; N52-E54 WeakPolarHBondContact OD1-CB 3.47Å; N52-E54 PolarHBondContact OD1-N 3.1Å; N52-G55 PolarHBondContact N-O 3.37Å; N52-G55 PolarHBondContact O-N 3.48Å; N52-G55 PolarHBondContact OD1-N 3.16Å; N52-G55 VanDerWaalsContact OD1-N 3.11Å; N52-G55 PolarHBondContact OD1-O 2.89Å; N52-G55 VanDerWaalsContact OD1-O 3.09Å; N52-W57 PolarHBondContact OD1-NE1 2.05Å; N52-P148 HydrophobicContact CB-CB 4.44Å; N52-P148 PolarHBondContact ND2-O 3.01Å; N52-F150 VanDerWaalsContact ND2-CE2 3.31Å; N52-F150 WeakPolarHBondContact ND2-CE2 3.09Å
53	S	84.1	Confident	91.9	Very high	130 Å²	130	27.7 Å²	27.7	91%	0.909	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-20.9	176	53.1	0	0	0	0	114	G55	S53-G55 VanDerWaalsContact C-N 3.35Å
54	E	83.3	Confident	91.8	Very high	87 Å²	87	29 Å²	29	41%	0.407	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-8.7	176.1	-57.4	-178.1	169.2	0	0	112.6	N52 W57 R82	N52-E54 PolarHBondContact O-N 2.94Å; N52-E54 VanDerWaalsContact O-N 3.15Å; N52-E54 WeakPolarHBondContact OD1-CA 3.19Å; N52-E54 VanDerWaalsContact OD1-CB 3.31Å; N52-E54 WeakPolarHBondContact OD1-CB 3.47Å; N52-E54 PolarHBondContact OD1-N 3.1Å; E54-W57 HydrophobicContact CB-CZ2 4.11Å; E54-R82 PolarHBondContact O-NH1 2.94Å; E54-R82 PolarHBondContact O-NH2 2.97Å
55	G	86.6	Confident	91.6	Very high	24 Å²	24	29.1 Å²	29.1	25%	0.247	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	128.2	-163	179	0	0	0	0	0	113.4	N52 S53 W57	N52-G55 PolarHBondContact N-O 3.37Å; N52-G55 PolarHBondContact O-N 3.48Å; N52-G55 PolarHBondContact OD1-N 3.16Å; N52-G55 VanDerWaalsContact OD1-N 3.11Å; N52-G55 PolarHBondContact OD1-O 2.89Å; N52-G55 VanDerWaalsContact OD1-O 3.09Å; S53-G55 VanDerWaalsContact C-N 3.35Å; G55-W57 PolarHBondContact O-NE1 2.85Å
56	K	90.2	Very high	90.8	Very high	46 Å²	46	26.5 Å²	26.5	20%	0.2	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	138.7	-176.5	-58.6	-173.2	-174.1	179.3	0	111.1	E51 V80 D640 L641	E51-K56 HydrophobicContact CB-CG 4.38Å; E51-K56 HydrophobicContact CG-CG 4.1Å; E51-K56 VanDerWaalsContact OE1-CE 3.31Å; E51-K56 WeakPolarHBondContact OE1-CE 3.43Å; K56-V80 PolarHBondContact O-N 2.92Å; K56-D640 PolarHBondContact NZ-O 3.38Å; K56-L641 HydrophobicContact CB-CD2 3.75Å; K56-L641 HydrophobicContact CD-CD2 4.15Å; K56-L641 VanDerWaalsContact CD-O 3.31Å; K56-L641 WeakPolarHBondContact CD-O 3.12Å; K56-L641 HydrophobicContact CG-CD2 4.44Å
57	W	91.4	Very high	89.7	Confident	13 Å²	13	29 Å²	29	5%	0.049	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	150.9	-169.5	-52.5	89.7	0	0	0	111.3	F50 N52 E54 G55 K77 C78 P79 F150	F50-W57 PolarHBondContact N-O 2.91Å; F50-W57 PolarHBondContact O-N 2.84Å; N52-W57 PolarHBondContact OD1-NE1 2.05Å; E54-W57 HydrophobicContact CB-CZ2 4.11Å; G55-W57 PolarHBondContact O-NE1 2.85Å; W57-K77 HydrophobicContact CE3-CB 4.19Å; W57-K77 HydrophobicContact CE3-CD 4.27Å; W57-K77 HydrophobicContact CE3-CG 4.39Å; W57-K77 HydrophobicContact CZ3-CD 4.2Å; W57-K77 HydrophobicContact CZ3-CG 4.46Å; W57-C78 CarbonylContact C-O 3.53Å; W57-C78 VanDerWaalsContact CA-O 3.3Å; W57-C78 WeakPolarHBondContact CA-O 3.37Å; W57-P79 HydrophobicContact CE3-CB 3.96Å; W57-P79 HydrophobicContact CH2-CB 4.34Å; W57-P79 HydrophobicContact CZ3-CB 3.62Å; W57-P79 HydrophobicContact CZ3-CG 4.31Å; W57-F150 HydrophobicContact CD2-CZ 4.27Å; W57-F150 HydrophobicContact CG-CZ 4.18Å
58	V	93.4	Very high	87.9	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	120.2	162.9	178.5	0	0	0	0	107.8	F35 I60 C78 V80 L641 T650	F35-V58 HydrophobicContact CE2-CB 4.04Å; F35-V58 HydrophobicContact CE2-CG1 4.39Å; F35-V58 HydrophobicContact CE2-CG2 3.98Å; F35-V58 HydrophobicContact CZ-CB 4.39Å; F35-V58 HydrophobicContact CZ-CG2 4.32Å; V58-I60 HydrophobicContact CG1-CD1 4.29Å; V58-I60 HydrophobicContact CG1-CG1 3.91Å; V58-C78 HydrophobicContact CB-CB 4.44Å; V58-C78 PolarHBondContact N-O 3.42Å; V58-C78 WeakPolarHBondContact O-CB 3.34Å; V58-C78 PolarHBondContact O-N 3.39Å; V58-V80 HydrophobicContact CG2-CG2 3.86Å; V58-L641 HydrophobicContact CG2-CD1 4.2Å; V58-T650 HydrophobicContact CG1-CG2 3.72Å; V58-T650 HydrophobicContact CG2-CG2 4.45Å
59	L	94.8	Very high	86.4	Confident	0 Å²	0	38 Å²	38	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	130.6	173.3	-53.5	178.9	0	0	0	108.9	V47 Q48 F50 V75 Y76 K77 L114 F122 F150	V47-L59 WeakPolarHBondContact CA-O 3.42Å; Q48-L59 HydrophobicContact CB-CB 4.27Å; Q48-L59 PolarHBondContact N-O 3.46Å; Q48-L59 PolarHBondContact O-N 2.81Å; F50-L59 HydrophobicContact CB-CD1 3.87Å; F50-L59 HydrophobicContact CB-CD2 4.49Å; F50-L59 HydrophobicContact CB-CG 3.87Å; F50-L59 HydrophobicContact CD2-CD1 4.43Å; F50-L59 HydrophobicContact CG-CD1 4.06Å; F50-L59 HydrophobicContact CG-CG 4.43Å; L59-V75 HydrophobicContact CB-CG1 4.26Å; L59-Y76 CarbonylContact C-O 3.36Å; L59-Y76 VanDerWaalsContact CA-O 3.31Å; L59-Y76 WeakPolarHBondContact CA-O 3.47Å; L59-K77 HydrophobicContact CD2-CB 3.93Å; L59-L114 HydrophobicContact CB-CD1 4.47Å; L59-F122 HydrophobicContact CD1-CB 4.34Å; L59-F122 HydrophobicContact CD1-CD1 3.59Å; L59-F122 HydrophobicContact CD1-CD2 3.99Å; L59-F122 HydrophobicContact CD1-CE1 3.79Å; L59-F122 HydrophobicContact CD1-CE2 4.16Å; L59-F122 HydrophobicContact CD1-CG 3.7Å; L59-F122 HydrophobicContact CD1-CZ 4.07Å; L59-F150 HydrophobicContact CD2-CE1 4.05Å
60	I	95.7	Very high	85.4	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	119.6	-176.8	-58.6	-178.3	0	0	0	109.3	F35 F43 G44 T46 V47 V58 V75 Y76 C78 A657	F35-I60 HydrophobicContact CB-CD1 3.93Å; F35-I60 HydrophobicContact CD2-CD1 4.17Å; F35-I60 HydrophobicContact CG-CD1 4.2Å; F43-I60 HydrophobicContact CD1-CG2 4.04Å; F43-I60 HydrophobicContact CD2-CG2 4.03Å; F43-I60 HydrophobicContact CE1-CD1 3.68Å; F43-I60 HydrophobicContact CE1-CG2 3.84Å; F43-I60 HydrophobicContact CE2-CB 4.14Å; F43-I60 HydrophobicContact CE2-CD1 4.43Å; F43-I60 HydrophobicContact CE2-CG2 3.83Å; F43-I60 HydrophobicContact CG-CG2 4.16Å; F43-I60 HydrophobicContact CZ-CB 4.01Å; F43-I60 HydrophobicContact CZ-CD1 3.49Å; F43-I60 VanDerWaalsContact CZ-CD1 3.49Å; F43-I60 HydrophobicContact CZ-CG1 4.32Å; F43-I60 HydrophobicContact CZ-CG2 3.74Å; G44-I60 VanDerWaalsContact N-CG2 3.26Å; T46-I60 WeakPolarHBondContact O-CA 3.47Å; V47-I60 HydrophobicContact CG1-CG1 4.47Å; V58-I60 HydrophobicContact CG1-CD1 4.29Å; V58-I60 HydrophobicContact CG1-CG1 3.91Å; I60-V75 WeakPolarHBondContact O-CA 3.42Å; I60-Y76 PolarHBondContact N-O 3.31Å; I60-Y76 PolarHBondContact O-N 2.55Å; I60-C78 VanDerWaalsContact CD1-SG 3.52Å; I60-A657 HydrophobicContact CD1-CB 3.59Å; I60-A657 HydrophobicContact CG1-CB 4.35Å
61	G	95.3	Very high	85	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	138.2	173.2	0	0	0	0	0	111.8	G44 Y45 T46	G44-G61 PolarHBondContact N-O 2.88Å; Y45-G61 PolarHBondContact N-O 3.43Å; T46-G61 PolarHBondContact O-N 2.88Å; T46-G61 WeakPolarHBondContact OG1-CA 3.26Å
62	S	95.1	Very high	84.9	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	80	178.2	178.6	0	0	0	0	109.1	D41 H64 S65 G73 D74	D41-S62 WeakPolarHBondContact CB-OG 3.41Å; D41-S62 CarbonylContact O-C 3.5Å; D41-S62 PolarHBondContact O-OG 3.48Å; S62-H64 PolarHBondContact O-N 3.45Å; S62-S65 PolarHBondContact O-N 3.17Å; S62-G73 CarbonylContact O-C 3.51Å; S62-G73 VanDerWaalsContact O-CA 3.24Å; S62-G73 WeakPolarHBondContact O-CA 3.49Å; S62-D74 PolarHBondContact N-O 2.76Å; S62-D74 PolarHBondContact O-N 2.77Å
63	P	92.6	Very high	85	Confident	3 Å²	3	43 Å²	43	2%	0.019	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-14.1	-170	-22	32.5	0	0	0	114.7	Y45 G73 T109	Y45-P63 HydrophobicContact CD1-CG 3.58Å; Y45-P63 HydrophobicContact CE1-CG 4.36Å; Y45-P63 HydrophobicContact CG-CG 3.73Å; P63-G73 VanDerWaalsContact C-CA 3.5Å; P63-G73 WeakPolarHBondContact O-CA 3.07Å; P63-T109 WeakPolarHBondContact O-CA 3.35Å
64	H	90.7	Very high	85.5	Confident	30 Å²	30	36.9 Å²	36.9	14%	0.139	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.6	9.6	-178.8	-65.8	-3	0	0	0	114.1	D40 D41 M42 S62 G66 Q67 R71	D40-H64 WeakPolarHBondContact O-CB 3.4Å; D41-H64 PolarHBondContact O-N 2.83Å; D41-H64 VanDerWaalsContact O-N 3.12Å; M42-H64 HydrophobicContact CG-CB 4.46Å; M42-H64 PolarHBondContact SD-CD2 3.07Å; M42-H64 PolarHBondContact SD-NE2 3.35Å; S62-H64 PolarHBondContact O-N 3.45Å; H64-G66 PolarHBondContact O-N 3.47Å; H64-Q67 HydrophobicContact CB-CG 4.42Å; H64-Q67 WeakPolarHBondContact O-CG 3.29Å; H64-Q67 PolarHBondContact O-N 3.02Å; H64-R71 HydrophobicContact CB-CG 4.3Å; H64-R71 PolarHBondContact CD2-NH2 3.42Å; H64-R71 VanDerWaalsContact CE1-CZ 3.43Å; H64-R71 PolarHBondContact CE1-NE 3.41Å; H64-R71 VanDerWaalsContact CE1-NE 3.35Å; H64-R71 PolarHBondContact CE1-NH2 2.96Å; H64-R71 PolarHBondContact ND1-NE 2.94Å; H64-R71 PolarHBondContact ND1-NH2 3.18Å; H64-R71 PolarHBondContact NE2-NH2 2.92Å
65	S	88.5	Confident	86	Confident	2 Å²	2	32.7 Å²	32.7	1%	0.014	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	132.6	176.5	-159	0	0	0	0	112.5	D41 S62 T72 G73 Y76 K89	D41-S65 VanDerWaalsContact CG-CA 3.48Å; D41-S65 WeakPolarHBondContact OD2-CA 3.23Å; D41-S65 WeakPolarHBondContact OD2-CB 3.34Å; D41-S65 PolarHBondContact OD2-OG 3.22Å; S62-S65 PolarHBondContact O-N 3.17Å; S65-T72 PolarHBondContact O-N 3.26Å; S65-G73 PolarHBondContact O-N 2.82Å; S65-Y76 PolarHBondContact OG-OH 2.82Å; S65-K89 PolarHBondContact OG-NZ 3.49Å
66	G	77.1	Confident	86.4	Confident	31 Å²	31	33 Å²	33	32%	0.32	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.7	7.2	-177.3	0	0	0	0	0	115.5	H64 K70 R71	H64-G66 PolarHBondContact O-N 3.47Å; G66-K70 CarbonylContact C-O 3.57Å; G66-K70 WeakPolarHBondContact CA-O 3.25Å; G66-K70 CarbonylContact O-C 3.58Å; G66-K70 WeakPolarHBondContact O-CA 3.31Å; G66-K70 PolarHBondContact O-N 2.93Å; G66-K70 VanDerWaalsContact O-O 3.14Å; G66-R71 PolarHBondContact O-N 2.79Å
67	Q	72.1	Confident	86.5	Confident	76 Å²	76	32.3 Å²	32.3	36%	0.355	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	151.9	169.7	-83.7	-170.7	-6.6	0	0	112.7	H64 R71	H64-Q67 HydrophobicContact CB-CG 4.42Å; H64-Q67 WeakPolarHBondContact O-CG 3.29Å; H64-Q67 PolarHBondContact O-N 3.02Å; Q67-R71 HydrophobicContact CG-CB 3.72Å; Q67-R71 HydrophobicContact CG-CG 3.68Å
68	P	57.6	Low	86.6	Confident	134 Å²	134	31.7 Å²	31.7	87%	0.87	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	cis	-92	-13.3	2.2	33.7	-33.6	0	0	0	114.6
69	A	62.3	Low	86.4	Confident	81 Å²	81	32.2 Å²	32.2	67%	0.669	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-21.9	-170	0	0	0	0	0	114.9
70	K	72.9	Confident	86.1	Confident	155 Å²	155	32.9 Å²	32.9	67%	0.674	19%	0.185	S	C	*	.			trans	-144.2	57	-176.3	-65.8	-173.6	179.6	-177.7	0	111.4	G66 T72	G66-K70 CarbonylContact C-O 3.57Å; G66-K70 WeakPolarHBondContact CA-O 3.25Å; G66-K70 CarbonylContact O-C 3.58Å; G66-K70 WeakPolarHBondContact O-CA 3.31Å; G66-K70 PolarHBondContact O-N 2.93Å; G66-K70 VanDerWaalsContact O-O 3.14Å; K70-T72 VanDerWaalsContact C-N 3.3Å; K70-T72 PolarHBondContact O-N 2.93Å
71	R	82.7	Confident	85	Confident	62 Å²	62	36.4 Å²	36.4	23%	0.234	22%	0.222	C	C	.	.			trans	-66.6	84.4	179.1	-175.6	-161.8	-154.7	171.5	2.7	110.6	H64 G66 Q67 N107	H64-R71 HydrophobicContact CB-CG 4.3Å; H64-R71 PolarHBondContact CD2-NH2 3.42Å; H64-R71 VanDerWaalsContact CE1-CZ 3.43Å; H64-R71 PolarHBondContact CE1-NE 3.41Å; H64-R71 VanDerWaalsContact CE1-NE 3.35Å; H64-R71 PolarHBondContact CE1-NH2 2.96Å; H64-R71 PolarHBondContact ND1-NE 2.94Å; H64-R71 PolarHBondContact ND1-NH2 3.18Å; H64-R71 PolarHBondContact NE2-NH2 2.92Å; G66-R71 PolarHBondContact O-N 2.79Å; Q67-R71 HydrophobicContact CG-CB 3.72Å; Q67-R71 HydrophobicContact CG-CG 3.68Å; R71-N107 WeakPolarHBondContact CD-OD1 3.27Å; R71-N107 PolarHBondContact NH1-OD1 2.93Å; R71-N107 WeakPolarHBondContact O-CA 3.31Å; R71-N107 PolarHBondContact O-N 2.76Å
72	T	87.4	Confident	83.6	Confident	29 Å²	29	42.7 Å²	42.7	18%	0.178	25%	0.245	C	C	.	.			trans	-92.4	-25.5	176.4	55.9	0	0	0	0	111.4	S65 K70 P93 M108 T109 M110	S65-T72 PolarHBondContact O-N 3.26Å; K70-T72 VanDerWaalsContact C-N 3.3Å; K70-T72 PolarHBondContact O-N 2.93Å; T72-P93 HydrophobicContact CG2-CB 4.27Å; T72-P93 WeakPolarHBondContact OG1-CG 3.37Å; T72-M108 WeakPolarHBondContact O-CE 3.35Å; T72-M108 WeakPolarHBondContact O-CG 3.39Å; T72-T109 PolarHBondContact O-N 2.98Å; T72-M110 PolarHBondContact O-N 2.84Å
73	G	92.4	Very high	81.8	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	72.7	159.1	-164.7	0	0	0	0	0	111.5	S62 P63 S65 P93 M110	S62-G73 CarbonylContact O-C 3.51Å; S62-G73 VanDerWaalsContact O-CA 3.24Å; S62-G73 WeakPolarHBondContact O-CA 3.49Å; P63-G73 VanDerWaalsContact C-CA 3.5Å; P63-G73 WeakPolarHBondContact O-CA 3.07Å; S65-G73 PolarHBondContact O-N 2.82Å; G73-P93 WeakPolarHBondContact O-CG 3.4Å; G73-M110 CarbonylContact C-O 3.6Å; G73-M110 VanDerWaalsContact C-O 3.32Å; G73-M110 WeakPolarHBondContact CA-O 3.44Å
74	D	93.4	Very high	80.3	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	176.1	175.6	-149.5	-13.8	0	0	0	112.1	S62 K89 E91 L92 P93 M110	S62-D74 PolarHBondContact N-O 2.76Å; S62-D74 PolarHBondContact O-N 2.77Å; D74-K89 HydrophobicContact CB-CG 4.32Å; D74-K89 WeakPolarHBondContact OD2-CE 3.32Å; D74-K89 WeakPolarHBondContact OD2-CG 3.48Å; D74-E91 PolarHBondContact OD1-N 3.07Å; D74-E91 WeakPolarHBondContact OD2-CA 3.47Å; D74-E91 PolarHBondContact OD2-N 2.03Å; D74-L92 PolarHBondContact OD1-N 3.13Å; D74-P93 WeakPolarHBondContact OD1-CD 3.3Å; D74-M110 PolarHBondContact N-O 2.89Å
75	V	94.7	Very high	79.5	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	136.2	174.3	-176	0	0	0	0	109.4	L59 I60 L90 L92 L114 F122 A124	L59-V75 HydrophobicContact CB-CG1 4.26Å; I60-V75 WeakPolarHBondContact O-CA 3.42Å; V75-L90 HydrophobicContact CB-CD1 4.22Å; V75-L90 HydrophobicContact CG1-CD1 4.14Å; V75-L90 VanDerWaalsContact O-CB 3.31Å; V75-L90 WeakPolarHBondContact O-CB 3.33Å; V75-L90 WeakPolarHBondContact O-CG 3.46Å; V75-L90 PolarHBondContact O-N 3.1Å; V75-L92 HydrophobicContact CB-CD1 3.96Å; V75-L92 HydrophobicContact CG2-CD1 3.78Å; V75-L114 HydrophobicContact CG1-CD1 4.36Å; V75-L114 HydrophobicContact CG1-CD2 4.2Å; V75-L114 HydrophobicContact CG2-CD2 3.74Å; V75-F122 HydrophobicContact CG1-CE2 4.46Å; V75-A124 HydrophobicContact CG2-CB 3.95Å
76	Y	93.9	Very high	79.3	Confident	30 Å²	30	59 Å²	59	12%	0.118	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	140.9	176	-69.4	-103	0	0	0	109.9	F43 L59 I60 S65 C87 I88 K89	F43-Y76 AromaticContact CD2-CD2 3.97Å; F43-Y76 HydrophobicContact CD2-CD2 3.97Å; F43-Y76 HydrophobicContact CD2-CE2 4.2Å; F43-Y76 HydrophobicContact CD2-CG 4.31Å; F43-Y76 HydrophobicContact CE2-CD1 4.24Å; F43-Y76 AromaticContact CE2-CD2 3.89Å; F43-Y76 HydrophobicContact CE2-CD2 3.89Å; F43-Y76 HydrophobicContact CE2-CE2 4.46Å; F43-Y76 AromaticContact CE2-CG 3.77Å; F43-Y76 HydrophobicContact CE2-CG 3.77Å; L59-Y76 CarbonylContact C-O 3.36Å; L59-Y76 VanDerWaalsContact CA-O 3.31Å; L59-Y76 WeakPolarHBondContact CA-O 3.47Å; I60-Y76 PolarHBondContact N-O 3.31Å; I60-Y76 PolarHBondContact O-N 2.55Å; S65-Y76 PolarHBondContact OG-OH 2.82Å; Y76-C87 HydrophobicContact CD1-CB 4.3Å; Y76-I88 CarbonylContact C-O 3.53Å; Y76-I88 WeakPolarHBondContact CA-O 3.45Å; Y76-K89 HydrophobicContact CD1-CB 3.95Å; Y76-K89 HydrophobicContact CE1-CB 3.63Å; Y76-K89 HydrophobicContact CE1-CD 4.3Å; Y76-K89 HydrophobicContact CE1-CG 4.06Å
77	K	92.7	Very high	79.9	Confident	32 Å²	32	58.9 Å²	58.9	14%	0.139	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	126	167.6	61.5	172.3	176.3	-178.8	0	109.9	W57 L59 C87 I88 L90 F150	W57-K77 HydrophobicContact CE3-CB 4.19Å; W57-K77 HydrophobicContact CE3-CD 4.27Å; W57-K77 HydrophobicContact CE3-CG 4.39Å; W57-K77 HydrophobicContact CZ3-CD 4.2Å; W57-K77 HydrophobicContact CZ3-CG 4.46Å; L59-K77 HydrophobicContact CD2-CB 3.93Å; K77-C87 WeakPolarHBondContact O-CA 3.28Å; K77-I88 HydrophobicContact CG-CB 4.06Å; K77-I88 PolarHBondContact N-O 2.99Å; K77-I88 PolarHBondContact O-N 3.05Å; K77-L90 HydrophobicContact CB-CD2 4.42Å; K77-L90 HydrophobicContact CD-CD2 3.79Å; K77-L90 HydrophobicContact CG-CD2 3.88Å; K77-L90 HydrophobicContact CG-CG 4.49Å; K77-F150 HydrophobicContact CB-CE1 4.33Å; K77-F150 HydrophobicContact CB-CZ 4.49Å; K77-F150 HydrophobicContact CD-CD1 4.21Å; K77-F150 HydrophobicContact CD-CD2 3.97Å; K77-F150 HydrophobicContact CD-CE1 4.03Å; K77-F150 HydrophobicContact CD-CE2 3.73Å; K77-F150 HydrophobicContact CD-CG 4.19Å; K77-F150 HydrophobicContact CD-CZ 3.77Å
78	C	92.4	Very high	80.8	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	121.7	-179.6	-51.9	0	0	0	0	109.4	F35 W57 V58 I60 C87	F35-C78 HydrophobicContact CD1-CB 3.6Å; F35-C78 HydrophobicContact CE1-CB 3.44Å; F35-C78 VanDerWaalsContact CE1-CB 3.44Å; F35-C78 HydrophobicContact CE2-CB 4.4Å; F35-C78 HydrophobicContact CG-CB 4.14Å; F35-C78 HydrophobicContact CZ-CB 3.85Å; W57-C78 CarbonylContact C-O 3.53Å; W57-C78 VanDerWaalsContact CA-O 3.3Å; W57-C78 WeakPolarHBondContact CA-O 3.37Å; V58-C78 HydrophobicContact CB-CB 4.44Å; V58-C78 PolarHBondContact N-O 3.42Å; V58-C78 WeakPolarHBondContact O-CB 3.34Å; V58-C78 PolarHBondContact O-N 3.39Å; I60-C78 VanDerWaalsContact CD1-SG 3.52Å; C78-C87 HydrophobicContact CB-CB 4.13Å; C78-C87 WeakPolarHBondContact CB-SG 3.48Å; C78-C87 WeakPolarHBondContact SG-CB 3.25Å; C78-C87 CovalentContact SG-SG 2.04Å; C78-C87 PolarHBondContact SG-SG 2.66Å
79	P	90.7	Very high	82.4	Confident	10 Å²	10	56.8 Å²	56.8	7%	0.065	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	144.3	-178.5	29.2	-33.6	0	0	0	111.2	W57 R82 D84 T86	W57-P79 HydrophobicContact CE3-CB 3.96Å; W57-P79 HydrophobicContact CH2-CB 4.34Å; W57-P79 HydrophobicContact CZ3-CB 3.62Å; W57-P79 HydrophobicContact CZ3-CG 4.31Å; P79-R82 HydrophobicContact CB-CB 4.23Å; P79-D84 WeakPolarHBondContact CG-O 3.32Å; P79-T86 WeakPolarHBondContact CD-O 3.45Å
80	V	86.9	Confident	83.8	Confident	15 Å²	15	54.4 Å²	54.4	9%	0.091	31%	0.305	C	S	.	.	S	Bend	trans	-110.1	131.7	172.6	-173.9	0	0	0	0	109.4	F35 K56 V58 R82 L641 L659 W661	F35-V80 HydrophobicContact CZ-CG2 4.49Å; K56-V80 PolarHBondContact O-N 2.92Å; V58-V80 HydrophobicContact CG2-CG2 3.86Å; V80-R82 VanDerWaalsContact C-N 3.33Å; V80-R82 PolarHBondContact O-N 2.72Å; V80-L641 HydrophobicContact CG1-CB 4.24Å; V80-L641 HydrophobicContact CG2-CD2 4.42Å; V80-L659 HydrophobicContact CG1-CD2 3.88Å; V80-L659 HydrophobicContact CG2-CD2 4.14Å; V80-W661 HydrophobicContact CG1-CH2 3.61Å; V80-W661 HydrophobicContact CG1-CZ3 4.35Å
81	G	73.6	Confident	84.6	Confident	74 Å²	74	52.7 Å²	52.7	76%	0.763	30%	0.3	S	S	*	.	S	Bend	trans	77.8	8.2	177.4	0	0	0	0	0	115.9
82	R	66.2	Low	84.9	Confident	132 Å²	132	49.9 Å²	49.9	50%	0.498	29%	0.289	S	S	.	.	S	Bend	trans	-110.7	118.8	171.7	-65	179.2	167.2	165.5	-2.4	107.6	E54 P79 V80 D84	E54-R82 PolarHBondContact O-NH1 2.94Å; E54-R82 PolarHBondContact O-NH2 2.97Å; P79-R82 HydrophobicContact CB-CB 4.23Å; V80-R82 VanDerWaalsContact C-N 3.33Å; V80-R82 PolarHBondContact O-N 2.72Å; R82-D84 CarbonylContact O-C 3.57Å; R82-D84 PolarHBondContact O-N 2.86Å
83	G	56.2	Low	84.8	Confident	83 Å²	83	48.9 Å²	48.9	86%	0.856	28%	0.283	S	S	*	.	S	Bend	trans	-53	-9.2	-164.3	0	0	0	0	0	118.9
84	D	62.8	Low	84.4	Confident	131 Å²	131	52.8 Å²	52.8	70%	0.701	31%	0.308	S	S	*	.			trans	-100	94.6	165.9	-76.5	-28.6	0	0	0	109.2	P79 R82 T86	P79-D84 WeakPolarHBondContact CG-O 3.32Å; R82-D84 CarbonylContact O-C 3.57Å; R82-D84 PolarHBondContact O-N 2.86Å; D84-T86 PolarHBondContact O-N 2.91Å
85	N	72.1	Confident	83.9	Confident	68 Å²	68	58.1 Å²	58.1	36%	0.364	34%	0.336	S	S	.	.			trans	-68.2	31.4	176.4	-65	-19.2	0	0	0	113.3	L33 F35	L33-N85 HydrophobicContact CD2-CB 4.43Å; F35-N85 HydrophobicContact CE1-CB 4.44Å
86	T	84.3	Confident	83.4	Confident	96 Å²	96	58.2 Å²	58.2	59%	0.589	34%	0.336	S	S	*	.			trans	-86.7	120.2	-173.1	-38.5	0	0	0	0	109.7	P79 D84	P79-T86 WeakPolarHBondContact CD-O 3.45Å; D84-T86 PolarHBondContact O-N 2.91Å
87	C	90.4	Very high	82.9	Confident	28 Å²	28	60.7 Å²	60.7	19%	0.189	36%	0.355	C	S	.	.			trans	-75.9	135.9	178.4	-62.9	0	0	0	0	111.7	F43 Y76 K77 C78	F43-C87 HydrophobicContact CZ-CB 4.37Å; Y76-C87 HydrophobicContact CD1-CB 4.3Å; K77-C87 WeakPolarHBondContact O-CA 3.28Å; C78-C87 HydrophobicContact CB-CB 4.13Å; C78-C87 WeakPolarHBondContact CB-SG 3.48Å; C78-C87 WeakPolarHBondContact SG-CB 3.25Å; C78-C87 CovalentContact SG-SG 2.04Å; C78-C87 PolarHBondContact SG-SG 2.66Å
88	I	91.7	Very high	82.4	Confident	89 Å²	89	60.2 Å²	60.2	46%	0.456	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	128.3	-177.9	-55.5	169.9	0	0	0	109.2	Y76 K77	Y76-I88 CarbonylContact C-O 3.53Å; Y76-I88 WeakPolarHBondContact CA-O 3.45Å; K77-I88 HydrophobicContact CG-CB 4.06Å; K77-I88 PolarHBondContact N-O 2.99Å; K77-I88 PolarHBondContact O-N 3.05Å
89	K	91.5	Very high	81.7	Confident	76 Å²	76	64.8 Å²	64.8	33%	0.33	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	136.5	176.9	-171.1	169.6	-179.3	165	0	111.1	S65 D74 Y76 E91	S65-K89 PolarHBondContact OG-NZ 3.49Å; D74-K89 HydrophobicContact CB-CG 4.32Å; D74-K89 WeakPolarHBondContact OD2-CE 3.32Å; D74-K89 WeakPolarHBondContact OD2-CG 3.48Å; Y76-K89 HydrophobicContact CD1-CB 3.95Å; Y76-K89 HydrophobicContact CE1-CB 3.63Å; Y76-K89 HydrophobicContact CE1-CD 4.3Å; Y76-K89 HydrophobicContact CE1-CG 4.06Å; K89-E91 HydrophobicContact CG-CG 4.31Å
90	L	90.9	Very high	80.7	Confident	31 Å²	31	71.4 Å²	71.4	16%	0.162	42%	0.419	C	S	.	.			trans	-89.5	-15.3	-177.3	-68.3	-179.4	0	0	0	114.9	V75 K77 L92 F122 F150	V75-L90 HydrophobicContact CB-CD1 4.22Å; V75-L90 HydrophobicContact CG1-CD1 4.14Å; V75-L90 VanDerWaalsContact O-CB 3.31Å; V75-L90 WeakPolarHBondContact O-CB 3.33Å; V75-L90 WeakPolarHBondContact O-CG 3.46Å; V75-L90 PolarHBondContact O-N 3.1Å; K77-L90 HydrophobicContact CB-CD2 4.42Å; K77-L90 HydrophobicContact CD-CD2 3.79Å; K77-L90 HydrophobicContact CG-CD2 3.88Å; K77-L90 HydrophobicContact CG-CG 4.49Å; L90-L92 HydrophobicContact CB-CD2 4Å; L90-L92 HydrophobicContact CB-CG 3.91Å; L90-L92 PolarHBondContact O-N 3.14Å; L90-F122 HydrophobicContact CD1-CZ 3.77Å; L90-F150 HydrophobicContact CD1-CD1 4.2Å; L90-F150 HydrophobicContact CD2-CB 4.03Å; L90-F150 HydrophobicContact CD2-CD1 4.08Å; L90-F150 HydrophobicContact CD2-CG 4.16Å
91	E	90.1	Very high	80.2	Confident	119 Å²	119	72.4 Å²	72.4	56%	0.556	42%	0.424	S	S	*	.			trans	57	30.4	179.6	-56.8	-166.6	157.4	0	0	114.4	D74 K89 T94	D74-E91 PolarHBondContact OD1-N 3.07Å; D74-E91 WeakPolarHBondContact OD2-CA 3.47Å; D74-E91 PolarHBondContact OD2-N 2.03Å; K89-E91 HydrophobicContact CG-CG 4.31Å; E91-T94 PolarHBondContact O-N 3.16Å; E91-T94 VanDerWaalsContact O-N 3.17Å; E91-T94 PolarHBondContact O-OG1 3.05Å
92	L	88.9	Confident	80.6	Confident	3 Å²	3	75.2 Å²	75.2	2%	0.016	42%	0.417	C	S	.	.	H	α-helix	trans	-51.2	-44.3	-179.5	-56.1	179.1	0	0	0	113.9	D74 V75 L90 T94 N95 T96 M110 A124 V146 I152	D74-L92 PolarHBondContact OD1-N 3.13Å; V75-L92 HydrophobicContact CB-CD1 3.96Å; V75-L92 HydrophobicContact CG2-CD1 3.78Å; L90-L92 HydrophobicContact CB-CD2 4Å; L90-L92 HydrophobicContact CB-CG 3.91Å; L90-L92 PolarHBondContact O-N 3.14Å; L92-T94 PolarHBondContact O-N 2.77Å; L92-T94 VanDerWaalsContact O-N 3.08Å; L92-N95 PolarHBondContact O-N 3.41Å; L92-N95 VanDerWaalsContact O-N 3.14Å; L92-T96 PolarHBondContact O-N 2.99Å; L92-T96 PolarHBondContact O-OG1 2.8Å; L92-T96 VanDerWaalsContact O-OG1 3.08Å; L92-M110 HydrophobicContact CB-CG 4.45Å; L92-A124 HydrophobicContact CD1-CB 3.88Å; L92-V146 HydrophobicContact CD1-CG2 4.38Å; L92-V146 HydrophobicContact CD2-CG2 4.02Å; L92-I152 HydrophobicContact CD2-CD1 4.25Å; L92-I152 HydrophobicContact CD2-CG1 4.1Å
93	P	85.5	Confident	81.4	Confident	8 Å²	8	71.1 Å²	71.1	5%	0.052	40%	0.403	C	S	.	.	H	α-helix	trans	-47.4	-37.2	177	-34.9	38.4	0	0	0	117.2	T72 G73 D74 N95 K105 M108 M110	T72-P93 HydrophobicContact CG2-CB 4.27Å; T72-P93 WeakPolarHBondContact OG1-CG 3.37Å; G73-P93 WeakPolarHBondContact O-CG 3.4Å; D74-P93 WeakPolarHBondContact OD1-CD 3.3Å; P93-N95 VanDerWaalsContact C-N 3.27Å; P93-N95 PolarHBondContact O-N 3.09Å; P93-K105 PolarHBondContact O-NZ 3.27Å; P93-M108 VanDerWaalsContact CA-CE 3.47Å; P93-M108 HydrophobicContact CB-CE 3.31Å; P93-M108 HydrophobicContact CG-CE 3.34Å; P93-M110 HydrophobicContact CG-CB 4.46Å
94	T	83.5	Confident	82.8	Confident	83 Å²	83	68.6 Å²	68.6	51%	0.509	37%	0.37	S	S	.	.	H	α-helix	trans	-69.1	-33.7	-172.5	60.3	0	0	0	0	111	E91 L92	E91-T94 PolarHBondContact O-N 3.16Å; E91-T94 VanDerWaalsContact O-N 3.17Å; E91-T94 PolarHBondContact O-OG1 3.05Å; L92-T94 PolarHBondContact O-N 2.77Å; L92-T94 VanDerWaalsContact O-N 3.08Å
95	N	82.4	Confident	83.8	Confident	113 Å²	113	64.7 Å²	64.7	60%	0.604	35%	0.347	S	S	*	.	H	α-helix	trans	-107.1	-9	-172.5	-67.7	-6.2	0	0	0	113.2	L92 P93 T97 I152	L92-N95 PolarHBondContact O-N 3.41Å; L92-N95 VanDerWaalsContact O-N 3.14Å; P93-N95 VanDerWaalsContact C-N 3.27Å; P93-N95 PolarHBondContact O-N 3.09Å; N95-T97 PolarHBondContact O-N 3.36Å; N95-I152 HydrophobicContact CB-CD1 3.45Å; N95-I152 VanDerWaalsContact CB-CD1 3.45Å
96	T	84.4	Confident	84.4	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.006	36%	0.357	C	S	.	.			trans	-74.2	110.8	169.4	-63	0	0	0	0	110	L92 K105 M110 V142 T144	L92-T96 PolarHBondContact O-N 2.99Å; L92-T96 PolarHBondContact O-OG1 2.8Å; L92-T96 VanDerWaalsContact O-OG1 3.08Å; T96-K105 WeakPolarHBondContact O-CE 3.34Å; T96-K105 PolarHBondContact O-NZ 2.97Å; T96-M110 HydrophobicContact CG2-CE 4.04Å; T96-V142 HydrophobicContact CG2-CG1 4.07Å; T96-V142 HydrophobicContact CG2-CG2 3.81Å; T96-T144 VanDerWaalsContact CG2-OG1 3.27Å; T96-T144 WeakPolarHBondContact CG2-OG1 3.24Å; T96-T144 PolarHBondContact OG1-OG1 2.92Å
97	T	83.4	Confident	84.5	Confident	82 Å²	82	66.1 Å²	66.1	50%	0.503	35%	0.347	S	S	.	.			trans	-139.2	142.7	176.5	55.4	0	0	0	0	111.4	N95 E103	N95-T97 PolarHBondContact O-N 3.36Å; T97-E103 VanDerWaalsContact CA-OE1 3.31Å; T97-E103 WeakPolarHBondContact CA-OE1 3.37Å
98	V	82.5	Confident	84.4	Confident	23 Å²	23	64.8 Å²	64.8	14%	0.139	34%	0.338	C	S	.	.			trans	-110.4	125.2	173.9	-169.7	0	0	0	0	108.7	L101 E103 Y129 V142 A157	V98-L101 HydrophobicContact CB-CD1 3.87Å; V98-L101 HydrophobicContact CG1-CD1 3.47Å; V98-L101 VanDerWaalsContact CG1-CD1 3.47Å; V98-E103 PolarHBondContact N-OE1 2.61Å; V98-Y129 HydrophobicContact CG2-CE1 4.47Å; V98-V142 HydrophobicContact CG2-CG2 4.21Å; V98-A157 HydrophobicContact CG1-CB 4.45Å; V98-A157 HydrophobicContact CG2-CB 3.95Å
99	P	77	Confident	84.5	Confident	96 Å²	96	60.9 Å²	60.9	62%	0.623	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	151.7	-174.6	26.4	-34.2	0	0	0	112.9	L101	P99-L101 PolarHBondContact O-N 2.81Å
100	N	71.5	Confident	84.6	Confident	148 Å²	148	57.2 Å²	57.2	79%	0.791	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	24.4	173	-53.2	-45.8	0	0	0	116.7
101	L	75.4	Confident	84.6	Confident	36 Å²	36	55.8 Å²	55.8	19%	0.188	29%	0.294	C	S	.	.	S	Bend	trans	-128.5	152.2	-179.1	-67.3	158.3	0	0	0	112.2	V98 P99 E103 Y131 V160	V98-L101 HydrophobicContact CB-CD1 3.87Å; V98-L101 HydrophobicContact CG1-CD1 3.47Å; V98-L101 VanDerWaalsContact CG1-CD1 3.47Å; P99-L101 PolarHBondContact O-N 2.81Å; L101-E103 PolarHBondContact O-N 3.33Å; L101-Y131 HydrophobicContact CD2-CD2 4.08Å; L101-V160 HydrophobicContact CD1-CB 4.27Å; L101-V160 HydrophobicContact CD1-CG1 3.39Å; L101-V160 HydrophobicContact CD2-CG1 3.52Å; L101-V160 HydrophobicContact CG-CG1 4.07Å
102	H	81.1	Confident	84.8	Confident	134 Å²	134	51.1 Å²	51.1	62%	0.62	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	93.4	167.9	-175.2	-73	0	0	0	109.3	M132	H102-M132 HydrophobicContact CB-CB 4.14Å; H102-M132 PolarHBondContact O-N 3.2Å
103	E	84.3	Confident	85.1	Confident	46 Å²	46	51.7 Å²	51.7	22%	0.215	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	143	-171.2	-46.4	-173.4	139.3	0	0	113.1	T97 V98 L101 K105 Y129	T97-E103 VanDerWaalsContact CA-OE1 3.31Å; T97-E103 WeakPolarHBondContact CA-OE1 3.37Å; V98-E103 PolarHBondContact N-OE1 2.61Å; L101-E103 PolarHBondContact O-N 3.33Å; E103-K105 HydrophobicContact CB-CG 4.46Å; E103-K105 WeakPolarHBondContact OE2-CE 3.11Å; E103-K105 IonicContact OE2-NZ 3.26Å; E103-K105 PolarHBondContact OE2-NZ 2.82Å; E103-Y129 HydrophobicContact CB-CE2 4.4Å; E103-Y129 WeakPolarHBondContact CB-OH 3.48Å; E103-Y129 VanDerWaalsContact CD-OH 3.26Å; E103-Y129 WeakPolarHBondContact CG-OH 3.35Å; E103-Y129 PolarHBondContact OE1-OH 2.77Å; E103-Y129 VanDerWaalsContact OE1-OH 3.1Å
104	I	86	Confident	85.5	Confident	30 Å²	30	52.2 Å²	52.2	15%	0.154	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	99.9	166.3	-62.9	174.9	0	0	0	107.7	E106 G130 M132 Q137	I104-E106 HydrophobicContact CG2-CB 4.23Å; I104-G130 CarbonylContact C-O 3.56Å; I104-G130 WeakPolarHBondContact CA-O 3.38Å; I104-G130 PolarHBondContact N-O 3.11Å; I104-G130 PolarHBondContact O-N 3.01Å; I104-G130 VanDerWaalsContact O-N 3.15Å; I104-G130 VanDerWaalsContact O-O 3.07Å; I104-M132 HydrophobicContact CD1-CG 3.43Å; I104-M132 VanDerWaalsContact CD1-CG 3.43Å; I104-M132 HydrophobicContact CD1-SD 3.45Å; I104-M132 WeakPolarHBondContact CD1-SD 3.46Å; I104-M132 HydrophobicContact CG1-CG 3.98Å; I104-Q137 HydrophobicContact CD1-CB 4.32Å; I104-Q137 HydrophobicContact CD1-CG 3.77Å
105	K	84	Confident	85.9	Confident	48 Å²	48	48.9 Å²	48.9	21%	0.209	26%	0.259	C	S	.	.			trans	-86.1	-9.4	179	-57	-169.6	-173.6	-172.7	0	113.4	P93 T96 E103 N107 M108 Y129	P93-K105 PolarHBondContact O-NZ 3.27Å; T96-K105 WeakPolarHBondContact O-CE 3.34Å; T96-K105 PolarHBondContact O-NZ 2.97Å; E103-K105 HydrophobicContact CB-CG 4.46Å; E103-K105 WeakPolarHBondContact OE2-CE 3.11Å; E103-K105 IonicContact OE2-NZ 3.26Å; E103-K105 PolarHBondContact OE2-NZ 2.82Å; K105-N107 PolarHBondContact O-N 2.79Å; K105-M108 HydrophobicContact CB-SD 4.47Å; K105-M108 WeakPolarHBondContact O-CG 3.42Å; K105-M108 PolarHBondContact O-N 2.78Å; K105-Y129 HydrophobicContact CG-CE2 4.33Å
106	E	83.6	Confident	86	Confident	125 Å²	125	46.2 Å²	46.2	58%	0.584	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	130.5	175.6	-67.3	-179.2	-172.6	0	0	110.3	I104 M108	I104-E106 HydrophobicContact CG2-CB 4.23Å; E106-M108 VanDerWaalsContact C-N 3.28Å; E106-M108 PolarHBondContact O-N 2.92Å
107	N	86.3	Confident	85.9	Confident	69 Å²	69	47.8 Å²	47.8	37%	0.369	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.2	21.9	-175.1	-57	-60.3	0	0	0	115.4	R71 K105 T109 Q128	R71-N107 WeakPolarHBondContact CD-OD1 3.27Å; R71-N107 PolarHBondContact NH1-OD1 2.93Å; R71-N107 WeakPolarHBondContact O-CA 3.31Å; R71-N107 PolarHBondContact O-N 2.76Å; K105-N107 PolarHBondContact O-N 2.79Å; N107-T109 PolarHBondContact O-N 3.49Å; N107-T109 VanDerWaalsContact O-N 3.11Å; N107-Q128 WeakPolarHBondContact O-CB 2.88Å; N107-Q128 PolarHBondContact O-OE1 3.31Å
108	M	88.7	Confident	85.3	Confident	1 Å²	1	48 Å²	48	1%	0.005	26%	0.259	C	S	.	.			trans	-66.9	-16	-177.7	73	167.6	-176.8	0	0	115.4	T72 P93 K105 E106 M110 G126 Q128 Y129	T72-M108 WeakPolarHBondContact O-CE 3.35Å; T72-M108 WeakPolarHBondContact O-CG 3.39Å; P93-M108 VanDerWaalsContact CA-CE 3.47Å; P93-M108 HydrophobicContact CB-CE 3.31Å; P93-M108 HydrophobicContact CG-CE 3.34Å; K105-M108 HydrophobicContact CB-SD 4.47Å; K105-M108 WeakPolarHBondContact O-CG 3.42Å; K105-M108 PolarHBondContact O-N 2.78Å; E106-M108 VanDerWaalsContact C-N 3.28Å; E106-M108 PolarHBondContact O-N 2.92Å; M108-M110 HydrophobicContact CE-CB 3.58Å; M108-M110 HydrophobicContact CE-CE 4.03Å; M108-M110 HydrophobicContact CE-CG 4.33Å; M108-M110 PolarHBondContact O-N 2.85Å; M108-M110 HydrophobicContact SD-CE 4.33Å; M108-G126 CarbonylContact O-C 3.54Å; M108-G126 WeakPolarHBondContact O-CA 3.26Å; M108-Q128 PolarHBondContact O-N 2.8Å; M108-Y129 HydrophobicContact CB-CD2 4.36Å; M108-Y129 HydrophobicContact SD-CD2 4.24Å
109	T	92.9	Very high	84.8	Confident	6 Å²	6	53 Å²	53	4%	0.037	29%	0.289	C	S	.	.			trans	52.3	51.1	178.6	67	0	0	0	0	114.1	P63 T72 N107 T112 Q128	P63-T109 WeakPolarHBondContact O-CA 3.35Å; T72-T109 PolarHBondContact O-N 2.98Å; N107-T109 PolarHBondContact O-N 3.49Å; N107-T109 VanDerWaalsContact O-N 3.11Å; T109-T112 PolarHBondContact O-N 2.87Å; T109-T112 PolarHBondContact O-OG1 3.49Å; T109-T112 PolarHBondContact OG1-OG1 2.95Å; T109-Q128 HydrophobicContact CG2-CB 4.37Å; T109-Q128 HydrophobicContact CG2-CG 4.43Å
110	M	93.5	Very high	84.7	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-62.1	136.7	175.1	-174.5	68.5	78.9	0	0	110.9	T72 G73 D74 L92 P93 T96 M108 A124 V142	T72-M110 PolarHBondContact O-N 2.84Å; G73-M110 CarbonylContact C-O 3.6Å; G73-M110 VanDerWaalsContact C-O 3.32Å; G73-M110 WeakPolarHBondContact CA-O 3.44Å; D74-M110 PolarHBondContact N-O 2.89Å; L92-M110 HydrophobicContact CB-CG 4.45Å; P93-M110 HydrophobicContact CG-CB 4.46Å; T96-M110 HydrophobicContact CG2-CE 4.04Å; M108-M110 HydrophobicContact CE-CB 3.58Å; M108-M110 HydrophobicContact CE-CE 4.03Å; M108-M110 HydrophobicContact CE-CG 4.33Å; M108-M110 PolarHBondContact O-N 2.85Å; M108-M110 HydrophobicContact SD-CE 4.33Å; M110-A124 HydrophobicContact SD-CB 4.07Å; M110-V142 HydrophobicContact CE-CG1 4.06Å
111	G	92.3	Very high	85.5	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.1	4.4	-177.1	0	0	0	0	0	114	T46 T113 C125	T46-G111 PolarHBondContact OG1-O 3.5Å; G111-T113 PolarHBondContact O-N 3.31Å; G111-C125 PolarHBondContact N-O 2.8Å; G111-C125 VanDerWaalsContact N-O 3.1Å
112	T	93.8	Very high	86.3	Confident	22 Å²	22	41.4 Å²	41.4	14%	0.135	23%	0.231	C	C	.	.	S	Bend	trans	-61.5	-33.4	167.9	-63.1	0	0	0	0	111.5	Y45 T46 T109 P127	Y45-T112 HydrophobicContact CE1-CG2 3.72Å; T46-T112 WeakPolarHBondContact CG2-O 3.48Å; T109-T112 PolarHBondContact O-N 2.87Å; T109-T112 PolarHBondContact O-OG1 3.49Å; T109-T112 PolarHBondContact OG1-OG1 2.95Å; T112-P127 HydrophobicContact CG2-CG 3.98Å
113	T	95	Very high	86.8	Confident	15 Å²	15	35.6 Å²	35.6	9%	0.092	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	127.8	-177.7	-45.1	0	0	0	0	109.1	G111 C125 G380 F381 A383	G111-T113 PolarHBondContact O-N 3.31Å; T113-C125 PolarHBondContact O-N 2.8Å; T113-G380 PolarHBondContact OG1-O 3.15Å; T113-G380 VanDerWaalsContact OG1-O 3.12Å; T113-F381 PolarHBondContact OG1-O 2.68Å; T113-A383 HydrophobicContact CG2-CB 3.74Å
114	L	93.6	Very high	87.3	Confident	18 Å²	18	33.4 Å²	33.4	9%	0.094	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	134	178.3	-69	177	0	0	0	108.6	T46 Q48 L59 V75 F122 M123 A124	T46-L114 WeakPolarHBondContact OG1-CD1 3.44Å; Q48-L114 HydrophobicContact CB-CB 4.41Å; Q48-L114 HydrophobicContact CB-CD1 4.45Å; L59-L114 HydrophobicContact CB-CD1 4.47Å; V75-L114 HydrophobicContact CG1-CD1 4.36Å; V75-L114 HydrophobicContact CG1-CD2 4.2Å; V75-L114 HydrophobicContact CG2-CD2 3.74Å; L114-F122 HydrophobicContact CD2-CD2 4.34Å; L114-F122 HydrophobicContact CD2-CE2 4.48Å; L114-M123 WeakPolarHBondContact CA-O 3.23Å; L114-A124 HydrophobicContact CD2-CB 3.77Å
115	V	91.6	Very high	87.7	Confident	13 Å²	13	32 Å²	32	8%	0.079	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	139.7	177.2	65.2	0	0	0	0	110.1	F122 M123 A383 A385 L390	V115-F122 CarbonylContact O-C 3.58Å; V115-F122 WeakPolarHBondContact O-CA 3.5Å; V115-F122 WeakPolarHBondContact O-CB 3.19Å; V115-M123 HydrophobicContact CG1-CB 3.81Å; V115-M123 PolarHBondContact N-O 2.95Å; V115-M123 VanDerWaalsContact N-O 3.07Å; V115-M123 PolarHBondContact O-N 3.3Å; V115-A383 HydrophobicContact CB-CB 4.28Å; V115-A383 HydrophobicContact CG1-CB 3.87Å; V115-A385 HydrophobicContact CG2-CB 3.95Å; V115-L390 HydrophobicContact CG1-CD1 4.07Å
116	T	86.1	Confident	88.2	Confident	57 Å²	57	29.7 Å²	29.7	35%	0.35	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	139.8	174.5	41.2	0	0	0	0	111.5	Q48 A385	Q48-T116 HydrophobicContact CG-CG2 4.13Å; T116-A385 WeakPolarHBondContact O-CB 3.47Å
117	N	81	Confident	88.7	Confident	35 Å²	35	23.9 Å²	23.9	19%	0.187	15%	0.15	C	C	.	.			trans	-90.8	126.8	176.3	-171.5	-27.5	0	0	0	109.9	T119 G120 G121 N145	N117-T119 VanDerWaalsContact CG-OG1 3.3Å; N117-T119 PolarHBondContact ND2-OG1 2.7Å; N117-T119 PolarHBondContact O-N 2.78Å; N117-T119 VanDerWaalsContact O-N 3.15Å; N117-T119 PolarHBondContact OD1-N 3.08Å; N117-T119 PolarHBondContact OD1-OG1 3.21Å; N117-G120 PolarHBondContact O-N 3.16Å; N117-G121 PolarHBondContact N-O 2.85Å; N117-G121 VanDerWaalsContact N-O 3.08Å; N117-N145 PolarHBondContact ND2-ND2 3.5Å; N117-N145 PolarHBondContact ND2-OD1 2.76Å
118	P	71.8	Confident	88.9	Confident	86 Å²	86	24.5 Å²	24.5	56%	0.558	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-26.5	177.7	-23.8	33.3	0	0	0	113.7	G120 A385	P118-G120 VanDerWaalsContact C-N 3.27Å; P118-G120 PolarHBondContact O-N 2.86Å; P118-A385 HydrophobicContact CG-CB 3.93Å
119	T	70.4	Confident	89.1	Confident	128 Å²	128	24.5 Å²	24.5	79%	0.785	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.1	2.4	177.9	61.1	0	0	0	0	113.6	N117	N117-T119 VanDerWaalsContact CG-OG1 3.3Å; N117-T119 PolarHBondContact ND2-OG1 2.7Å; N117-T119 PolarHBondContact O-N 2.78Å; N117-T119 VanDerWaalsContact O-N 3.15Å; N117-T119 PolarHBondContact OD1-N 3.08Å; N117-T119 PolarHBondContact OD1-OG1 3.21Å
120	G	76.1	Confident	88.8	Confident	31 Å²	31	24.2 Å²	24.2	32%	0.32	15%	0.149	S	C	.	.	S	Bend	trans	103.2	143.5	-177.8	0	0	0	0	0	112.9	N117 P118	N117-G120 PolarHBondContact O-N 3.16Å; P118-G120 VanDerWaalsContact C-N 3.27Å; P118-G120 PolarHBondContact O-N 2.86Å
121	G	88.4	Confident	88.5	Confident	5 Å²	5	24.3 Å²	24.3	5%	0.052	15%	0.149	C	C	.	.	S	Bend	trans	89.2	-157.1	-175.4	0	0	0	0	0	112.6	N117 V146	N117-G121 PolarHBondContact N-O 2.85Å; N117-G121 VanDerWaalsContact N-O 3.08Å; G121-V146 CarbonylContact C-O 3.58Å; G121-V146 VanDerWaalsContact CA-O 3.28Å; G121-V146 WeakPolarHBondContact CA-O 3.45Å
122	F	92	Very high	87.8	Confident	1 Å²	1	26.6 Å²	26.6	0%	0.004	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	162.9	-179.2	68.2	-84.2	0	0	0	111.1	F50 L59 V75 L90 L114 V115 A124 V146 F150	F50-F122 HydrophobicContact CE2-CD1 4.4Å; L59-F122 HydrophobicContact CD1-CB 4.34Å; L59-F122 HydrophobicContact CD1-CD1 3.59Å; L59-F122 HydrophobicContact CD1-CD2 3.99Å; L59-F122 HydrophobicContact CD1-CE1 3.79Å; L59-F122 HydrophobicContact CD1-CE2 4.16Å; L59-F122 HydrophobicContact CD1-CG 3.7Å; L59-F122 HydrophobicContact CD1-CZ 4.07Å; V75-F122 HydrophobicContact CG1-CE2 4.46Å; L90-F122 HydrophobicContact CD1-CZ 3.77Å; L114-F122 HydrophobicContact CD2-CD2 4.34Å; L114-F122 HydrophobicContact CD2-CE2 4.48Å; V115-F122 CarbonylContact O-C 3.58Å; V115-F122 WeakPolarHBondContact O-CA 3.5Å; V115-F122 WeakPolarHBondContact O-CB 3.19Å; F122-A124 HydrophobicContact CE2-CB 4.31Å; F122-V146 HydrophobicContact CD1-CB 4.17Å; F122-V146 HydrophobicContact CD1-CG1 4.33Å; F122-V146 HydrophobicContact CD2-CB 4.38Å; F122-V146 HydrophobicContact CE1-CB 3.82Å; F122-V146 HydrophobicContact CE1-CG1 3.6Å; F122-V146 HydrophobicContact CE2-CB 4.05Å; F122-V146 HydrophobicContact CE2-CG1 4.43Å; F122-V146 HydrophobicContact CE2-CG2 3.97Å; F122-V146 HydrophobicContact CG-CB 4.43Å; F122-V146 HydrophobicContact CZ-CB 3.75Å; F122-V146 HydrophobicContact CZ-CG1 3.66Å; F122-V146 HydrophobicContact CZ-CG2 3.98Å; F122-V146 PolarHBondContact N-O 2.63Å; F122-V146 WeakPolarHBondContact O-CA 3.4Å; F122-V146 WeakPolarHBondContact O-CB 3.49Å; F122-V146 PolarHBondContact O-N 2.76Å; F122-F150 AromaticContact CE1-CD1 3.91Å; F122-F150 HydrophobicContact CE1-CD1 3.91Å; F122-F150 HydrophobicContact CE1-CE1 4.2Å; F122-F150 HydrophobicContact CZ-CD1 4.49Å
123	M	92	Very high	86.8	Confident	11 Å²	11	25.8 Å²	25.8	5%	0.054	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	137	173.3	-178.3	174.2	-65.9	0	0	110.1	L114 V115 C143 T144 N145 I156 L390 L392	L114-M123 WeakPolarHBondContact CA-O 3.23Å; V115-M123 HydrophobicContact CG1-CB 3.81Å; V115-M123 PolarHBondContact N-O 2.95Å; V115-M123 VanDerWaalsContact N-O 3.07Å; V115-M123 PolarHBondContact O-N 3.3Å; M123-C143 HydrophobicContact CG-CB 4.08Å; M123-C143 HydrophobicContact SD-CB 3.64Å; M123-T144 WeakPolarHBondContact CA-O 3.1Å; M123-T144 WeakPolarHBondContact CG-O 3.23Å; M123-N145 HydrophobicContact CE-CB 4.23Å; M123-I156 HydrophobicContact CE-CD1 4.46Å; M123-L390 HydrophobicContact CE-CD2 3.53Å; M123-L390 HydrophobicContact SD-CD2 3.25Å; M123-L390 WeakPolarHBondContact SD-CD2 3.04Å; M123-L392 HydrophobicContact SD-CD2 4.49Å
124	A	94.4	Very high	85.5	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	130.6	174.3	0	0	0	0	0	109.7	V75 L92 M110 L114 F122 T144	V75-A124 HydrophobicContact CG2-CB 3.95Å; L92-A124 HydrophobicContact CD1-CB 3.88Å; M110-A124 HydrophobicContact SD-CB 4.07Å; L114-A124 HydrophobicContact CD2-CB 3.77Å; F122-A124 HydrophobicContact CE2-CB 4.31Å; A124-T144 PolarHBondContact N-O 2.76Å; A124-T144 PolarHBondContact O-N 2.93Å
125	C	94.6	Very high	84.1	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	148.2	178.8	-55	0	0	0	0	112.5	G111 T113 V142 C143 G380	G111-C125 PolarHBondContact N-O 2.8Å; G111-C125 VanDerWaalsContact N-O 3.1Å; T113-C125 PolarHBondContact O-N 2.8Å; C125-V142 CarbonylContact C-O 3.55Å; C125-V142 VanDerWaalsContact CA-O 3.29Å; C125-V142 WeakPolarHBondContact CA-O 3.31Å; C125-C143 HydrophobicContact CB-CB 4.1Å; C125-C143 WeakPolarHBondContact CB-SG 3.39Å; C125-C143 WeakPolarHBondContact SG-CB 2.95Å; C125-C143 CovalentContact SG-SG 2.05Å; C125-C143 PolarHBondContact SG-SG 2.96Å; C125-G380 WeakPolarHBondContact CB-O 3.08Å
126	G	94.7	Very high	83	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	91.3	171.7	0	0	0	0	0	109.7	M108 Q128 Y129 G141 V142	M108-G126 CarbonylContact O-C 3.54Å; M108-G126 WeakPolarHBondContact O-CA 3.26Å; G126-Q128 PolarHBondContact O-N 2.9Å; G126-Y129 WeakPolarHBondContact O-CB 3.41Å; G126-Y129 PolarHBondContact O-N 2.79Å; G126-G141 WeakPolarHBondContact O-CA 3.09Å; G126-V142 PolarHBondContact N-O 2.85Å; G126-V142 PolarHBondContact O-N 2.82Å; G126-V142 VanDerWaalsContact O-N 3.08Å
127	P	93.4	Very high	82.7	Confident	4 Å²	4	36.7 Å²	36.7	3%	0.026	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-13.3	-171.6	26.5	-34.6	0	0	0	114.1	T112 Q378 F381	T112-P127 HydrophobicContact CG2-CG 3.98Å; P127-Q378 HydrophobicContact CB-CB 4.47Å; P127-Q378 WeakPolarHBondContact O-CB 3.49Å; P127-F381 HydrophobicContact CB-CB 4.32Å; P127-F381 HydrophobicContact CB-CD2 4.26Å; P127-F381 HydrophobicContact CG-CD2 4.48Å
128	Q	91.7	Very high	82.8	Confident	81 Å²	81	35.4 Å²	35.4	38%	0.379	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	10.9	177	-69.3	-164.7	-8.1	0	0	113.2	N107 M108 T109 G126 G130	N107-Q128 WeakPolarHBondContact O-CB 2.88Å; N107-Q128 PolarHBondContact O-OE1 3.31Å; M108-Q128 PolarHBondContact O-N 2.8Å; T109-Q128 HydrophobicContact CG2-CB 4.37Å; T109-Q128 HydrophobicContact CG2-CG 4.43Å; G126-Q128 PolarHBondContact O-N 2.9Å; Q128-G130 PolarHBondContact O-N 2.73Å
129	Y	91.2	Very high	83.6	Confident	1 Å²	1	33.4 Å²	33.4	0%	0.004	19%	0.189	C	C	.	.			trans	-57.1	127.4	174	174.2	-93.7	0	0	0	111.4	V98 E103 K105 M108 G126 I139 S140 G141 V142	V98-Y129 HydrophobicContact CG2-CE1 4.47Å; E103-Y129 HydrophobicContact CB-CE2 4.4Å; E103-Y129 WeakPolarHBondContact CB-OH 3.48Å; E103-Y129 VanDerWaalsContact CD-OH 3.26Å; E103-Y129 WeakPolarHBondContact CG-OH 3.35Å; E103-Y129 PolarHBondContact OE1-OH 2.77Å; E103-Y129 VanDerWaalsContact OE1-OH 3.1Å; K105-Y129 HydrophobicContact CG-CE2 4.33Å; M108-Y129 HydrophobicContact CB-CD2 4.36Å; M108-Y129 HydrophobicContact SD-CD2 4.24Å; G126-Y129 WeakPolarHBondContact O-CB 3.41Å; G126-Y129 PolarHBondContact O-N 2.79Å; Y129-I139 WeakPolarHBondContact O-CA 3.49Å; Y129-S140 PolarHBondContact O-N 2.84Å; Y129-S140 VanDerWaalsContact O-N 3.1Å; Y129-G141 PolarHBondContact O-N 2.86Å; Y129-V142 HydrophobicContact CD1-CB 3.94Å; Y129-V142 HydrophobicContact CD1-CG1 4.37Å; Y129-V142 HydrophobicContact CD2-CB 4.16Å; Y129-V142 HydrophobicContact CD2-CG1 3.76Å; Y129-V142 HydrophobicContact CG-CB 3.72Å; Y129-V142 HydrophobicContact CG-CG1 3.64Å
130	G	88	Confident	84.4	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	158.9	-177.2	0	0	0	0	0	113.6	I104 Q128 Y138	I104-G130 CarbonylContact C-O 3.56Å; I104-G130 WeakPolarHBondContact CA-O 3.38Å; I104-G130 PolarHBondContact N-O 3.11Å; I104-G130 PolarHBondContact O-N 3.01Å; I104-G130 VanDerWaalsContact O-N 3.15Å; I104-G130 VanDerWaalsContact O-O 3.07Å; Q128-G130 PolarHBondContact O-N 2.73Å; G130-Y138 CarbonylContact C-O 3.44Å; G130-Y138 WeakPolarHBondContact CA-O 3.14Å
131	Y	85.8	Confident	85.1	Confident	3 Å²	3	25.8 Å²	25.8	1%	0.012	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	154.6	172.4	68.9	-78.4	0	0	0	110.2	L101 C133 Y138 V160	L101-Y131 HydrophobicContact CD2-CD2 4.08Å; Y131-C133 HydrophobicContact CE2-CB 4.41Å; Y131-Y138 HydrophobicContact CE2-CD2 4.08Å; Y131-Y138 PolarHBondContact N-O 2.97Å; Y131-Y138 PolarHBondContact O-N 3.44Å; Y131-V160 HydrophobicContact CD1-CG1 4.41Å; Y131-V160 HydrophobicContact CD1-CG2 3.99Å; Y131-V160 HydrophobicContact CD2-CG1 4.17Å; Y131-V160 HydrophobicContact CE1-CG1 4.27Å; Y131-V160 HydrophobicContact CE1-CG2 3.93Å; Y131-V160 HydrophobicContact CE2-CG1 3.98Å; Y131-V160 HydrophobicContact CG-CG1 4.37Å
132	M	78.2	Confident	85.3	Confident	48 Å²	48	25.6 Å²	25.6	24%	0.236	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	133.8	175.5	-69.9	-66.5	-70.3	0	0	110.9	H102 I104 Q136 Q137	H102-M132 HydrophobicContact CB-CB 4.14Å; H102-M132 PolarHBondContact O-N 3.2Å; I104-M132 HydrophobicContact CD1-CG 3.43Å; I104-M132 VanDerWaalsContact CD1-CG 3.43Å; I104-M132 HydrophobicContact CD1-SD 3.45Å; I104-M132 WeakPolarHBondContact CD1-SD 3.46Å; I104-M132 HydrophobicContact CG1-CG 3.98Å; M132-Q136 WeakPolarHBondContact CA-O 3.24Å; M132-Q137 HydrophobicContact SD-CB 3.83Å
133	C	72.8	Confident	85.3	Confident	5 Å²	5	25.5 Å²	25.5	3%	0.034	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	107.6	168.5	-157.3	0	0	0	0	107.9	Y131 Q135 Q136 Y138 C163	Y131-C133 HydrophobicContact CE2-CB 4.41Å; C133-Q135 PolarHBondContact O-N 3.28Å; C133-Q135 VanDerWaalsContact O-N 3.09Å; C133-Q136 PolarHBondContact N-O 2.9Å; C133-Q136 PolarHBondContact O-N 3Å; C133-Y138 HydrophobicContact CB-CD2 3.7Å; C133-Y138 HydrophobicContact CB-CE2 3.48Å; C133-Y138 VanDerWaalsContact CB-CE2 3.48Å; C133-C163 WeakPolarHBondContact CA-SG 3.14Å; C133-C163 HydrophobicContact CB-CB 4.24Å; C133-C163 WeakPolarHBondContact CB-SG 3.44Å; C133-C163 WeakPolarHBondContact SG-CB 3.45Å; C133-C163 CovalentContact SG-SG 2.02Å; C133-C163 PolarHBondContact SG-SG 2.73Å
134	G	67.8	Low	85.3	Confident	45 Å²	45	25 Å²	25	46%	0.464	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	-112.4	-170.7	0	0	0	0	0	111.8
135	Q	63.4	Low	85.1	Confident	126 Å²	126	26 Å²	26	59%	0.589	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.9	1.1	174.2	-68.3	-65.4	-71.7	0	0	113.4	C133	C133-Q135 PolarHBondContact O-N 3.28Å; C133-Q135 VanDerWaalsContact O-N 3.09Å
136	Q	69.3	Low	85	Confident	50 Å²	50	26 Å²	26	23%	0.234	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	141.7	179.3	-60.6	-158.5	8.2	0	0	111.2	M132 C133 Y138 R356	M132-Q136 WeakPolarHBondContact CA-O 3.24Å; C133-Q136 PolarHBondContact N-O 2.9Å; C133-Q136 PolarHBondContact O-N 3Å; Q136-Y138 HydrophobicContact CB-CE1 4.37Å; Q136-Y138 HydrophobicContact CB-CE2 4.14Å; Q136-Y138 PolarHBondContact OE1-OH 2.71Å; Q136-R356 PolarHBondContact NE2-O 2.66Å
137	Q	79.1	Confident	84.8	Confident	110 Å²	110	26.4 Å²	26.4	51%	0.514	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	126.1	173.5	176.1	175.4	-3.2	0	0	109.1	I104 M132	I104-Q137 HydrophobicContact CD1-CB 4.32Å; I104-Q137 HydrophobicContact CD1-CG 3.77Å; M132-Q137 HydrophobicContact SD-CB 3.83Å
138	Y	83.7	Confident	84.6	Confident	8 Å²	8	29.1 Å²	29.1	3%	0.031	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	158.6	174.9	-62.7	-58.6	0	0	0	111.2	G130 Y131 C133 Q136 A363 F372 E375 M376	G130-Y138 CarbonylContact C-O 3.44Å; G130-Y138 WeakPolarHBondContact CA-O 3.14Å; Y131-Y138 HydrophobicContact CE2-CD2 4.08Å; Y131-Y138 PolarHBondContact N-O 2.97Å; Y131-Y138 PolarHBondContact O-N 3.44Å; C133-Y138 HydrophobicContact CB-CD2 3.7Å; C133-Y138 HydrophobicContact CB-CE2 3.48Å; C133-Y138 VanDerWaalsContact CB-CE2 3.48Å; Q136-Y138 HydrophobicContact CB-CE1 4.37Å; Q136-Y138 HydrophobicContact CB-CE2 4.14Å; Q136-Y138 PolarHBondContact OE1-OH 2.71Å; Y138-A363 HydrophobicContact CD2-CB 4.5Å; Y138-A363 HydrophobicContact CE2-CB 3.4Å; Y138-A363 VanDerWaalsContact CE2-CB 3.4Å; Y138-A363 VanDerWaalsContact OH-CB 3.22Å; Y138-A363 WeakPolarHBondContact OH-CB 3.45Å; Y138-F372 HydrophobicContact CE1-CD1 4.47Å; Y138-F372 HydrophobicContact CE1-CE1 4.13Å; Y138-E375 HydrophobicContact CD1-CB 3.92Å; Y138-E375 HydrophobicContact CD2-CB 4.44Å; Y138-E375 HydrophobicContact CE1-CB 4.38Å; Y138-E375 HydrophobicContact CG-CB 3.98Å; Y138-M376 HydrophobicContact CD1-CG 4.44Å; Y138-M376 HydrophobicContact CD1-SD 4Å
139	I	88.3	Confident	84.5	Confident	44 Å²	44	28.1 Å²	28.1	23%	0.226	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	95.1	-177.3	-55.5	178.8	0	0	0	109	Y129 E375 M376 Q378	Y129-I139 WeakPolarHBondContact O-CA 3.49Å; I139-E375 CarbonylContact C-O 3.57Å; I139-E375 PolarHBondContact N-O 2.84Å; I139-M376 HydrophobicContact CB-CE 4.14Å; I139-M376 HydrophobicContact CB-SD 4.23Å; I139-M376 HydrophobicContact CD1-CE 4.23Å; I139-M376 HydrophobicContact CG1-CE 4.16Å; I139-M376 HydrophobicContact CG1-SD 4.46Å; I139-M376 PolarHBondContact N-SD 3Å; I139-M376 VanDerWaalsContact N-SD 3.36Å; I139-M376 CarbonylContact O-C 3.57Å; I139-M376 VanDerWaalsContact O-CA 3.22Å; I139-M376 WeakPolarHBondContact O-CA 3.45Å; I139-Q378 HydrophobicContact CG2-CG 4.11Å; I139-Q378 PolarHBondContact O-N 3.46Å
140	S	87.8	Confident	84.5	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.163	C	C	.	.			trans	-91	-27.6	-179.1	61.1	0	0	0	0	113.7	Y129 V160 S377 Q378 A379	Y129-S140 PolarHBondContact O-N 2.84Å; Y129-S140 VanDerWaalsContact O-N 3.1Å; S140-V160 WeakPolarHBondContact OG-CG2 2.87Å; S140-S377 PolarHBondContact O-OG 3.34Å; S140-Q378 CarbonylContact O-C 3.3Å; S140-Q378 VanDerWaalsContact O-CA 3.31Å; S140-Q378 WeakPolarHBondContact O-CA 3.09Å; S140-Q378 PolarHBondContact O-N 3.3Å; S140-A379 PolarHBondContact O-N 3.29Å
141	G	91.5	Very high	84.5	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.192	C	C	.	.			trans	80.4	156.7	-163.2	0	0	0	0	0	113.4	G126 Y129	G126-G141 WeakPolarHBondContact O-CA 3.09Å; Y129-G141 PolarHBondContact O-N 2.86Å
142	V	92.4	Very high	84.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	142.1	177	70.6	0	0	0	0	110.2	T96 V98 M110 C125 G126 Y129 A157	T96-V142 HydrophobicContact CG2-CG1 4.07Å; T96-V142 HydrophobicContact CG2-CG2 3.81Å; V98-V142 HydrophobicContact CG2-CG2 4.21Å; M110-V142 HydrophobicContact CE-CG1 4.06Å; C125-V142 CarbonylContact C-O 3.55Å; C125-V142 VanDerWaalsContact CA-O 3.29Å; C125-V142 WeakPolarHBondContact CA-O 3.31Å; G126-V142 PolarHBondContact N-O 2.85Å; G126-V142 PolarHBondContact O-N 2.82Å; G126-V142 VanDerWaalsContact O-N 3.08Å; Y129-V142 HydrophobicContact CD1-CB 3.94Å; Y129-V142 HydrophobicContact CD1-CG1 4.37Å; Y129-V142 HydrophobicContact CD2-CB 4.16Å; Y129-V142 HydrophobicContact CD2-CG1 3.76Å; Y129-V142 HydrophobicContact CG-CB 3.72Å; Y129-V142 HydrophobicContact CG-CG1 3.64Å; V142-A157 HydrophobicContact CG2-CB 4.4Å
143	C	92.4	Very high	85	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	138.4	172.3	-68	0	0	0	0	110.1	M123 C125 S155 I156	M123-C143 HydrophobicContact CG-CB 4.08Å; M123-C143 HydrophobicContact SD-CB 3.64Å; C125-C143 HydrophobicContact CB-CB 4.1Å; C125-C143 WeakPolarHBondContact CB-SG 3.39Å; C125-C143 WeakPolarHBondContact SG-CB 2.95Å; C125-C143 CovalentContact SG-SG 2.05Å; C125-C143 PolarHBondContact SG-SG 2.96Å; C143-S155 CarbonylContact O-C 3.59Å; C143-S155 WeakPolarHBondContact O-CA 3.05Å; C143-I156 PolarHBondContact N-O 2.95Å; C143-I156 PolarHBondContact O-N 3.04Å
144	T	91.7	Very high	85.6	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	124.8	-179.1	-60.1	0	0	0	0	109.8	T96 M123 A124 V146 I152 N154 S155	T96-T144 VanDerWaalsContact CG2-OG1 3.27Å; T96-T144 WeakPolarHBondContact CG2-OG1 3.24Å; T96-T144 PolarHBondContact OG1-OG1 2.92Å; M123-T144 WeakPolarHBondContact CA-O 3.1Å; M123-T144 WeakPolarHBondContact CG-O 3.23Å; A124-T144 PolarHBondContact N-O 2.76Å; A124-T144 PolarHBondContact O-N 2.93Å; T144-V146 HydrophobicContact CG2-CG2 4.33Å; T144-I152 HydrophobicContact CG2-CB 4.13Å; T144-I152 HydrophobicContact CG2-CD1 3.95Å; T144-I152 HydrophobicContact CG2-CG1 3.79Å; T144-I152 HydrophobicContact CG2-CG2 3.42Å; T144-I152 VanDerWaalsContact CG2-CG2 3.42Å; T144-N154 WeakPolarHBondContact CA-O 3.44Å; T144-S155 PolarHBondContact OG1-OG 3.2Å
145	N	90.4	Very high	86.6	Confident	21 Å²	21	43 Å²	43	11%	0.112	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	127	174.6	-166.1	18.1	0	0	0	109.6	N117 M123 L153 N154	N117-N145 PolarHBondContact ND2-ND2 3.5Å; N117-N145 PolarHBondContact ND2-OD1 2.76Å; M123-N145 HydrophobicContact CE-CB 4.23Å; N145-L153 HydrophobicContact CB-CB 4.49Å; N145-L153 PolarHBondContact O-N 3.24Å; N145-N154 WeakPolarHBondContact CB-OD1 3.06Å; N145-N154 PolarHBondContact N-O 2.78Å
146	V	91.5	Very high	87.7	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	127.1	-175.5	-173.9	0	0	0	0	109	L92 G121 F122 T144	L92-V146 HydrophobicContact CD1-CG2 4.38Å; L92-V146 HydrophobicContact CD2-CG2 4.02Å; G121-V146 CarbonylContact C-O 3.58Å; G121-V146 VanDerWaalsContact CA-O 3.28Å; G121-V146 WeakPolarHBondContact CA-O 3.45Å; F122-V146 HydrophobicContact CD1-CB 4.17Å; F122-V146 HydrophobicContact CD1-CG1 4.33Å; F122-V146 HydrophobicContact CD2-CB 4.38Å; F122-V146 HydrophobicContact CE1-CB 3.82Å; F122-V146 HydrophobicContact CE1-CG1 3.6Å; F122-V146 HydrophobicContact CE2-CB 4.05Å; F122-V146 HydrophobicContact CE2-CG1 4.43Å; F122-V146 HydrophobicContact CE2-CG2 3.97Å; F122-V146 HydrophobicContact CG-CB 4.43Å; F122-V146 HydrophobicContact CZ-CB 3.75Å; F122-V146 HydrophobicContact CZ-CG1 3.66Å; F122-V146 HydrophobicContact CZ-CG2 3.98Å; F122-V146 PolarHBondContact N-O 2.63Å; F122-V146 WeakPolarHBondContact O-CA 3.4Å; F122-V146 WeakPolarHBondContact O-CB 3.49Å; F122-V146 PolarHBondContact O-N 2.76Å; T144-V146 HydrophobicContact CG2-CG2 4.33Å
147	S	90.7	Very high	88.6	Confident	9 Å²	9	36.8 Å²	36.8	6%	0.063	20%	0.198	C	C	.	.			trans	-67.7	165.2	178.2	60.9	0	0	0	0	112.9	S149 F150 Q151	S147-S149 PolarHBondContact O-N 2.94Å; S147-S149 VanDerWaalsContact O-N 3.08Å; S147-S149 PolarHBondContact OG-OG 3.28Å; S147-F150 PolarHBondContact O-N 2.8Å; S147-Q151 WeakPolarHBondContact CB-O 3.25Å; S147-Q151 PolarHBondContact N-O 3.45Å; S147-Q151 WeakPolarHBondContact OG-CA 3.2Å; S147-Q151 WeakPolarHBondContact OG-CB 3.37Å; S147-Q151 PolarHBondContact OG-N 3.32Å; S147-Q151 PolarHBondContact OG-O 3.05Å
148	P	90	Very high	88.3	Confident	60 Å²	60	32.8 Å²	32.8	39%	0.39	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-22.1	174.3	-25.2	32.7	0	0	0	115.7	F50 N52 F150	F50-P148 HydrophobicContact CZ-CB 4.48Å; N52-P148 HydrophobicContact CB-CB 4.44Å; N52-P148 PolarHBondContact ND2-O 3.01Å; P148-F150 VanDerWaalsContact C-N 3.32Å
149	S	88.8	Confident	87.7	Confident	60 Å²	60	32.4 Å²	32.4	42%	0.42	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	15.8	175.6	54.1	0	0	0	0	113.4	S147 Q151	S147-S149 PolarHBondContact O-N 2.94Å; S147-S149 VanDerWaalsContact O-N 3.08Å; S147-S149 PolarHBondContact OG-OG 3.28Å; S149-Q151 PolarHBondContact O-N 2.79Å
150	F	90.1	Very high	87.1	Confident	23 Å²	23	31.7 Å²	31.7	10%	0.101	18%	0.178	C	C	.	.	S	Bend	trans	64.3	20.5	-180	-50.3	-75.1	0	0	0	115	F50 N52 W57 L59 K77 L90 F122 S147 P148	F50-F150 HydrophobicContact CD1-CE1 4.09Å; F50-F150 HydrophobicContact CD1-CZ 4.13Å; F50-F150 AromaticContact CE1-CE1 3.99Å; F50-F150 HydrophobicContact CE1-CE1 3.99Å; F50-F150 HydrophobicContact CE1-CZ 4.01Å; N52-F150 VanDerWaalsContact ND2-CE2 3.31Å; N52-F150 WeakPolarHBondContact ND2-CE2 3.09Å; W57-F150 HydrophobicContact CD2-CZ 4.27Å; W57-F150 HydrophobicContact CG-CZ 4.18Å; L59-F150 HydrophobicContact CD2-CE1 4.05Å; K77-F150 HydrophobicContact CB-CE1 4.33Å; K77-F150 HydrophobicContact CB-CZ 4.49Å; K77-F150 HydrophobicContact CD-CD1 4.21Å; K77-F150 HydrophobicContact CD-CD2 3.97Å; K77-F150 HydrophobicContact CD-CE1 4.03Å; K77-F150 HydrophobicContact CD-CE2 3.73Å; K77-F150 HydrophobicContact CD-CG 4.19Å; K77-F150 HydrophobicContact CD-CZ 3.77Å; L90-F150 HydrophobicContact CD1-CD1 4.2Å; L90-F150 HydrophobicContact CD2-CB 4.03Å; L90-F150 HydrophobicContact CD2-CD1 4.08Å; L90-F150 HydrophobicContact CD2-CG 4.16Å; F122-F150 AromaticContact CE1-CD1 3.91Å; F122-F150 HydrophobicContact CE1-CD1 3.91Å; F122-F150 HydrophobicContact CE1-CE1 4.2Å; F122-F150 HydrophobicContact CZ-CD1 4.49Å; S147-F150 PolarHBondContact O-N 2.8Å; P148-F150 VanDerWaalsContact C-N 3.32Å
151	Q	89.6	Confident	86.1	Confident	132 Å²	132	35.3 Å²	35.3	62%	0.617	20%	0.196	S	C	*	.			trans	-94	139.4	173.9	-60.8	-178.4	-13.4	0	0	111.1	S147 S149 L153	S147-Q151 WeakPolarHBondContact CB-O 3.25Å; S147-Q151 PolarHBondContact N-O 3.45Å; S147-Q151 WeakPolarHBondContact OG-CA 3.2Å; S147-Q151 WeakPolarHBondContact OG-CB 3.37Å; S147-Q151 PolarHBondContact OG-N 3.32Å; S147-Q151 PolarHBondContact OG-O 3.05Å; S149-Q151 PolarHBondContact O-N 2.79Å; Q151-L153 PolarHBondContact O-N 2.95Å
152	I	86.9	Confident	84.6	Confident	47 Å²	47	41.1 Å²	41.1	24%	0.241	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	125.9	175.7	-63.4	177.3	0	0	0	109.7	L92 N95 T144	L92-I152 HydrophobicContact CD2-CD1 4.25Å; L92-I152 HydrophobicContact CD2-CG1 4.1Å; N95-I152 HydrophobicContact CB-CD1 3.45Å; N95-I152 VanDerWaalsContact CB-CD1 3.45Å; T144-I152 HydrophobicContact CG2-CB 4.13Å; T144-I152 HydrophobicContact CG2-CD1 3.95Å; T144-I152 HydrophobicContact CG2-CG1 3.79Å; T144-I152 HydrophobicContact CG2-CG2 3.42Å; T144-I152 VanDerWaalsContact CG2-CG2 3.42Å
153	L	86.1	Confident	83.2	Confident	106 Å²	106	43.2 Å²	43.2	56%	0.555	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91	-51.7	177.7	-64.2	176.2	0	0	0	111.2	N145 Q151	N145-L153 HydrophobicContact CB-CB 4.49Å; N145-L153 PolarHBondContact O-N 3.24Å; Q151-L153 PolarHBondContact O-N 2.95Å
154	N	86.6	Confident	81.4	Confident	78 Å²	78	47.6 Å²	47.6	42%	0.417	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	164.9	177.6	63.2	9.9	0	0	0	111.2	T144 N145	T144-N154 WeakPolarHBondContact CA-O 3.44Å; N145-N154 WeakPolarHBondContact CB-OD1 3.06Å; N145-N154 PolarHBondContact N-O 2.78Å
155	S	88.8	Confident	79.8	Confident	28 Å²	28	50.6 Å²	50.6	20%	0.196	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	136.3	174.3	-59.9	0	0	0	0	109.3	C143 T144	C143-S155 CarbonylContact O-C 3.59Å; C143-S155 WeakPolarHBondContact O-CA 3.05Å; T144-S155 PolarHBondContact OG1-OG 3.2Å
156	I	86.6	Confident	79.1	Confident	30 Å²	30	51.3 Å²	51.3	15%	0.154	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	131	-174.1	-58.1	140.3	0	0	0	107.9	M123 C143 P158 Q407	M123-I156 HydrophobicContact CE-CD1 4.46Å; C143-I156 PolarHBondContact N-O 2.95Å; C143-I156 PolarHBondContact O-N 3.04Å; I156-P158 HydrophobicContact CG2-CG 3.97Å; I156-Q407 VanDerWaalsContact CD1-NE2 3.26Å
157	A	86.9	Confident	78.6	Confident	16 Å²	16	51.4 Å²	51.4	13%	0.132	29%	0.293	C	S	.	.			trans	-128.9	84.4	175.3	0	0	0	0	0	108.9	V98 V142 G159 V160	V98-A157 HydrophobicContact CG1-CB 4.45Å; V98-A157 HydrophobicContact CG2-CB 3.95Å; V142-A157 HydrophobicContact CG2-CB 4.4Å; A157-G159 PolarHBondContact O-N 3.29Å; A157-G159 VanDerWaalsContact O-N 3.16Å; A157-V160 HydrophobicContact CB-CB 4.37Å; A157-V160 HydrophobicContact CB-CG2 3.6Å; A157-V160 PolarHBondContact O-N 3.12Å
158	P	74.6	Confident	78.6	Confident	26 Å²	26	51 Å²	51	17%	0.169	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-24	-167.4	-20.9	30.6	0	0	0	115	I156 A379 L392 V405	I156-P158 HydrophobicContact CG2-CG 3.97Å; P158-A379 HydrophobicContact CB-CB 4.37Å; P158-A379 HydrophobicContact CG-CB 4.11Å; P158-L392 HydrophobicContact CG-CD1 4.02Å; P158-V405 HydrophobicContact CB-CB 4.47Å; P158-V405 HydrophobicContact CB-CG1 3.79Å; P158-V405 HydrophobicContact CB-CG2 4.18Å; P158-V405 HydrophobicContact CG-CG1 4.08Å
159	G	70.5	Confident	78.7	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.01	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-0.9	-178.7	0	0	0	0	0	115.3	A157 S377	A157-G159 PolarHBondContact O-N 3.29Å; A157-G159 VanDerWaalsContact O-N 3.16Å; G159-S377 WeakPolarHBondContact CA-OG 3.5Å
160	V	75.9	Confident	78.9	Confident	28 Å²	28	45.3 Å²	45.3	17%	0.17	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-89.3	120.1	-176	-173.4	0	0	0	0	110.8	L101 Y131 S140 A157	L101-V160 HydrophobicContact CD1-CB 4.27Å; L101-V160 HydrophobicContact CD1-CG1 3.39Å; L101-V160 HydrophobicContact CD2-CG1 3.52Å; L101-V160 HydrophobicContact CG-CG1 4.07Å; Y131-V160 HydrophobicContact CD1-CG1 4.41Å; Y131-V160 HydrophobicContact CD1-CG2 3.99Å; Y131-V160 HydrophobicContact CD2-CG1 4.17Å; Y131-V160 HydrophobicContact CE1-CG1 4.27Å; Y131-V160 HydrophobicContact CE1-CG2 3.93Å; Y131-V160 HydrophobicContact CE2-CG1 3.98Å; Y131-V160 HydrophobicContact CG-CG1 4.37Å; S140-V160 WeakPolarHBondContact OG-CG2 2.87Å; A157-V160 HydrophobicContact CB-CB 4.37Å; A157-V160 HydrophobicContact CB-CG2 3.6Å; A157-V160 PolarHBondContact O-N 3.12Å
161	Q	65.7	Low	79.1	Confident	77 Å²	77	44.2 Å²	44.2	36%	0.36	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-99.4	149.3	168.4	-65.1	-171.8	2	0	0	110.4	C163	Q161-C163 PolarHBondContact O-N 2.81Å
162	N	61.4	Low	79.4	Confident	121 Å²	121	37.9 Å²	37.9	65%	0.647	22%	0.217	S	C	*	.	P	Polyproline II helix	trans	-68	116.6	172.7	-78.5	-17.7	0	0	0	109.4	T164	N162-T164 PolarHBondContact O-N 2.93Å; N162-T164 VanDerWaalsContact O-N 3.13Å
163	C	61.1	Low	79.7	Confident	45 Å²	45	35.7 Å²	35.7	30%	0.304	21%	0.206	S	C	.	.			trans	-60.7	111.1	175.1	-62.9	0	0	0	0	111.3	C133 Q161 S165	C133-C163 WeakPolarHBondContact CA-SG 3.14Å; C133-C163 HydrophobicContact CB-CB 4.24Å; C133-C163 WeakPolarHBondContact CB-SG 3.44Å; C133-C163 WeakPolarHBondContact SG-CB 3.45Å; C133-C163 CovalentContact SG-SG 2.02Å; C133-C163 PolarHBondContact SG-SG 2.73Å; Q161-C163 PolarHBondContact O-N 2.81Å; C163-S165 PolarHBondContact O-N 3.45Å
164	T	56.2	Low	79.9	Confident	92 Å²	92	30.7 Å²	30.7	56%	0.564	18%	0.179	S	C	*	.			trans	-79.9	110	170.4	40.3	0	0	0	0	109.7	N162	N162-T164 PolarHBondContact O-N 2.93Å; N162-T164 VanDerWaalsContact O-N 3.13Å
165	S	57	Low	80	Confident	62 Å²	62	27 Å²	27	43%	0.434	16%	0.16	S	C	.	.			trans	-91.6	9.8	-167.7	61.4	0	0	0	0	116	C163 K201 Q202	C163-S165 PolarHBondContact O-N 3.45Å; S165-K201 PolarHBondContact OG-O 2.66Å; S165-Q202 CarbonylContact O-C 3.58Å; S165-Q202 WeakPolarHBondContact O-CA 3.31Å
166	N	75.2	Confident	79.9	Confident	36 Å²	36	25.7 Å²	25.7	19%	0.193	15%	0.151	C	C	.	.			trans	-106.4	112.3	-173.5	-67.5	-9	0	0	0	111.3	K201 D267 A268 K269	N166-K201 PolarHBondContact OD1-O 2.83Å; N166-D267 PolarHBondContact ND2-OD2 3.15Å; N166-A268 HydrophobicContact CB-CB 3.92Å; N166-A268 VanDerWaalsContact O-CA 3.26Å; N166-A268 WeakPolarHBondContact O-CA 3.38Å; N166-A268 WeakPolarHBondContact O-CB 3.27Å; N166-K269 PolarHBondContact O-N 2.76Å
167	M	82.9	Confident	79.9	Confident	3 Å²	3	28.6 Å²	28.6	2%	0.015	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	139.3	176	-82.7	-149.3	-115.1	0	0	113.1	A203 Q204 R265 K269 V271 I358 L361 E362	M167-A203 CarbonylContact O-C 3.52Å; M167-A203 VanDerWaalsContact O-CA 3.25Å; M167-A203 WeakPolarHBondContact O-CA 3.43Å; M167-Q204 PolarHBondContact O-N 3.45Å; M167-R265 VanDerWaalsContact C-NH2 3.34Å; M167-R265 PolarHBondContact O-NH2 2.71Å; M167-K269 WeakPolarHBondContact CA-O 3.27Å; M167-K269 HydrophobicContact CG-CB 4.22Å; M167-V271 HydrophobicContact SD-CG2 4.11Å; M167-I358 WeakPolarHBondContact CE-O 3.43Å; M167-I358 HydrophobicContact SD-CG2 4.23Å; M167-L361 HydrophobicContact CE-CB 4.45Å; M167-E362 HydrophobicContact CE-CB 4.14Å; M167-E362 HydrophobicContact CE-CG 2.94Å; M167-E362 WeakPolarHBondContact CE-OE1 3.45Å
168	D	89.8	Confident	79.6	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	110.9	173.8	-67.4	-7.1	0	0	0	108.9	L220 F258 A264 R265 K269 V271	D168-L220 HydrophobicContact CB-CD1 4.08Å; D168-L220 HydrophobicContact CB-CD2 4.22Å; D168-F258 HydrophobicContact CB-CE1 4.31Å; D168-A264 WeakPolarHBondContact OD2-CA 3.42Å; D168-R265 IonicContact OD1-CZ 3.51Å; D168-R265 VanDerWaalsContact OD1-CZ 3.28Å; D168-R265 IonicContact OD1-NE 2.89Å; D168-R265 PolarHBondContact OD1-NE 2.8Å; D168-R265 IonicContact OD1-NH2 3.58Å; D168-R265 PolarHBondContact OD1-NH2 3.44Å; D168-R265 PolarHBondContact OD2-N 3.41Å; D168-K269 PolarHBondContact N-O 2.91Å; D168-V271 PolarHBondContact O-N 3.13Å
169	I	91.3	Very high	80.1	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	120	-174.2	-53.8	172.7	0	0	0	109.1	F171 A203 Q204 V205 G206 V271 V273 I358	I169-F171 HydrophobicContact CG2-CD2 4.32Å; I169-F171 HydrophobicContact CG2-CE2 3.83Å; I169-F171 HydrophobicContact CG2-CZ 4.3Å; I169-A203 HydrophobicContact CD1-CB 4.49Å; I169-Q204 PolarHBondContact N-O 2.85Å; I169-V205 CarbonylContact O-C 3.55Å; I169-V205 VanDerWaalsContact O-CA 3.27Å; I169-V205 WeakPolarHBondContact O-CA 3.33Å; I169-G206 PolarHBondContact O-N 2.86Å; I169-V271 CarbonylContact C-O 3.56Å; I169-V271 WeakPolarHBondContact CA-O 3.15Å; I169-V271 HydrophobicContact CG1-CB 4.33Å; I169-V273 HydrophobicContact CG2-CG2 4.38Å; I169-I358 HydrophobicContact CD1-CG2 4.03Å
170	V	94.3	Very high	80.6	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	120.2	176.4	179.3	0	0	0	0	110.3	V172 G206 V208 L220 A253 A257 F258 V271 M272 V273	V170-V172 HydrophobicContact CG1-CG2 4.41Å; V170-G206 WeakPolarHBondContact CA-O 3.34Å; V170-V208 HydrophobicContact CG1-CG2 4.1Å; V170-L220 HydrophobicContact CG2-CD1 4.15Å; V170-L220 HydrophobicContact CG2-CD2 4.14Å; V170-L220 HydrophobicContact CG2-CG 4.32Å; V170-A253 HydrophobicContact CG1-CB 4.42Å; V170-A257 HydrophobicContact CG1-CB 3.94Å; V170-A257 HydrophobicContact CG2-CB 4.14Å; V170-F258 HydrophobicContact CB-CE1 4.35Å; V170-F258 HydrophobicContact CB-CE2 3.91Å; V170-F258 HydrophobicContact CB-CZ 3.67Å; V170-F258 HydrophobicContact CG2-CD1 4.19Å; V170-F258 HydrophobicContact CG2-CD2 4.35Å; V170-F258 HydrophobicContact CG2-CE1 3.64Å; V170-F258 HydrophobicContact CG2-CE2 3.83Å; V170-F258 HydrophobicContact CG2-CZ 3.45Å; V170-F258 VanDerWaalsContact CG2-CZ 3.45Å; V170-V271 PolarHBondContact N-O 2.72Å; V170-M272 CarbonylContact O-C 3.42Å; V170-M272 WeakPolarHBondContact O-CA 3.19Å; V170-V273 PolarHBondContact O-N 3.13Å
171	F	94.7	Very high	81.2	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	127.8	172	-72.9	-88	0	0	0	110.5	I169 L173 F188 L189 F192 V205 G206 I207 V208 V273	I169-F171 HydrophobicContact CG2-CD2 4.32Å; I169-F171 HydrophobicContact CG2-CE2 3.83Å; I169-F171 HydrophobicContact CG2-CZ 4.3Å; F171-L173 HydrophobicContact CB-CD1 4.48Å; F171-L173 HydrophobicContact CB-CD2 4.17Å; F171-L173 HydrophobicContact CB-CG 4.17Å; F171-L173 HydrophobicContact CD1-CD2 4.42Å; F171-F188 HydrophobicContact CD1-CE1 4.47Å; F171-F188 HydrophobicContact CE1-CE1 4.06Å; F171-F188 HydrophobicContact CE1-CZ 4.4Å; F171-L189 HydrophobicContact CB-CD2 4.3Å; F171-L189 HydrophobicContact CD1-CD2 3.65Å; F171-L189 HydrophobicContact CD2-CD2 4.13Å; F171-L189 HydrophobicContact CE1-CD2 3.95Å; F171-L189 HydrophobicContact CE2-CD2 4.4Å; F171-L189 HydrophobicContact CG-CD2 3.75Å; F171-L189 HydrophobicContact CZ-CD2 4.32Å; F171-F192 HydrophobicContact CE2-CD1 4.08Å; F171-F192 AromaticContact CE2-CE1 3.97Å; F171-F192 HydrophobicContact CE2-CE1 3.97Å; F171-F192 AromaticContact CZ-CD1 3.52Å; F171-F192 HydrophobicContact CZ-CD1 3.52Å; F171-F192 AromaticContact CZ-CE1 3.52Å; F171-F192 HydrophobicContact CZ-CE1 3.52Å; F171-F192 HydrophobicContact CZ-CG 4.07Å; F171-F192 HydrophobicContact CZ-CZ 4.07Å; F171-V205 HydrophobicContact CD2-CG1 3.99Å; F171-V205 HydrophobicContact CE2-CG1 4.08Å; F171-G206 PolarHBondContact N-O 2.77Å; F171-I207 HydrophobicContact CB-CG1 4.47Å; F171-V208 PolarHBondContact O-N 3.29Å; F171-V208 VanDerWaalsContact O-O 3.13Å; F171-V273 HydrophobicContact CD1-CB 3.69Å; F171-V273 HydrophobicContact CD1-CG1 3.84Å; F171-V273 HydrophobicContact CD1-CG2 4.33Å; F171-V273 HydrophobicContact CE1-CB 3.8Å; F171-V273 HydrophobicContact CE1-CG1 3.77Å; F171-V273 HydrophobicContact CE1-CG2 4.02Å; F171-V273 HydrophobicContact CG-CB 4.43Å; F171-V273 HydrophobicContact CZ-CG2 4.41Å
172	V	94.6	Very high	82.3	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	103.3	175	-175.7	0	0	0	0	107.6	V170 V208 Y210 A249 A253 M272 V273 I274 L275	V170-V172 HydrophobicContact CG1-CG2 4.41Å; V172-V208 WeakPolarHBondContact CA-O 3.28Å; V172-Y210 HydrophobicContact CG1-CD1 3.82Å; V172-Y210 HydrophobicContact CG1-CE1 3.86Å; V172-A249 HydrophobicContact CG1-CB 3.79Å; V172-A253 HydrophobicContact CG2-CB 3.7Å; V172-M272 HydrophobicContact CG2-CG 3.77Å; V172-M272 HydrophobicContact CG2-SD 4Å; V172-V273 PolarHBondContact N-O 2.84Å; V172-I274 HydrophobicContact CB-CG1 4.38Å; V172-I274 WeakPolarHBondContact O-CA 3.27Å; V172-L275 PolarHBondContact O-N 2.82Å
173	L	93.9	Very high	83.7	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	124.4	-166.6	-54.9	173.1	0	0	0	111.3	F171 G175 W182 I185 L189 I207 V208 S209 Y210 L275	F171-L173 HydrophobicContact CB-CD1 4.48Å; F171-L173 HydrophobicContact CB-CD2 4.17Å; F171-L173 HydrophobicContact CB-CG 4.17Å; F171-L173 HydrophobicContact CD1-CD2 4.42Å; L173-G175 PolarHBondContact O-N 3.1Å; L173-W182 HydrophobicContact CB-CH2 4.34Å; L173-I185 HydrophobicContact CD1-CG2 4.21Å; L173-I185 HydrophobicContact CD2-CG2 4.21Å; L173-L189 HydrophobicContact CD1-CD1 3.61Å; L173-L189 HydrophobicContact CD1-CD2 4.24Å; L173-L189 HydrophobicContact CD1-CG 4.34Å; L173-L189 HydrophobicContact CD2-CD2 4.45Å; L173-I207 HydrophobicContact CD1-CG2 3.8Å; L173-V208 PolarHBondContact N-O 2.8Å; L173-S209 CarbonylContact O-C 3.11Å; L173-S209 VanDerWaalsContact O-CA 3.22Å; L173-S209 WeakPolarHBondContact O-CA 3.15Å; L173-Y210 VanDerWaalsContact C-CD1 3.49Å; L173-Y210 VanDerWaalsContact C-CE1 3.44Å; L173-Y210 WeakPolarHBondContact O-CD1 3.46Å; L173-Y210 PolarHBondContact O-N 3.29Å; L173-L275 HydrophobicContact CD2-CB 4.07Å
174	D	90.8	Very high	85	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	113.5	171.8	-168.6	-20.3	0	0	0	110.1	S176 I179 W182 Y210 T244 L275 T276	D174-S176 WeakPolarHBondContact OD1-CB 2.93Å; D174-S176 PolarHBondContact OD1-N 3Å; D174-S176 PolarHBondContact OD1-OG 3.09Å; D174-I179 HydrophobicContact CB-CD1 4.5Å; D174-I179 HydrophobicContact CB-CG1 4.31Å; D174-W182 WeakPolarHBondContact O-CZ3 3.26Å; D174-Y210 HydrophobicContact CB-CE1 3.97Å; D174-Y210 HydrophobicContact CB-CE2 4.47Å; D174-Y210 VanDerWaalsContact N-CE1 3.31Å; D174-T244 WeakPolarHBondContact OD2-CG2 3.43Å; D174-L275 WeakPolarHBondContact CB-O 3.29Å; D174-L275 PolarHBondContact N-O 2.82Å; D174-T276 PolarHBondContact OD2-OG1 3.07Å
175	G	88.5	Confident	86.6	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.15	C	C	.	.			trans	-107	15.2	178.6	0	0	0	0	0	113.1	L173 Y210 Q238 L240	L173-G175 PolarHBondContact O-N 3.1Å; G175-Y210 WeakPolarHBondContact CA-O 3.13Å; G175-Y210 PolarHBondContact N-O 2.89Å; G175-Q238 VanDerWaalsContact O-CG 3.3Å; G175-Q238 WeakPolarHBondContact O-CG 3.21Å; G175-L240 WeakPolarHBondContact O-CA 3.09Å; G175-L240 PolarHBondContact O-N 2.04Å
176	S	87	Confident	88.3	Confident	2 Å²	2	27.5 Å²	27.5	1%	0.014	13%	0.133	C	C	.	.	S	Bend	trans	-65.6	168.9	178.3	67.1	0	0	0	0	112.4	D174 S178 I179 Q238 T244	D174-S176 WeakPolarHBondContact OD1-CB 2.93Å; D174-S176 PolarHBondContact OD1-N 3Å; D174-S176 PolarHBondContact OD1-OG 3.09Å; S176-S178 PolarHBondContact O-N 3.4Å; S176-S178 PolarHBondContact OG-OG 3.21Å; S176-I179 PolarHBondContact O-N 2.76Å; S176-Q238 PolarHBondContact O-NE2 2.74Å; S176-T244 PolarHBondContact OG-OG1 2.99Å
177	N	85.4	Confident	89	Confident	90 Å²	90	28.4 Å²	28.4	48%	0.481	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-12.2	-176	-67.5	-12.9	0	0	0	114.1	L240 G241	N177-L240 WeakPolarHBondContact OD1-CA 3.42Å; N177-L240 WeakPolarHBondContact OD1-CD2 3.44Å; N177-G241 WeakPolarHBondContact CB-O 3.39Å; N177-G241 PolarHBondContact N-O 3.36Å; N177-G241 PolarHBondContact ND2-O 2.48Å; N177-G241 PolarHBondContact OD1-N 2.7Å; N177-G241 VanDerWaalsContact OD1-N 3.09Å
178	S	81.9	Confident	89.4	Confident	28 Å²	28	28.2 Å²	28.2	20%	0.196	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-31.5	177.2	44.8	0	0	0	0	112.5	S176 Y180 D277 R311	S176-S178 PolarHBondContact O-N 3.4Å; S176-S178 PolarHBondContact OG-OG 3.21Å; S178-Y180 PolarHBondContact O-N 2.83Å; S178-D277 VanDerWaalsContact CB-OD2 3.27Å; S178-D277 WeakPolarHBondContact CB-OD2 3.33Å; S178-D277 VanDerWaalsContact O-OD2 3.08Å; S178-D277 PolarHBondContact OG-OD1 2.84Å; S178-D277 PolarHBondContact OG-OD2 2.66Å; S178-R311 PolarHBondContact O-NH2 2.99Å
179	I	84.4	Confident	89.4	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.005	14%	0.137	C	C	.	.			trans	-71.9	108	177.5	-62.6	-81.1	0	0	0	109.4	D174 S176 W182 I185 Q238 L275 D277	D174-I179 HydrophobicContact CB-CD1 4.5Å; D174-I179 HydrophobicContact CB-CG1 4.31Å; S176-I179 PolarHBondContact O-N 2.76Å; I179-W182 HydrophobicContact CG2-CE3 3.96Å; I179-W182 HydrophobicContact CG2-CZ3 4.45Å; I179-I185 HydrophobicContact CG2-CD1 4.36Å; I179-I185 HydrophobicContact CG2-CG1 3.88Å; I179-Q238 PolarHBondContact O-NE2 3.14Å; I179-L275 HydrophobicContact CD1-CD2 4.49Å; I179-D277 WeakPolarHBondContact CA-OD2 2.84Å; I179-D277 HydrophobicContact CD1-CB 3.39Å; I179-D277 HydrophobicContact CG1-CB 4.29Å; I179-D277 PolarHBondContact N-OD2 2.79Å; I179-D277 VanDerWaalsContact N-OD2 3.14Å
180	Y	81.1	Confident	89.4	Confident	161 Å²	161	29.3 Å²	29.3	63%	0.631	14%	0.142	S	C	*	.			trans	-149.3	128.9	176.5	-177	-93.7	0	0	0	111.3	S178 R311	S178-Y180 PolarHBondContact O-N 2.83Å; Y180-R311 PolarHBondContact O-NH1 2.89Å; Y180-R311 PolarHBondContact O-NH2 2.6Å
181	P	88.2	Confident	89.1	Confident	51 Å²	51	32.6 Å²	32.6	33%	0.331	16%	0.155	S	C	.	.			cis	-84	137.3	-1.2	-13.7	31.2	0	0	0	114.5	K183 N184	P181-K183 PolarHBondContact O-N 2.85Å; P181-K183 VanDerWaalsContact O-N 3.12Å; P181-N184 PolarHBondContact O-N 3.27Å
182	W	89.4	Confident	88.8	Confident	26 Å²	26	32.7 Å²	32.7	10%	0.098	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-30.4	176.8	179.4	-113.3	0	0	0	114.5	L173 D174 I179 N184 I185 V186 I236 Q238	L173-W182 HydrophobicContact CB-CH2 4.34Å; D174-W182 WeakPolarHBondContact O-CZ3 3.26Å; I179-W182 HydrophobicContact CG2-CE3 3.96Å; I179-W182 HydrophobicContact CG2-CZ3 4.45Å; W182-N184 PolarHBondContact O-N 3.13Å; W182-N184 VanDerWaalsContact O-N 3.09Å; W182-I185 HydrophobicContact CD2-CB 4.48Å; W182-I185 HydrophobicContact CE3-CB 4.12Å; W182-I185 HydrophobicContact CE3-CG1 3.89Å; W182-I185 HydrophobicContact CH2-CB 4.48Å; W182-I185 HydrophobicContact CH2-CG2 4.06Å; W182-I185 HydrophobicContact CZ3-CB 4.1Å; W182-I185 HydrophobicContact CZ3-CG1 3.96Å; W182-I185 HydrophobicContact CZ3-CG2 4.02Å; W182-I185 WeakPolarHBondContact O-CB 3.37Å; W182-I185 PolarHBondContact O-N 3.22Å; W182-V186 PolarHBondContact O-N 2.8Å; W182-I236 HydrophobicContact CZ2-CG2 4.12Å; W182-I236 PolarHBondContact NE1-O 2.76Å; W182-Q238 HydrophobicContact CB-CB 4.15Å; W182-Q238 HydrophobicContact CB-CG 4.41Å; W182-Q238 HydrophobicContact CD2-CB 3.83Å; W182-Q238 HydrophobicContact CD2-CG 4.03Å; W182-Q238 HydrophobicContact CE3-CB 4.32Å; W182-Q238 HydrophobicContact CE3-CG 4Å; W182-Q238 HydrophobicContact CG-CB 3.73Å; W182-Q238 HydrophobicContact CG-CG 4.22Å
183	K	89.6	Confident	88.5	Confident	142 Å²	142	32.7 Å²	32.7	62%	0.617	16%	0.155	S	C	*	.	H	α-helix	trans	-52.3	-35.7	179.7	-175.9	-179.6	173.6	-173.1	0	112.6	P181 I185 V186 D187	P181-K183 PolarHBondContact O-N 2.85Å; P181-K183 VanDerWaalsContact O-N 3.12Å; K183-I185 VanDerWaalsContact C-N 3.32Å; K183-I185 PolarHBondContact O-N 2.94Å; K183-V186 PolarHBondContact O-N 2.73Å; K183-D187 WeakPolarHBondContact CE-OD2 3.24Å; K183-D187 PolarHBondContact O-N 3.01Å
184	N	88.7	Confident	88	Confident	24 Å²	24	38.6 Å²	38.6	13%	0.128	18%	0.183	C	C	.	.	H	α-helix	trans	-67.9	-31.1	-178.6	-67.5	-16.9	0	0	0	113	P181 W182 F188 E344	P181-N184 PolarHBondContact O-N 3.27Å; W182-N184 PolarHBondContact O-N 3.13Å; W182-N184 VanDerWaalsContact O-N 3.09Å; N184-F188 WeakPolarHBondContact O-CB 3.47Å; N184-F188 PolarHBondContact O-N 3.42Å; N184-E344 HydrophobicContact CB-CB 3.88Å; N184-E344 VanDerWaalsContact CB-O 3.3Å; N184-E344 WeakPolarHBondContact CB-O 3.38Å; N184-E344 WeakPolarHBondContact ND2-CB 3.48Å
185	I	90.1	Very high	87.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-66.6	-43.9	173.1	-55	-51.5	0	0	0	110	L173 I179 W182 K183 F188 L189 L275 L347	L173-I185 HydrophobicContact CD1-CG2 4.21Å; L173-I185 HydrophobicContact CD2-CG2 4.21Å; I179-I185 HydrophobicContact CG2-CD1 4.36Å; I179-I185 HydrophobicContact CG2-CG1 3.88Å; W182-I185 HydrophobicContact CD2-CB 4.48Å; W182-I185 HydrophobicContact CE3-CB 4.12Å; W182-I185 HydrophobicContact CE3-CG1 3.89Å; W182-I185 HydrophobicContact CH2-CB 4.48Å; W182-I185 HydrophobicContact CH2-CG2 4.06Å; W182-I185 HydrophobicContact CZ3-CB 4.1Å; W182-I185 HydrophobicContact CZ3-CG1 3.96Å; W182-I185 HydrophobicContact CZ3-CG2 4.02Å; W182-I185 WeakPolarHBondContact O-CB 3.37Å; W182-I185 PolarHBondContact O-N 3.22Å; K183-I185 VanDerWaalsContact C-N 3.32Å; K183-I185 PolarHBondContact O-N 2.94Å; I185-F188 WeakPolarHBondContact O-CB 3.49Å; I185-F188 PolarHBondContact O-N 3.15Å; I185-L189 WeakPolarHBondContact O-CG 3.14Å; I185-L189 PolarHBondContact O-N 2.99Å; I185-L275 HydrophobicContact CD1-CD1 4Å; I185-L275 HydrophobicContact CD1-CD2 3.55Å; I185-L275 HydrophobicContact CD1-CG 4.46Å; I185-L347 HydrophobicContact CD1-CD1 3.35Å
186	V	91.8	Very high	86.8	Confident	13 Å²	13	44.2 Å²	44.2	8%	0.079	20%	0.204	C	C	.	.	H	α-helix	trans	-63.6	-44	177.1	178.5	0	0	0	0	111	W182 K183 F188 L189 I190 V233	W182-V186 PolarHBondContact O-N 2.8Å; K183-V186 PolarHBondContact O-N 2.73Å; V186-F188 VanDerWaalsContact C-N 3.34Å; V186-F188 PolarHBondContact O-N 3.28Å; V186-L189 PolarHBondContact O-N 3.22Å; V186-I190 HydrophobicContact CG1-CD1 3.89Å; V186-I190 VanDerWaalsContact O-CG1 3.29Å; V186-I190 WeakPolarHBondContact O-CG1 3.4Å; V186-I190 PolarHBondContact O-N 2.89Å; V186-V233 HydrophobicContact CG1-CG1 4.42Å
187	D	90.1	Very high	86.3	Confident	54 Å²	54	48.4 Å²	48.4	29%	0.289	22%	0.224	S	C	.	.	H	α-helix	trans	-64.6	-36.7	177.7	-72.1	-17.3	0	0	0	111.8	K183 I190 R191 V348	K183-D187 WeakPolarHBondContact CE-OD2 3.24Å; K183-D187 PolarHBondContact O-N 3.01Å; D187-I190 PolarHBondContact O-N 2.97Å; D187-R191 WeakPolarHBondContact O-CB 3.28Å; D187-R191 PolarHBondContact O-N 3.45Å; D187-V348 HydrophobicContact CB-CG2 4.07Å
188	F	91.3	Very high	86.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60.9	-48.7	171.5	161	-99.5	0	0	0	112.3	F171 N184 I185 V186 I190 R191 F192 L275 I303 L347 A351 L354	F171-F188 HydrophobicContact CD1-CE1 4.47Å; F171-F188 HydrophobicContact CE1-CE1 4.06Å; F171-F188 HydrophobicContact CE1-CZ 4.4Å; N184-F188 WeakPolarHBondContact O-CB 3.47Å; N184-F188 PolarHBondContact O-N 3.42Å; I185-F188 WeakPolarHBondContact O-CB 3.49Å; I185-F188 PolarHBondContact O-N 3.15Å; V186-F188 VanDerWaalsContact C-N 3.34Å; V186-F188 PolarHBondContact O-N 3.28Å; F188-I190 VanDerWaalsContact C-N 3.34Å; F188-I190 PolarHBondContact O-N 2.84Å; F188-R191 PolarHBondContact O-N 3.38Å; F188-F192 WeakPolarHBondContact O-CB 3.45Å; F188-F192 PolarHBondContact O-N 2.58Å; F188-L275 HydrophobicContact CD1-CD1 4.22Å; F188-L275 HydrophobicContact CE1-CD1 4.16Å; F188-I303 HydrophobicContact CZ-CD1 3.96Å; F188-L347 HydrophobicContact CB-CB 4.24Å; F188-L347 HydrophobicContact CD2-CB 4.47Å; F188-L347 VanDerWaalsContact CD2-O 3.27Å; F188-L347 WeakPolarHBondContact CD2-O 3.44Å; F188-A351 HydrophobicContact CD2-CB 3.82Å; F188-A351 HydrophobicContact CE2-CB 4.04Å; F188-L354 HydrophobicContact CE2-CD2 4.15Å; F188-L354 HydrophobicContact CZ-CD2 3.63Å
189	L	91.4	Very high	85.8	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-60.8	-43.4	177.3	-68.8	170.5	0	0	0	111.4	F171 L173 I185 V186 F192 L193 V233	F171-L189 HydrophobicContact CB-CD2 4.3Å; F171-L189 HydrophobicContact CD1-CD2 3.65Å; F171-L189 HydrophobicContact CD2-CD2 4.13Å; F171-L189 HydrophobicContact CE1-CD2 3.95Å; F171-L189 HydrophobicContact CE2-CD2 4.4Å; F171-L189 HydrophobicContact CG-CD2 3.75Å; F171-L189 HydrophobicContact CZ-CD2 4.32Å; L173-L189 HydrophobicContact CD1-CD1 3.61Å; L173-L189 HydrophobicContact CD1-CD2 4.24Å; L173-L189 HydrophobicContact CD1-CG 4.34Å; L173-L189 HydrophobicContact CD2-CD2 4.45Å; I185-L189 WeakPolarHBondContact O-CG 3.14Å; I185-L189 PolarHBondContact O-N 2.99Å; V186-L189 PolarHBondContact O-N 3.22Å; L189-F192 PolarHBondContact O-N 2.85Å; L189-L193 VanDerWaalsContact O-CB 3.28Å; L189-L193 WeakPolarHBondContact O-CB 3.29Å; L189-L193 WeakPolarHBondContact O-CG 3.44Å; L189-L193 PolarHBondContact O-N 2.9Å; L189-V233 HydrophobicContact CB-CG1 3.77Å; L189-V233 HydrophobicContact CD1-CG1 4.01Å
190	I	90.6	Very high	85.3	Confident	21 Å²	21	47.6 Å²	47.6	11%	0.108	22%	0.224	C	C	.	.	H	α-helix	trans	-59.1	-51.9	178	-70.6	165.3	0	0	0	110.2	V186 D187 F188 F192 L193 E194 L230 V233 K234	V186-I190 HydrophobicContact CG1-CD1 3.89Å; V186-I190 VanDerWaalsContact O-CG1 3.29Å; V186-I190 WeakPolarHBondContact O-CG1 3.4Å; V186-I190 PolarHBondContact O-N 2.89Å; D187-I190 PolarHBondContact O-N 2.97Å; F188-I190 VanDerWaalsContact C-N 3.34Å; F188-I190 PolarHBondContact O-N 2.84Å; I190-F192 VanDerWaalsContact C-N 3.28Å; I190-F192 PolarHBondContact O-N 2.95Å; I190-L193 PolarHBondContact O-N 3.13Å; I190-E194 WeakPolarHBondContact O-CG 3.28Å; I190-E194 PolarHBondContact O-N 3.33Å; I190-L230 HydrophobicContact CB-CD2 4.42Å; I190-L230 HydrophobicContact CG1-CD2 4.47Å; I190-L230 HydrophobicContact CG2-CD2 4.2Å; I190-V233 HydrophobicContact CG1-CG1 4.15Å; I190-K234 HydrophobicContact CD1-CD 4.48Å; I190-K234 HydrophobicContact CD1-CG 3.54Å; I190-K234 HydrophobicContact CG1-CG 4.33Å
191	R	87.6	Confident	84.9	Confident	69 Å²	69	48 Å²	48	26%	0.26	23%	0.229	S	C	.	.	H	α-helix	trans	-63	-34.4	-178.6	-174.2	169.5	171.3	172.9	2	112.7	D187 F188 V348 N349 A351 D352	D187-R191 WeakPolarHBondContact O-CB 3.28Å; D187-R191 PolarHBondContact O-N 3.45Å; F188-R191 PolarHBondContact O-N 3.38Å; R191-V348 HydrophobicContact CB-CG1 4.4Å; R191-V348 VanDerWaalsContact CD-CG1 3.47Å; R191-V348 VanDerWaalsContact CD-O 3.23Å; R191-V348 WeakPolarHBondContact CD-O 3.26Å; R191-V348 PolarHBondContact NE-O 3.34Å; R191-V348 PolarHBondContact NH1-O 3.33Å; R191-N349 PolarHBondContact NH1-OD1 2.9Å; R191-A351 HydrophobicContact CB-CB 4.05Å; R191-A351 HydrophobicContact CG-CB 3.97Å; R191-D352 IonicContact CZ-OD1 2.7Å; R191-D352 IonicContact CZ-OD2 3.38Å; R191-D352 IonicContact NE-OD1 3.95Å; R191-D352 PolarHBondContact NE-OD1 3.09Å; R191-D352 IonicContact NE-OD2 3.42Å; R191-D352 VanDerWaalsContact NH2-CG 3.32Å; R191-D352 IonicContact NH2-OD1 2.93Å; R191-D352 PolarHBondContact NH2-OD1 2.68Å; R191-D352 IonicContact NH2-OD2 2.78Å; R191-D352 PolarHBondContact NH2-OD2 3.28Å
192	F	88	Confident	84.3	Confident	2 Å²	2	49 Å²	49	1%	0.009	23%	0.229	C	C	.	.	H	α-helix	trans	-67.6	-50.7	173.5	-177.5	-88.5	0	0	0	111.4	F171 F188 L189 I190 E194 R195 V196 A351 L354 I358	F171-F192 HydrophobicContact CE2-CD1 4.08Å; F171-F192 AromaticContact CE2-CE1 3.97Å; F171-F192 HydrophobicContact CE2-CE1 3.97Å; F171-F192 AromaticContact CZ-CD1 3.52Å; F171-F192 HydrophobicContact CZ-CD1 3.52Å; F171-F192 AromaticContact CZ-CE1 3.52Å; F171-F192 HydrophobicContact CZ-CE1 3.52Å; F171-F192 HydrophobicContact CZ-CG 4.07Å; F171-F192 HydrophobicContact CZ-CZ 4.07Å; F188-F192 WeakPolarHBondContact O-CB 3.45Å; F188-F192 PolarHBondContact O-N 2.58Å; L189-F192 PolarHBondContact O-N 2.85Å; I190-F192 VanDerWaalsContact C-N 3.28Å; I190-F192 PolarHBondContact O-N 2.95Å; F192-E194 VanDerWaalsContact C-N 3.28Å; F192-E194 PolarHBondContact O-N 2.79Å; F192-R195 PolarHBondContact O-N 3.37Å; F192-R195 VanDerWaalsContact O-N 3.09Å; F192-V196 HydrophobicContact CD1-CG2 3.69Å; F192-V196 HydrophobicContact CE1-CG2 3.32Å; F192-V196 HydrophobicContact CZ-CG2 4.07Å; F192-A351 HydrophobicContact CB-CB 4.24Å; F192-L354 HydrophobicContact CD2-CD2 4.28Å; F192-L354 HydrophobicContact CE2-CD2 4.15Å; F192-L354 HydrophobicContact CE2-CG 4.13Å; F192-I358 HydrophobicContact CE2-CD1 3.94Å; F192-I358 HydrophobicContact CZ-CD1 3.82Å
193	L	88.1	Confident	83.9	Confident	1 Å²	1	48 Å²	48	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-69.6	-21.6	-175.2	-68.5	173.5	0	0	0	113.9	L189 I190 R195 V196 V205 L229 L230 V233	L189-L193 VanDerWaalsContact O-CB 3.28Å; L189-L193 WeakPolarHBondContact O-CB 3.29Å; L189-L193 WeakPolarHBondContact O-CG 3.44Å; L189-L193 PolarHBondContact O-N 2.9Å; I190-L193 PolarHBondContact O-N 3.13Å; L193-R195 PolarHBondContact O-N 2.81Å; L193-V196 HydrophobicContact CD2-CG2 4.44Å; L193-V196 PolarHBondContact O-N 3.45Å; L193-V205 HydrophobicContact CD2-CB 4.38Å; L193-V205 HydrophobicContact CD2-CG1 4.02Å; L193-V205 HydrophobicContact CD2-CG2 3.86Å; L193-L229 HydrophobicContact CD1-CD2 3.99Å; L193-L229 HydrophobicContact CD1-CG 4.14Å; L193-L229 HydrophobicContact CD2-CD2 3.91Å; L193-L229 HydrophobicContact CG-CD2 4.5Å; L193-L230 HydrophobicContact CB-CD2 3.67Å; L193-L230 HydrophobicContact CB-CG 4.47Å; L193-V233 HydrophobicContact CD1-CG2 3.83Å
194	E	84.3	Confident	83.9	Confident	125 Å²	125	42 Å²	42	58%	0.584	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-22.7	169.9	-80.5	175.8	172.5	0	0	113	I190 F192 L230	I190-E194 WeakPolarHBondContact O-CG 3.28Å; I190-E194 PolarHBondContact O-N 3.33Å; F192-E194 VanDerWaalsContact C-N 3.28Å; F192-E194 PolarHBondContact O-N 2.79Å; E194-L230 HydrophobicContact CG-CD1 4.22Å; E194-L230 HydrophobicContact CG-CD2 4.49Å
195	R	75.8	Confident	84	Confident	116 Å²	116	41.2 Å²	41.2	44%	0.438	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-12.8	-176.8	-60.4	-175.3	-179	177	4.9	114.6	F192 L193 D352 F359	F192-R195 PolarHBondContact O-N 3.37Å; F192-R195 VanDerWaalsContact O-N 3.09Å; L193-R195 PolarHBondContact O-N 2.81Å; R195-D352 IonicContact CZ-OD1 3.79Å; R195-D352 IonicContact CZ-OD2 3.99Å; R195-D352 IonicContact NE-OD1 3.53Å; R195-D352 IonicContact NH1-OD1 3.12Å; R195-D352 PolarHBondContact NH1-OD1 3.31Å; R195-D352 VanDerWaalsContact NH1-OD1 3.08Å; R195-D352 IonicContact NH1-OD2 2.77Å; R195-D352 PolarHBondContact NH1-OD2 3.34Å; R195-D352 IonicContact NH2-OD1 2.95Å; R195-D352 PolarHBondContact NH2-OD1 2.76Å; R195-D352 IonicContact NH2-OD2 2.64Å; R195-D352 PolarHBondContact NH2-OD2 3.36Å; R195-F359 HydrophobicContact CB-CE2 4.33Å
196	V	78.5	Confident	84.1	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.006	20%	0.197	C	C	.	.	S	Bend	trans	-84.9	131	178.5	178.8	0	0	0	0	108.8	F192 L193 V198 A203 V205 N226 F359	F192-V196 HydrophobicContact CD1-CG2 3.69Å; F192-V196 HydrophobicContact CE1-CG2 3.32Å; F192-V196 HydrophobicContact CZ-CG2 4.07Å; L193-V196 HydrophobicContact CD2-CG2 4.44Å; L193-V196 PolarHBondContact O-N 3.45Å; V196-V198 HydrophobicContact CG1-CG2 4.01Å; V196-A203 HydrophobicContact CG1-CB 3.62Å; V196-V205 HydrophobicContact CG1-CG2 4.4Å; V196-N226 VanDerWaalsContact O-CG 3.27Å; V196-N226 PolarHBondContact O-ND2 2.84Å; V196-N226 PolarHBondContact O-OD1 3.2Å; V196-F359 HydrophobicContact CB-CZ 4.31Å; V196-F359 HydrophobicContact CG2-CE1 3.93Å; V196-F359 HydrophobicContact CG2-CZ 3.61Å
197	Q	76.3	Confident	84.2	Confident	91 Å²	91	40.7 Å²	40.7	43%	0.425	19%	0.193	S	C	.	.			trans	-87.9	109.7	168.9	-62.8	-173	12	0	0	110.3	Q202 A203	Q197-Q202 WeakPolarHBondContact O-CB 3.32Å; Q197-A203 PolarHBondContact O-N 3.07Å
198	V	80.9	Confident	84.4	Confident	11 Å²	11	38.1 Å²	38.1	7%	0.067	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-91.5	124	-178.7	-178.7	0	0	0	0	110.6	V196 A203 V205 N226 L229	V196-V198 HydrophobicContact CG1-CG2 4.01Å; V198-A203 VanDerWaalsContact CA-O 3.31Å; V198-A203 WeakPolarHBondContact CA-O 3.31Å; V198-V205 HydrophobicContact CG2-CG2 4.13Å; V198-N226 WeakPolarHBondContact CB-OD1 3.43Å; V198-N226 VanDerWaalsContact CG2-OD1 3.31Å; V198-N226 WeakPolarHBondContact CG2-OD1 3.44Å; V198-N226 PolarHBondContact N-OD1 3.23Å; V198-L229 HydrophobicContact CG2-CD2 4.04Å
199	G	76.7	Confident	84.5	Confident	6 Å²	6	38.1 Å²	38.1	6%	0.062	18%	0.18	C	C	.	.	S	Bend	trans	-175.6	166.8	178.1	0	0	0	0	0	113.7	K201 Q202 A203	G199-K201 VanDerWaalsContact C-N 3.26Å; G199-K201 PolarHBondContact O-N 3.13Å; G199-Q202 CarbonylContact O-C 3.56Å; G199-Q202 PolarHBondContact O-N 2.78Å; G199-A203 PolarHBondContact N-O 2.79Å; G199-A203 VanDerWaalsContact N-O 3.17Å
200	P	73.9	Confident	84.4	Confident	85 Å²	85	38.1 Å²	38.1	55%	0.552	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-25.7	-173.4	23.2	-33.2	0	0	0	114.3	R265	P200-R265 PolarHBondContact O-NH1 2.88Å; P200-R265 VanDerWaalsContact O-NH1 3.12Å
201	K	70.9	Confident	84.2	Confident	169 Å²	169	37.1 Å²	37.1	74%	0.735	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.5	14.1	174.7	-61.6	-171.7	177.5	-173.9	0	113.4	S165 N166 G199	S165-K201 PolarHBondContact OG-O 2.66Å; N166-K201 PolarHBondContact OD1-O 2.83Å; G199-K201 VanDerWaalsContact C-N 3.26Å; G199-K201 PolarHBondContact O-N 3.13Å
202	Q	75.6	Confident	84	Confident	73 Å²	73	38.2 Å²	38.2	34%	0.341	18%	0.182	S	C	.	.	S	Bend	trans	-131.1	-148.3	-175.3	-61.6	-174.7	-39.2	0	0	109.3	S165 Q197 G199 R265	S165-Q202 CarbonylContact O-C 3.58Å; S165-Q202 WeakPolarHBondContact O-CA 3.31Å; Q197-Q202 WeakPolarHBondContact O-CB 3.32Å; G199-Q202 CarbonylContact O-C 3.56Å; G199-Q202 PolarHBondContact O-N 2.78Å; Q202-R265 VanDerWaalsContact O-CZ 3.29Å; Q202-R265 PolarHBondContact O-NH1 2.88Å; Q202-R265 PolarHBondContact O-NH2 2.96Å
203	A	82.9	Confident	83.9	Confident	4 Å²	4	42.8 Å²	42.8	3%	0.033	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	143.1	175.9	0	0	0	0	0	111.8	M167 I169 V196 Q197 V198 G199	M167-A203 CarbonylContact O-C 3.52Å; M167-A203 VanDerWaalsContact O-CA 3.25Å; M167-A203 WeakPolarHBondContact O-CA 3.43Å; I169-A203 HydrophobicContact CD1-CB 4.49Å; V196-A203 HydrophobicContact CG1-CB 3.62Å; Q197-A203 PolarHBondContact O-N 3.07Å; V198-A203 VanDerWaalsContact CA-O 3.31Å; V198-A203 WeakPolarHBondContact CA-O 3.31Å; G199-A203 PolarHBondContact N-O 2.79Å; G199-A203 VanDerWaalsContact N-O 3.17Å
204	Q	89.1	Confident	84	Confident	16 Å²	16	44.3 Å²	44.3	8%	0.075	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	141.3	167.7	-64.9	-172	12.5	0	0	109.5	M167 I169 L220 G263	M167-Q204 PolarHBondContact O-N 3.45Å; I169-Q204 PolarHBondContact N-O 2.85Å; Q204-L220 HydrophobicContact CB-CD2 4.1Å; Q204-G263 PolarHBondContact OE1-O 2.89Å
205	V	91.2	Very high	84.3	Confident	8 Å²	8	43 Å²	43	5%	0.048	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	126.9	-173.4	-177.4	0	0	0	0	111.2	I169 F171 L193 V196 V198 I207 V218 L229	I169-V205 CarbonylContact O-C 3.55Å; I169-V205 VanDerWaalsContact O-CA 3.27Å; I169-V205 WeakPolarHBondContact O-CA 3.33Å; F171-V205 HydrophobicContact CD2-CG1 3.99Å; F171-V205 HydrophobicContact CE2-CG1 4.08Å; L193-V205 HydrophobicContact CD2-CB 4.38Å; L193-V205 HydrophobicContact CD2-CG1 4.02Å; L193-V205 HydrophobicContact CD2-CG2 3.86Å; V196-V205 HydrophobicContact CG1-CG2 4.4Å; V198-V205 HydrophobicContact CG2-CG2 4.13Å; V205-I207 HydrophobicContact CG1-CG1 4.3Å; V205-V218 WeakPolarHBondContact O-CG1 3.21Å; V205-L229 HydrophobicContact CB-CD2 4.04Å; V205-L229 HydrophobicContact CG1-CD2 4.46Å; V205-L229 HydrophobicContact CG2-CD2 4.34Å
206	G	92.1	Very high	84.9	Confident	2 Å²	2	39.3 Å²	39.3	2%	0.021	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	150	168.8	0	0	0	0	0	111.2	I169 V170 F171 V218	I169-G206 PolarHBondContact O-N 2.86Å; V170-G206 WeakPolarHBondContact CA-O 3.34Å; F171-G206 PolarHBondContact N-O 2.77Å; G206-V218 WeakPolarHBondContact CA-O 3.34Å
207	I	93.9	Very high	85.5	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	124.7	179.5	-55.6	176.6	0	0	0	109.1	F171 L173 V205 H217 V218 V233 I236	F171-I207 HydrophobicContact CB-CG1 4.47Å; L173-I207 HydrophobicContact CD1-CG2 3.8Å; V205-I207 HydrophobicContact CG1-CG1 4.3Å; I207-H217 HydrophobicContact CB-CB 4.34Å; I207-H217 HydrophobicContact CG2-CB 4.28Å; I207-H217 PolarHBondContact O-N 3.08Å; I207-V218 HydrophobicContact CB-CB 4.06Å; I207-V218 HydrophobicContact CB-CG2 4.15Å; I207-V218 HydrophobicContact CD1-CG2 4.03Å; I207-V218 HydrophobicContact CG1-CB 4.19Å; I207-V218 HydrophobicContact CG1-CG2 4.21Å; I207-V218 PolarHBondContact N-O 2.63Å; I207-V218 PolarHBondContact O-N 2.79Å; I207-V218 VanDerWaalsContact O-N 3.1Å; I207-V233 HydrophobicContact CD1-CG2 3.63Å; I207-I236 HydrophobicContact CD1-CD1 4.07Å; I207-I236 HydrophobicContact CG2-CD1 4.3Å
208	V	93.6	Very high	86.2	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	132.2	178.4	-178.1	0	0	0	0	108	V170 F171 V172 L173 V214 K215 A257	V170-V208 HydrophobicContact CG1-CG2 4.1Å; F171-V208 PolarHBondContact O-N 3.29Å; F171-V208 VanDerWaalsContact O-O 3.13Å; V172-V208 WeakPolarHBondContact CA-O 3.28Å; L173-V208 PolarHBondContact N-O 2.8Å; V208-V214 HydrophobicContact CG1-CG1 3.32Å; V208-K215 WeakPolarHBondContact CA-O 3.35Å; V208-A257 HydrophobicContact CG2-CB 4.3Å
209	S	92.3	Very high	86.7	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	151.8	170.6	67.9	0	0	0	0	110.6	L173 K215 H217	L173-S209 CarbonylContact O-C 3.11Å; L173-S209 VanDerWaalsContact O-CA 3.22Å; L173-S209 WeakPolarHBondContact O-CA 3.15Å; S209-K215 PolarHBondContact N-O 2.93Å; S209-K215 PolarHBondContact O-N 2.86Å; S209-H217 PolarHBondContact OG-CD2 3.1Å; S209-H217 VanDerWaalsContact OG-CD2 3.22Å; S209-H217 PolarHBondContact OG-NE2 3.38Å
210	Y	91.2	Very high	87	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	160.7	-179.9	72.3	-82.7	0	0	0	113.7	V172 L173 D174 G175 D213 T244 H245 T246 A249 T276	V172-Y210 HydrophobicContact CG1-CD1 3.82Å; V172-Y210 HydrophobicContact CG1-CE1 3.86Å; L173-Y210 VanDerWaalsContact C-CD1 3.49Å; L173-Y210 VanDerWaalsContact C-CE1 3.44Å; L173-Y210 WeakPolarHBondContact O-CD1 3.46Å; L173-Y210 PolarHBondContact O-N 3.29Å; D174-Y210 HydrophobicContact CB-CE1 3.97Å; D174-Y210 HydrophobicContact CB-CE2 4.47Å; D174-Y210 VanDerWaalsContact N-CE1 3.31Å; G175-Y210 WeakPolarHBondContact CA-O 3.13Å; G175-Y210 PolarHBondContact N-O 2.89Å; Y210-D213 WeakPolarHBondContact CA-O 3.46Å; Y210-T244 HydrophobicContact CE2-CG2 3.69Å; Y210-H245 WeakPolarHBondContact CD2-O 3.16Å; Y210-T246 VanDerWaalsContact CE2-CA 3.46Å; Y210-T246 WeakPolarHBondContact CE2-OG1 3.16Å; Y210-T246 WeakPolarHBondContact OH-CG2 3.36Å; Y210-T246 PolarHBondContact OH-OG1 3.12Å; Y210-A249 HydrophobicContact CD1-CB 3.55Å; Y210-A249 HydrophobicContact CD2-CB 3.75Å; Y210-A249 HydrophobicContact CE1-CB 4.13Å; Y210-A249 HydrophobicContact CE2-CB 4.3Å; Y210-A249 HydrophobicContact CG-CB 3.33Å; Y210-T276 WeakPolarHBondContact OH-CB 3.16Å
211	G	85.9	Confident	87.4	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.183	C	C	.	.	S	Bend	trans	-155.1	-102.9	172	0	0	0	0	0	109.3	D213 K243 H245	G211-D213 PolarHBondContact N-O 2.85Å; G211-K243 CarbonylContact C-O 3.53Å; G211-K243 WeakPolarHBondContact CA-O 3.16Å; G211-H245 PolarHBondContact O-N 2.87Å
212	E	83.3	Confident	88.1	Confident	92 Å²	92	33.2 Å²	33.2	43%	0.43	17%	0.169	S	C	.	.	S	Bend	trans	-79.6	-33.9	168.3	-171	158.4	-147.5	0	0	111.9	K243 H245	E212-K243 IonicContact OE1-NZ 2.79Å; E212-K243 PolarHBondContact OE1-NZ 3.18Å; E212-H245 PolarHBondContact O-ND1 3.04Å
213	D	86.3	Confident	88.6	Confident	98 Å²	98	31.3 Å²	31.3	52%	0.524	16%	0.16	S	C	.	.	S	Bend	trans	-124	169.5	171.9	62.9	-35.7	0	0	0	111.6	Y210 G211 H239	Y210-D213 WeakPolarHBondContact CA-O 3.46Å; G211-D213 PolarHBondContact N-O 2.85Å; D213-H239 PolarHBondContact O-NE2 3.34Å; D213-H239 VanDerWaalsContact O-NE2 3.15Å; D213-H239 IonicContact OD1-CD2 2.97Å; D213-H239 IonicContact OD1-CE1 3.28Å; D213-H239 PolarHBondContact OD1-CE1 3.46Å; D213-H239 IonicContact OD1-NE2 3.2Å; D213-H239 PolarHBondContact OD1-NE2 3.47Å; D213-H239 IonicContact OD2-CE1 2.73Å; D213-H239 IonicContact OD2-NE2 3.81Å
214	V	89.3	Confident	88.4	Confident	33 Å²	33	36.2 Å²	36.2	20%	0.2	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	135.2	-175.1	-175.9	0	0	0	0	110.2	V208 L248 A249 T252	V208-V214 HydrophobicContact CG1-CG1 3.32Å; V214-L248 HydrophobicContact CG2-CD2 4.46Å; V214-L248 HydrophobicContact CG2-CG 4.19Å; V214-A249 HydrophobicContact CG2-CB 4.07Å; V214-T252 HydrophobicContact CB-CG2 4.2Å; V214-T252 HydrophobicContact CG1-CG2 3.86Å
215	K	90.4	Very high	88	Confident	99 Å²	99	38.2 Å²	38.2	43%	0.43	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	128.4	-178.9	-174.2	175.3	-176.8	173.7	0	112.3	V208 S209	V208-K215 WeakPolarHBondContact CA-O 3.35Å; S209-K215 PolarHBondContact N-O 2.93Å; S209-K215 PolarHBondContact O-N 2.86Å
216	H	89.8	Confident	87.5	Confident	38 Å²	38	39.9 Å²	39.9	18%	0.176	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	120.2	172.3	-69	-103	0	0	0	110.4	E256	H216-E256 IonicContact NE2-OE2 2.73Å
217	H	90.3	Very high	87.2	Confident	22 Å²	22	47.8 Å²	47.8	10%	0.102	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	-38.6	175.1	-76.5	-74	0	0	0	112.5	I207 S209 F232 I236	I207-H217 HydrophobicContact CB-CB 4.34Å; I207-H217 HydrophobicContact CG2-CB 4.28Å; I207-H217 PolarHBondContact O-N 3.08Å; S209-H217 PolarHBondContact OG-CD2 3.1Å; S209-H217 VanDerWaalsContact OG-CD2 3.22Å; S209-H217 PolarHBondContact OG-NE2 3.38Å; H217-F232 HydrophobicContact CB-CE1 4.45Å; H217-F232 WeakPolarHBondContact O-CE1 3.22Å; H217-F232 WeakPolarHBondContact O-CZ 3.22Å; H217-I236 HydrophobicContact CB-CD1 4.4Å
218	V	90.9	Very high	86.7	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.018	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	128.2	-179.2	-177.9	0	0	0	0	109.1	V205 G206 I207 Q222 F223 L229 F232	V205-V218 WeakPolarHBondContact O-CG1 3.21Å; G206-V218 WeakPolarHBondContact CA-O 3.34Å; I207-V218 HydrophobicContact CB-CB 4.06Å; I207-V218 HydrophobicContact CB-CG2 4.15Å; I207-V218 HydrophobicContact CD1-CG2 4.03Å; I207-V218 HydrophobicContact CG1-CB 4.19Å; I207-V218 HydrophobicContact CG1-CG2 4.21Å; I207-V218 PolarHBondContact N-O 2.63Å; I207-V218 PolarHBondContact O-N 2.79Å; I207-V218 VanDerWaalsContact O-N 3.1Å; V218-Q222 HydrophobicContact CG1-CB 4.42Å; V218-F223 HydrophobicContact CG1-CD2 3.8Å; V218-F223 HydrophobicContact CG1-CE2 3.79Å; V218-F223 HydrophobicContact CG2-CE2 4.16Å; V218-L229 HydrophobicContact CG1-CD1 4.1Å; V218-L229 HydrophobicContact CG2-CD1 4.3Å; V218-F232 HydrophobicContact CG2-CD1 3.7Å; V218-F232 HydrophobicContact CG2-CE1 3.58Å
219	N	90.8	Very high	86.4	Confident	55 Å²	55	52.8 Å²	52.8	29%	0.294	26%	0.263	S	S	.	.			trans	-87.6	154.9	171.1	-67.2	-24.2	0	0	0	110.6	Q222 R262	N219-Q222 HydrophobicContact CB-CB 4.44Å; N219-Q222 VanDerWaalsContact O-CB 3.26Å; N219-Q222 WeakPolarHBondContact O-CB 3.27Å; N219-Q222 PolarHBondContact O-N 3.04Å; N219-R262 HydrophobicContact CB-CB 4.44Å; N219-R262 PolarHBondContact OD1-NH1 2.78Å
220	L	83.6	Confident	86.3	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.01	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	149.1	169.3	-58.7	164.6	0	0	0	108.2	D168 V170 Q204 Q222 A257 F258 R262 A264	D168-L220 HydrophobicContact CB-CD1 4.08Å; D168-L220 HydrophobicContact CB-CD2 4.22Å; V170-L220 HydrophobicContact CG2-CD1 4.15Å; V170-L220 HydrophobicContact CG2-CD2 4.14Å; V170-L220 HydrophobicContact CG2-CG 4.32Å; Q204-L220 HydrophobicContact CB-CD2 4.1Å; L220-Q222 PolarHBondContact O-N 3.45Å; L220-Q222 VanDerWaalsContact O-N 3.09Å; L220-A257 WeakPolarHBondContact CD1-O 3.09Å; L220-F258 HydrophobicContact CD1-CD1 4.3Å; L220-R262 CarbonylContact C-O 3.59Å; L220-R262 VanDerWaalsContact C-O 3.32Å; L220-R262 VanDerWaalsContact CA-O 3.28Å; L220-R262 WeakPolarHBondContact CA-O 3.4Å; L220-R262 WeakPolarHBondContact CB-O 3.28Å; L220-R262 PolarHBondContact N-O 3.02Å; L220-R262 CarbonylContact O-C 3Å; L220-A264 HydrophobicContact CD1-CB 3.74Å
221	S	82.9	Confident	86.1	Confident	59 Å²	59	57.9 Å²	57.9	41%	0.413	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	0.4	-172.5	79.4	0	0	0	0	118.2	F223 G263	S221-F223 VanDerWaalsContact C-N 3.31Å; S221-F223 PolarHBondContact O-N 2.98Å; S221-G263 WeakPolarHBondContact OG-CA 3.28Å
222	Q	85.6	Confident	86.3	Confident	94 Å²	94	61.5 Å²	61.5	44%	0.439	31%	0.308	S	S	.	.	S	Bend	trans	-65.6	-32.8	-179.9	-177.7	176.8	-13.2	0	0	113.3	V218 N219 L220	V218-Q222 HydrophobicContact CG1-CB 4.42Å; N219-Q222 HydrophobicContact CB-CB 4.44Å; N219-Q222 VanDerWaalsContact O-CB 3.26Å; N219-Q222 WeakPolarHBondContact O-CB 3.27Å; N219-Q222 PolarHBondContact O-N 3.04Å; L220-Q222 PolarHBondContact O-N 3.45Å; L220-Q222 VanDerWaalsContact O-N 3.09Å
223	F	85.1	Confident	86.6	Confident	33 Å²	33	57.1 Å²	57.1	15%	0.145	29%	0.288	C	S	.	.			trans	-122.7	136.1	-178.8	-62.9	-78.8	0	0	0	110.6	V218 S221 E228 L229 F232	V218-F223 HydrophobicContact CG1-CD2 3.8Å; V218-F223 HydrophobicContact CG1-CE2 3.79Å; V218-F223 HydrophobicContact CG2-CE2 4.16Å; S221-F223 VanDerWaalsContact C-N 3.31Å; S221-F223 PolarHBondContact O-N 2.98Å; F223-E228 HydrophobicContact CD1-CB 3.82Å; F223-E228 HydrophobicContact CE1-CB 4.26Å; F223-L229 HydrophobicContact CB-CB 4.21Å; F223-L229 HydrophobicContact CD2-CB 4.34Å; F223-L229 HydrophobicContact CD2-CD1 3.65Å; F223-L229 HydrophobicContact CE2-CD1 3.99Å; F223-L229 HydrophobicContact CG-CB 4.2Å; F223-L229 HydrophobicContact CG-CD1 4.35Å; F223-F232 HydrophobicContact CE2-CB 4.48Å; F223-F232 HydrophobicContact CE2-CD1 4.49Å; F223-F232 HydrophobicContact CE2-CG 4.4Å; F223-F232 HydrophobicContact CZ-CB 3.88Å; F223-F232 HydrophobicContact CZ-CD1 4.42Å; F223-F232 HydrophobicContact CZ-CD2 4.14Å; F223-F232 AromaticContact CZ-CG 3.9Å; F223-F232 HydrophobicContact CZ-CG 3.9Å
224	N	79.3	Confident	86.8	Confident	107 Å²	107	59.1 Å²	59.1	57%	0.572	29%	0.292	S	S	*	.	S	Bend	trans	-104.2	0.8	179.8	-69.3	-34	0	0	0	113.4
225	N	80.2	Confident	86.9	Confident	57 Å²	57	65.5 Å²	65.5	31%	0.305	32%	0.317	S	S	.	.	S	Bend	trans	-148.5	150.9	177	69.1	70	0	0	0	112	K227 E228	N225-K227 VanDerWaalsContact C-N 3.31Å; N225-K227 PolarHBondContact O-N 2.96Å; N225-K227 PolarHBondContact OD1-N 3.49Å; N225-E228 PolarHBondContact ND2-OE1 2.67Å; N225-E228 WeakPolarHBondContact OD1-CB 3.47Å; N225-E228 WeakPolarHBondContact OD1-CG 3.46Å; N225-E228 PolarHBondContact OD1-N 2.83Å
226	N	81.9	Confident	86.8	Confident	43 Å²	43	61.2 Å²	61.2	23%	0.23	30%	0.299	C	S	.	.	H	α-helix	trans	-61.9	-35.9	-179.1	-69.3	17.1	0	0	0	113.7	V196 V198 E228 L229 L230	V196-N226 VanDerWaalsContact O-CG 3.27Å; V196-N226 PolarHBondContact O-ND2 2.84Å; V196-N226 PolarHBondContact O-OD1 3.2Å; V198-N226 WeakPolarHBondContact CB-OD1 3.43Å; V198-N226 VanDerWaalsContact CG2-OD1 3.31Å; V198-N226 WeakPolarHBondContact CG2-OD1 3.44Å; V198-N226 PolarHBondContact N-OD1 3.23Å; N226-E228 PolarHBondContact O-N 3.29Å; N226-L229 PolarHBondContact O-N 2.92Å; N226-L230 WeakPolarHBondContact O-CB 3.27Å; N226-L230 VanDerWaalsContact O-CG 3.24Å; N226-L230 WeakPolarHBondContact O-CG 3.34Å; N226-L230 PolarHBondContact O-N 3.45Å
227	K	83.9	Confident	86.7	Confident	168 Å²	168	63 Å²	63	73%	0.73	31%	0.314	S	S	*	.	H	α-helix	trans	-67.3	-40.6	-169.4	-170.3	178.5	179.2	-178.7	0	111.4	N225 T231	N225-K227 VanDerWaalsContact C-N 3.31Å; N225-K227 PolarHBondContact O-N 2.96Å; N225-K227 PolarHBondContact OD1-N 3.49Å; K227-T231 PolarHBondContact O-N 3.28Å; K227-T231 VanDerWaalsContact O-N 3.15Å; K227-T231 PolarHBondContact O-OG1 2.9Å
228	E	84.6	Confident	86.5	Confident	105 Å²	105	64.1 Å²	64.1	49%	0.491	32%	0.319	S	S	.	.	H	α-helix	trans	-68.3	-45.3	175.3	-74.6	169.7	-153	0	0	111.6	F223 N225 N226 L230 T231 F232	F223-E228 HydrophobicContact CD1-CB 3.82Å; F223-E228 HydrophobicContact CE1-CB 4.26Å; N225-E228 PolarHBondContact ND2-OE1 2.67Å; N225-E228 WeakPolarHBondContact OD1-CB 3.47Å; N225-E228 WeakPolarHBondContact OD1-CG 3.46Å; N225-E228 PolarHBondContact OD1-N 2.83Å; N226-E228 PolarHBondContact O-N 3.29Å; E228-L230 PolarHBondContact O-N 3.29Å; E228-T231 PolarHBondContact O-N 2.86Å; E228-F232 PolarHBondContact O-N 2.99Å
229	L	87.5	Confident	86.1	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-58.1	-49.2	176.2	178.9	63.4	0	0	0	111.3	L193 V198 V205 V218 F223 N226 T231 F232 V233	L193-L229 HydrophobicContact CD1-CD2 3.99Å; L193-L229 HydrophobicContact CD1-CG 4.14Å; L193-L229 HydrophobicContact CD2-CD2 3.91Å; L193-L229 HydrophobicContact CG-CD2 4.5Å; V198-L229 HydrophobicContact CG2-CD2 4.04Å; V205-L229 HydrophobicContact CB-CD2 4.04Å; V205-L229 HydrophobicContact CG1-CD2 4.46Å; V205-L229 HydrophobicContact CG2-CD2 4.34Å; V218-L229 HydrophobicContact CG1-CD1 4.1Å; V218-L229 HydrophobicContact CG2-CD1 4.3Å; F223-L229 HydrophobicContact CB-CB 4.21Å; F223-L229 HydrophobicContact CD2-CB 4.34Å; F223-L229 HydrophobicContact CD2-CD1 3.65Å; F223-L229 HydrophobicContact CE2-CD1 3.99Å; F223-L229 HydrophobicContact CG-CB 4.2Å; F223-L229 HydrophobicContact CG-CD1 4.35Å; N226-L229 PolarHBondContact O-N 2.92Å; L229-T231 VanDerWaalsContact C-N 3.27Å; L229-T231 PolarHBondContact O-N 3.41Å; L229-F232 WeakPolarHBondContact O-CB 3.16Å; L229-F232 PolarHBondContact O-N 3.44Å; L229-F232 VanDerWaalsContact O-N 3.11Å; L229-V233 HydrophobicContact CD1-CG2 4.15Å; L229-V233 HydrophobicContact CG-CG2 4.34Å; L229-V233 VanDerWaalsContact O-CG2 3.32Å; L229-V233 WeakPolarHBondContact O-CG2 3.39Å; L229-V233 PolarHBondContact O-N 2.91Å
230	L	89.4	Confident	85.4	Confident	29 Å²	29	68 Å²	68	15%	0.152	34%	0.338	C	S	.	.	H	α-helix	trans	-60.4	-35.4	177.8	-74.5	171.3	0	0	0	112.5	I190 L193 E194 N226 E228 F232 K234	I190-L230 HydrophobicContact CB-CD2 4.42Å; I190-L230 HydrophobicContact CG1-CD2 4.47Å; I190-L230 HydrophobicContact CG2-CD2 4.2Å; L193-L230 HydrophobicContact CB-CD2 3.67Å; L193-L230 HydrophobicContact CB-CG 4.47Å; E194-L230 HydrophobicContact CG-CD1 4.22Å; E194-L230 HydrophobicContact CG-CD2 4.49Å; N226-L230 WeakPolarHBondContact O-CB 3.27Å; N226-L230 VanDerWaalsContact O-CG 3.24Å; N226-L230 WeakPolarHBondContact O-CG 3.34Å; N226-L230 PolarHBondContact O-N 3.45Å; E228-L230 PolarHBondContact O-N 3.29Å; L230-F232 VanDerWaalsContact C-N 3.34Å; L230-K234 WeakPolarHBondContact O-CG 3.23Å; L230-K234 PolarHBondContact O-N 3.3Å
231	T	88.1	Confident	85.2	Confident	77 Å²	77	68.6 Å²	68.6	47%	0.472	34%	0.344	S	S	.	.	H	α-helix	trans	-69.2	-34.7	177.7	-57.2	0	0	0	0	111.6	K227 E228 L229	K227-T231 PolarHBondContact O-N 3.28Å; K227-T231 VanDerWaalsContact O-N 3.15Å; K227-T231 PolarHBondContact O-OG1 2.9Å; E228-T231 PolarHBondContact O-N 2.86Å; L229-T231 VanDerWaalsContact C-N 3.27Å; L229-T231 PolarHBondContact O-N 3.41Å
232	F	89.7	Confident	84.8	Confident	77 Å²	77	71.2 Å²	71.2	34%	0.338	36%	0.358	S	S	.	.	H	α-helix	trans	-72.4	-46.4	175.1	-174.3	-92.2	0	0	0	111.9	H217 V218 F223 E228 L229 L230 K234 K235 I236	H217-F232 HydrophobicContact CB-CE1 4.45Å; H217-F232 WeakPolarHBondContact O-CE1 3.22Å; H217-F232 WeakPolarHBondContact O-CZ 3.22Å; V218-F232 HydrophobicContact CG2-CD1 3.7Å; V218-F232 HydrophobicContact CG2-CE1 3.58Å; F223-F232 HydrophobicContact CE2-CB 4.48Å; F223-F232 HydrophobicContact CE2-CD1 4.49Å; F223-F232 HydrophobicContact CE2-CG 4.4Å; F223-F232 HydrophobicContact CZ-CB 3.88Å; F223-F232 HydrophobicContact CZ-CD1 4.42Å; F223-F232 HydrophobicContact CZ-CD2 4.14Å; F223-F232 AromaticContact CZ-CG 3.9Å; F223-F232 HydrophobicContact CZ-CG 3.9Å; E228-F232 PolarHBondContact O-N 2.99Å; L229-F232 WeakPolarHBondContact O-CB 3.16Å; L229-F232 PolarHBondContact O-N 3.44Å; L229-F232 VanDerWaalsContact O-N 3.11Å; L230-F232 VanDerWaalsContact C-N 3.34Å; F232-K234 VanDerWaalsContact C-N 3.26Å; F232-K234 PolarHBondContact O-N 2.84Å; F232-K235 PolarHBondContact O-N 2.87Å; F232-I236 HydrophobicContact CD1-CD1 4.49Å; F232-I236 HydrophobicContact CD1-CG1 4.38Å; F232-I236 HydrophobicContact CE1-CD1 4.5Å; F232-I236 HydrophobicContact CE1-CG1 4.27Å
233	V	90.1	Very high	84.6	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-57.4	-37.8	-178.1	170.5	0	0	0	0	112.3	V186 L189 I190 L193 I207 L229 K235 I236	V186-V233 HydrophobicContact CG1-CG1 4.42Å; L189-V233 HydrophobicContact CB-CG1 3.77Å; L189-V233 HydrophobicContact CD1-CG1 4.01Å; I190-V233 HydrophobicContact CG1-CG1 4.15Å; L193-V233 HydrophobicContact CD1-CG2 3.83Å; I207-V233 HydrophobicContact CD1-CG2 3.63Å; L229-V233 HydrophobicContact CD1-CG2 4.15Å; L229-V233 HydrophobicContact CG-CG2 4.34Å; L229-V233 VanDerWaalsContact O-CG2 3.32Å; L229-V233 WeakPolarHBondContact O-CG2 3.39Å; L229-V233 PolarHBondContact O-N 2.91Å; V233-K235 PolarHBondContact O-N 2.89Å; V233-I236 HydrophobicContact CB-CD1 4.28Å; V233-I236 HydrophobicContact CG1-CD1 4.36Å; V233-I236 HydrophobicContact CG2-CD1 4.12Å; V233-I236 PolarHBondContact O-N 2.82Å; V233-I236 VanDerWaalsContact O-N 3.16Å
234	K	89.6	Confident	84.6	Confident	139 Å²	139	69.4 Å²	69.4	60%	0.604	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-20.6	175.6	-77.4	173.9	-177.7	-177.2	0	114.7	I190 L230 F232	I190-K234 HydrophobicContact CD1-CD 4.48Å; I190-K234 HydrophobicContact CD1-CG 3.54Å; I190-K234 HydrophobicContact CG1-CG 4.33Å; L230-K234 WeakPolarHBondContact O-CG 3.23Å; L230-K234 PolarHBondContact O-N 3.3Å; F232-K234 VanDerWaalsContact C-N 3.26Å; F232-K234 PolarHBondContact O-N 2.84Å
235	K	90.3	Very high	85.1	Confident	168 Å²	168	66.2 Å²	66.2	73%	0.73	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	5.1	-175.3	-60.4	-179	-176.3	177.5	0	113.4	F232 V233 P237	F232-K235 PolarHBondContact O-N 2.87Å; V233-K235 PolarHBondContact O-N 2.89Å; K235-P237 VanDerWaalsContact O-CD 3.27Å; K235-P237 WeakPolarHBondContact O-CD 3.46Å
236	I	89.8	Confident	85.6	Confident	9 Å²	9	63.5 Å²	63.5	5%	0.046	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-67.1	116.7	-178.2	-67.6	176.4	0	0	0	109.5	W182 I207 H217 F232 V233	W182-I236 HydrophobicContact CZ2-CG2 4.12Å; W182-I236 PolarHBondContact NE1-O 2.76Å; I207-I236 HydrophobicContact CD1-CD1 4.07Å; I207-I236 HydrophobicContact CG2-CD1 4.3Å; H217-I236 HydrophobicContact CB-CD1 4.4Å; F232-I236 HydrophobicContact CD1-CD1 4.49Å; F232-I236 HydrophobicContact CD1-CG1 4.38Å; F232-I236 HydrophobicContact CE1-CD1 4.5Å; F232-I236 HydrophobicContact CE1-CG1 4.27Å; V233-I236 HydrophobicContact CB-CD1 4.28Å; V233-I236 HydrophobicContact CG1-CD1 4.36Å; V233-I236 HydrophobicContact CG2-CD1 4.12Å; V233-I236 PolarHBondContact O-N 2.82Å; V233-I236 VanDerWaalsContact O-N 3.16Å
237	P	86.9	Confident	86	Confident	76 Å²	76	61.4 Å²	61.4	49%	0.494	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-76.1	154.6	176.5	33	-34.4	0	0	0	111	K235	K235-P237 VanDerWaalsContact O-CD 3.27Å; K235-P237 WeakPolarHBondContact O-CD 3.46Å
238	Q	87.1	Confident	86.4	Confident	45 Å²	45	56.6 Å²	56.6	21%	0.21	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-64.8	138.2	168.2	-171.7	168.3	11.4	0	0	109.4	G175 S176 I179 W182 L240	G175-Q238 VanDerWaalsContact O-CG 3.3Å; G175-Q238 WeakPolarHBondContact O-CG 3.21Å; S176-Q238 PolarHBondContact O-NE2 2.74Å; I179-Q238 PolarHBondContact O-NE2 3.14Å; W182-Q238 HydrophobicContact CB-CB 4.15Å; W182-Q238 HydrophobicContact CB-CG 4.41Å; W182-Q238 HydrophobicContact CD2-CB 3.83Å; W182-Q238 HydrophobicContact CD2-CG 4.03Å; W182-Q238 HydrophobicContact CE3-CB 4.32Å; W182-Q238 HydrophobicContact CE3-CG 4Å; W182-Q238 HydrophobicContact CG-CB 3.73Å; W182-Q238 HydrophobicContact CG-CG 4.22Å; Q238-L240 HydrophobicContact CB-CD2 4.34Å; Q238-L240 HydrophobicContact CG-CD2 4.05Å
239	H	81.1	Confident	86.7	Confident	35 Å²	35	51.6 Å²	51.6	16%	0.162	26%	0.264	C	S	.	.			trans	-69.9	-32.8	-175.7	-170.3	67	0	0	0	112.6	D213	D213-H239 PolarHBondContact O-NE2 3.34Å; D213-H239 VanDerWaalsContact O-NE2 3.15Å; D213-H239 IonicContact OD1-CD2 2.97Å; D213-H239 IonicContact OD1-CE1 3.28Å; D213-H239 PolarHBondContact OD1-CE1 3.46Å; D213-H239 IonicContact OD1-NE2 3.2Å; D213-H239 PolarHBondContact OD1-NE2 3.47Å; D213-H239 IonicContact OD2-CE1 2.73Å; D213-H239 IonicContact OD2-NE2 3.81Å
240	L	77.8	Confident	86.9	Confident	105 Å²	105	51.6 Å²	51.6	55%	0.55	26%	0.264	S	S	.	.			trans	65.3	138.9	-178.8	-54.6	169.7	0	0	0	112.9	G175 N177 Q238	G175-L240 WeakPolarHBondContact O-CA 3.09Å; G175-L240 PolarHBondContact O-N 2.04Å; N177-L240 WeakPolarHBondContact OD1-CA 3.42Å; N177-L240 WeakPolarHBondContact OD1-CD2 3.44Å; Q238-L240 HydrophobicContact CB-CD2 4.34Å; Q238-L240 HydrophobicContact CG-CD2 4.05Å
241	G	78.6	Confident	87.1	Confident	14 Å²	14	51.4 Å²	51.4	14%	0.144	26%	0.263	C	S	.	.			trans	170	151.6	-177	0	0	0	0	0	113	N177	N177-G241 WeakPolarHBondContact CB-O 3.39Å; N177-G241 PolarHBondContact N-O 3.36Å; N177-G241 PolarHBondContact ND2-O 2.48Å; N177-G241 PolarHBondContact OD1-N 2.7Å; N177-G241 VanDerWaalsContact OD1-N 3.09Å
242	T	74.6	Confident	87.3	Confident	114 Å²	114	48.7 Å²	48.7	70%	0.699	25%	0.246	S	C	*	.	S	Bend	trans	-93	-9.2	179.7	55	0	0	0	0	113.6
243	K	81.6	Confident	87.4	Confident	80 Å²	80	45 Å²	45	35%	0.348	23%	0.23	S	C	.	.			trans	-125.2	161.5	177.3	-64.4	177.7	-167.8	147.2	0	110.4	G211 E212	G211-K243 CarbonylContact C-O 3.53Å; G211-K243 WeakPolarHBondContact CA-O 3.16Å; E212-K243 IonicContact OE1-NZ 2.79Å; E212-K243 PolarHBondContact OE1-NZ 3.18Å
244	T	85	Confident	87.5	Confident	8 Å²	8	46.6 Å²	46.6	5%	0.049	24%	0.236	C	C	.	.			trans	-126.9	101.1	179.1	-51.4	0	0	0	0	108.3	D174 S176 Y210 S280 H281	D174-T244 WeakPolarHBondContact OD2-CG2 3.43Å; S176-T244 PolarHBondContact OG-OG1 2.99Å; Y210-T244 HydrophobicContact CE2-CG2 3.69Å; T244-S280 PolarHBondContact O-OG 3.06Å; T244-H281 PolarHBondContact N-ND1 2.94Å; T244-H281 PolarHBondContact O-N 2.9Å
245	H	90	Very high	87.6	Confident	40 Å²	40	45.7 Å²	45.7	19%	0.185	23%	0.232	C	C	.	.			trans	-99.1	76	176.6	-63.8	156	0	0	0	111.1	Y210 G211 E212 L248 A249 D282	Y210-H245 WeakPolarHBondContact CD2-O 3.16Å; G211-H245 PolarHBondContact O-N 2.87Å; E212-H245 PolarHBondContact O-ND1 3.04Å; H245-L248 HydrophobicContact CB-CB 3.95Å; H245-L248 HydrophobicContact CB-CD2 4.19Å; H245-A249 PolarHBondContact O-N 3.32Å; H245-D282 WeakPolarHBondContact CA-OD2 3.27Å
246	T	89.8	Confident	87.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-67.8	-40.4	-175.6	-55	0	0	0	0	112.7	Y210 A249 I250 I274 S280 D282 I329	Y210-T246 VanDerWaalsContact CE2-CA 3.46Å; Y210-T246 WeakPolarHBondContact CE2-OG1 3.16Å; Y210-T246 WeakPolarHBondContact OH-CG2 3.36Å; Y210-T246 PolarHBondContact OH-OG1 3.12Å; T246-A249 PolarHBondContact O-N 3.43Å; T246-I250 HydrophobicContact CG2-CD1 4.03Å; T246-I250 VanDerWaalsContact O-CG1 3.31Å; T246-I250 WeakPolarHBondContact O-CG1 3.46Å; T246-I250 PolarHBondContact O-N 2.83Å; T246-I274 HydrophobicContact CG2-CG2 4.22Å; T246-S280 WeakPolarHBondContact CB-OG 3.07Å; T246-S280 PolarHBondContact N-OG 2.94Å; T246-S280 PolarHBondContact OG1-OG 3.22Å; T246-D282 PolarHBondContact N-OD1 3.5Å; T246-I329 HydrophobicContact CG2-CD1 4.06Å
247	F	91.4	Very high	87.5	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-73.5	-34.8	-178.2	-68.3	-75.2	0	0	0	112.1	A249 I250 D251 D282 H283 L285 Q286 V289 I290 E325 I329	F247-A249 VanDerWaalsContact C-N 3.32Å; F247-A249 PolarHBondContact O-N 3.01Å; F247-I250 HydrophobicContact CD1-CD1 4.4Å; F247-I250 PolarHBondContact O-N 2.86Å; F247-D251 PolarHBondContact O-N 2.81Å; F247-D282 WeakPolarHBondContact CD2-OD1 3.35Å; F247-D282 PolarHBondContact N-OD1 3.28Å; F247-D282 PolarHBondContact N-OD2 3.21Å; F247-H283 HydrophobicContact CE2-CB 4.44Å; F247-L285 HydrophobicContact CB-CB 4.02Å; F247-Q286 HydrophobicContact CD1-CB 4.19Å; F247-Q286 VanDerWaalsContact CE1-CA 3.48Å; F247-Q286 HydrophobicContact CE1-CB 3.6Å; F247-Q286 HydrophobicContact CE1-CG 3.62Å; F247-Q286 HydrophobicContact CE2-CB 4.06Å; F247-Q286 HydrophobicContact CZ-CB 3.53Å; F247-Q286 HydrophobicContact CZ-CG 3.58Å; F247-V289 HydrophobicContact CB-CG2 4.49Å; F247-I290 HydrophobicContact CE1-CD1 4.35Å; F247-I290 HydrophobicContact CE1-CG1 4.18Å; F247-E325 HydrophobicContact CZ-CG 4.46Å; F247-I329 HydrophobicContact CE1-CD1 4.12Å; F247-I329 HydrophobicContact CE1-CG1 3.81Å; F247-I329 HydrophobicContact CZ-CD1 3.96Å; F247-I329 HydrophobicContact CZ-CG1 3.94Å
248	L	90.9	Very high	87.7	Confident	67 Å²	67	38.5 Å²	38.5	35%	0.351	20%	0.195	S	C	.	.	H	α-helix	trans	-59.8	-42.5	169	-179.5	63.5	0	0	0	111.6	V214 H245 D251 T252 D282	V214-L248 HydrophobicContact CG2-CD2 4.46Å; V214-L248 HydrophobicContact CG2-CG 4.19Å; H245-L248 HydrophobicContact CB-CB 3.95Å; H245-L248 HydrophobicContact CB-CD2 4.19Å; L248-D251 PolarHBondContact O-N 2.82Å; L248-T252 WeakPolarHBondContact O-CB 3.34Å; L248-T252 PolarHBondContact O-N 2.94Å; L248-T252 PolarHBondContact O-OG1 3.05Å; L248-D282 WeakPolarHBondContact CB-OD2 3.19Å; L248-D282 PolarHBondContact N-OD2 2.89Å
249	A	90.9	Very high	87.8	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-65.3	-41.6	178.6	0	0	0	0	0	112.5	V172 Y210 V214 H245 T246 F247 T252 A253	V172-A249 HydrophobicContact CG1-CB 3.79Å; Y210-A249 HydrophobicContact CD1-CB 3.55Å; Y210-A249 HydrophobicContact CD2-CB 3.75Å; Y210-A249 HydrophobicContact CE1-CB 4.13Å; Y210-A249 HydrophobicContact CE2-CB 4.3Å; Y210-A249 HydrophobicContact CG-CB 3.33Å; V214-A249 HydrophobicContact CG2-CB 4.07Å; H245-A249 PolarHBondContact O-N 3.32Å; T246-A249 PolarHBondContact O-N 3.43Å; F247-A249 VanDerWaalsContact C-N 3.32Å; F247-A249 PolarHBondContact O-N 3.01Å; A249-T252 PolarHBondContact O-N 2.81Å; A249-A253 VanDerWaalsContact O-CB 3.32Å; A249-A253 WeakPolarHBondContact O-CB 3.3Å; A249-A253 PolarHBondContact O-N 2.95Å
250	I	93.1	Very high	87.9	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.2	-47	175.5	-67.4	165.1	0	0	0	110.7	T246 F247 T252 A253 R254 M272 I274 V289 I329	T246-I250 HydrophobicContact CG2-CD1 4.03Å; T246-I250 VanDerWaalsContact O-CG1 3.31Å; T246-I250 WeakPolarHBondContact O-CG1 3.46Å; T246-I250 PolarHBondContact O-N 2.83Å; F247-I250 HydrophobicContact CD1-CD1 4.4Å; F247-I250 PolarHBondContact O-N 2.86Å; I250-T252 PolarHBondContact O-N 2.84Å; I250-A253 PolarHBondContact O-N 2.82Å; I250-R254 WeakPolarHBondContact O-CB 3.46Å; I250-R254 PolarHBondContact O-N 3.46Å; I250-M272 HydrophobicContact CB-SD 4.43Å; I250-M272 HydrophobicContact CG1-SD 4.31Å; I250-M272 HydrophobicContact CG2-CE 4.31Å; I250-M272 HydrophobicContact CG2-SD 3.94Å; I250-I274 HydrophobicContact CD1-CG1 4.33Å; I250-I274 HydrophobicContact CG1-CG1 4.11Å; I250-V289 HydrophobicContact CB-CG1 4.02Å; I250-V289 HydrophobicContact CG2-CG1 3.6Å; I250-I329 HydrophobicContact CD1-CD1 4.22Å; I250-I329 HydrophobicContact CD1-CG1 4.39Å; I250-I329 HydrophobicContact CD1-CG2 3.65Å
251	D	92.9	Very high	88.2	Confident	25 Å²	25	48 Å²	48	13%	0.134	24%	0.24	C	C	.	.	H	α-helix	trans	-66.2	-38.4	179.7	-171.1	45.3	0	0	0	112.1	F247 L248 R254 K255 V289	F247-D251 PolarHBondContact O-N 2.81Å; L248-D251 PolarHBondContact O-N 2.82Å; D251-R254 PolarHBondContact O-N 2.87Å; D251-R254 IonicContact OD1-CZ 3.53Å; D251-R254 IonicContact OD1-NE 2.76Å; D251-R254 PolarHBondContact OD1-NE 2.97Å; D251-R254 IonicContact OD1-NH2 2.63Å; D251-R254 PolarHBondContact OD1-NH2 2.8Å; D251-K255 WeakPolarHBondContact O-CB 3.37Å; D251-K255 WeakPolarHBondContact O-CG 3.48Å; D251-K255 PolarHBondContact O-N 3.45Å; D251-K255 WeakPolarHBondContact OD1-CE 3.25Å; D251-K255 IonicContact OD1-NZ 3.78Å; D251-K255 PolarHBondContact OD1-NZ 3.04Å; D251-K255 WeakPolarHBondContact OD2-CE 3.43Å; D251-K255 IonicContact OD2-NZ 3.33Å; D251-K255 PolarHBondContact OD2-NZ 3.46Å; D251-V289 HydrophobicContact CB-CG1 3.96Å; D251-V289 HydrophobicContact CB-CG2 4.02Å
252	T	91.6	Very high	88.5	Confident	21 Å²	21	50.5 Å²	50.5	13%	0.129	25%	0.245	C	C	.	.	H	α-helix	trans	-65.4	-42.6	174.8	-53.9	0	0	0	0	111	V214 L248 A249 I250 R254 K255 E256	V214-T252 HydrophobicContact CB-CG2 4.2Å; V214-T252 HydrophobicContact CG1-CG2 3.86Å; L248-T252 WeakPolarHBondContact O-CB 3.34Å; L248-T252 PolarHBondContact O-N 2.94Å; L248-T252 PolarHBondContact O-OG1 3.05Å; A249-T252 PolarHBondContact O-N 2.81Å; I250-T252 PolarHBondContact O-N 2.84Å; T252-R254 VanDerWaalsContact C-N 3.31Å; T252-R254 PolarHBondContact O-N 2.83Å; T252-K255 PolarHBondContact O-N 3.29Å; T252-E256 HydrophobicContact CG2-CG 4.24Å; T252-E256 WeakPolarHBondContact O-CA 3.4Å; T252-E256 VanDerWaalsContact O-CB 3.3Å; T252-E256 WeakPolarHBondContact O-CB 3.31Å; T252-E256 PolarHBondContact O-N 2.87Å
253	A	92.1	Very high	88.9	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.217	C	C	.	.	I	π-helix	trans	-61.8	-40.5	175.4	0	0	0	0	0	111.6	V170 V172 A249 I250 A257 F258 M272	V170-A253 HydrophobicContact CG1-CB 4.42Å; V172-A253 HydrophobicContact CG2-CB 3.7Å; A249-A253 VanDerWaalsContact O-CB 3.32Å; A249-A253 WeakPolarHBondContact O-CB 3.3Å; A249-A253 PolarHBondContact O-N 2.95Å; I250-A253 PolarHBondContact O-N 2.82Å; A253-A257 HydrophobicContact CB-CB 4.45Å; A253-A257 WeakPolarHBondContact O-CA 3.48Å; A253-A257 WeakPolarHBondContact O-CB 3.42Å; A253-A257 PolarHBondContact O-N 3.49Å; A253-F258 WeakPolarHBondContact O-CD2 3.47Å; A253-F258 PolarHBondContact O-N 3.31Å; A253-M272 HydrophobicContact CB-CE 3.74Å; A253-M272 HydrophobicContact CB-SD 4.49Å
254	R	93.2	Very high	89.1	Confident	33 Å²	33	42.2 Å²	42.2	13%	0.125	20%	0.204	C	C	.	.	I	π-helix	trans	-63.6	-52.4	174.5	-177.6	-175	73.9	98.3	-4	112.4	I250 D251 T252 E292 D296 I298	I250-R254 WeakPolarHBondContact O-CB 3.46Å; I250-R254 PolarHBondContact O-N 3.46Å; D251-R254 PolarHBondContact O-N 2.87Å; D251-R254 IonicContact OD1-CZ 3.53Å; D251-R254 IonicContact OD1-NE 2.76Å; D251-R254 PolarHBondContact OD1-NE 2.97Å; D251-R254 IonicContact OD1-NH2 2.63Å; D251-R254 PolarHBondContact OD1-NH2 2.8Å; T252-R254 VanDerWaalsContact C-N 3.31Å; T252-R254 PolarHBondContact O-N 2.83Å; R254-E292 IonicContact CZ-OE2 3.31Å; R254-E292 VanDerWaalsContact CZ-OE2 3.28Å; R254-E292 IonicContact NE-OE2 3.33Å; R254-E292 IonicContact NH1-OE2 2.78Å; R254-E292 IonicContact NH2-OE2 3.76Å; R254-E292 PolarHBondContact NH2-OE2 3.21Å; R254-D296 WeakPolarHBondContact CD-OD2 3.42Å; R254-D296 WeakPolarHBondContact CG-OD2 3.35Å; R254-D296 IonicContact CZ-OD2 3.85Å; R254-D296 IonicContact NE-OD2 3.48Å; R254-D296 IonicContact NH1-OD2 2.7Å; R254-D296 PolarHBondContact NH1-OD2 2.76Å; R254-I298 HydrophobicContact CB-CD1 4.18Å; R254-I298 HydrophobicContact CG-CD1 3.73Å
255	K	90.8	Very high	89.2	Confident	119 Å²	119	43.3 Å²	43.3	52%	0.517	21%	0.207	S	C	.	.	I	π-helix	trans	-74.3	-30.3	-174.7	-74.8	177.7	177.7	156.8	0	114.1	D251 T252 T259	D251-K255 WeakPolarHBondContact O-CB 3.37Å; D251-K255 WeakPolarHBondContact O-CG 3.48Å; D251-K255 PolarHBondContact O-N 3.45Å; D251-K255 WeakPolarHBondContact OD1-CE 3.25Å; D251-K255 IonicContact OD1-NZ 3.78Å; D251-K255 PolarHBondContact OD1-NZ 3.04Å; D251-K255 WeakPolarHBondContact OD2-CE 3.43Å; D251-K255 IonicContact OD2-NZ 3.33Å; D251-K255 PolarHBondContact OD2-NZ 3.46Å; T252-K255 PolarHBondContact O-N 3.29Å; K255-T259 WeakPolarHBondContact O-CG2 3.48Å
256	E	90.8	Very high	88.6	Confident	84 Å²	84	46.4 Å²	46.4	39%	0.393	23%	0.234	S	C	.	.	I	π-helix	trans	-113.3	-50.4	-174.5	-60.2	-166.3	-156.1	0	0	113.1	H216 T252 T259 R262	H216-E256 IonicContact NE2-OE2 2.73Å; T252-E256 HydrophobicContact CG2-CG 4.24Å; T252-E256 WeakPolarHBondContact O-CA 3.4Å; T252-E256 VanDerWaalsContact O-CB 3.3Å; T252-E256 WeakPolarHBondContact O-CB 3.31Å; T252-E256 PolarHBondContact O-N 2.87Å; E256-T259 WeakPolarHBondContact O-CB 3.48Å; E256-T259 WeakPolarHBondContact O-CG2 3.47Å; E256-T259 PolarHBondContact O-N 3.49Å; E256-T259 PolarHBondContact O-OG1 3.03Å; E256-R262 VanDerWaalsContact O-CD 3.28Å; E256-R262 WeakPolarHBondContact O-CD 3.42Å; E256-R262 IonicContact OE2-CZ 3.57Å; E256-R262 IonicContact OE2-NH2 3.62Å; E256-R262 PolarHBondContact OE2-NH2 3.48Å
257	A	88.1	Confident	88	Confident	6 Å²	6	51.8 Å²	51.8	5%	0.05	26%	0.262	C	S	.	.	I	π-helix	trans	-69.7	-38.2	-172.6	0	0	0	0	0	112.5	V170 V208 L220 A253 T259	V170-A257 HydrophobicContact CG1-CB 3.94Å; V170-A257 HydrophobicContact CG2-CB 4.14Å; V208-A257 HydrophobicContact CG2-CB 4.3Å; L220-A257 WeakPolarHBondContact CD1-O 3.09Å; A253-A257 HydrophobicContact CB-CB 4.45Å; A253-A257 WeakPolarHBondContact O-CA 3.48Å; A253-A257 WeakPolarHBondContact O-CB 3.42Å; A253-A257 PolarHBondContact O-N 3.49Å; A257-T259 PolarHBondContact O-N 2.97Å
258	F	90.4	Very high	87.4	Confident	13 Å²	13	52.2 Å²	52.2	6%	0.057	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	27.5	178	-71.6	-71.7	0	0	0	114.3	D168 V170 L220 A253 A264 K270 M272 I298	D168-F258 HydrophobicContact CB-CE1 4.31Å; V170-F258 HydrophobicContact CB-CE1 4.35Å; V170-F258 HydrophobicContact CB-CE2 3.91Å; V170-F258 HydrophobicContact CB-CZ 3.67Å; V170-F258 HydrophobicContact CG2-CD1 4.19Å; V170-F258 HydrophobicContact CG2-CD2 4.35Å; V170-F258 HydrophobicContact CG2-CE1 3.64Å; V170-F258 HydrophobicContact CG2-CE2 3.83Å; V170-F258 HydrophobicContact CG2-CZ 3.45Å; V170-F258 VanDerWaalsContact CG2-CZ 3.45Å; L220-F258 HydrophobicContact CD1-CD1 4.3Å; A253-F258 WeakPolarHBondContact O-CD2 3.47Å; A253-F258 PolarHBondContact O-N 3.31Å; F258-A264 WeakPolarHBondContact O-CB 3.3Å; F258-K270 HydrophobicContact CB-CD 4.38Å; F258-K270 HydrophobicContact CD1-CB 3.94Å; F258-K270 HydrophobicContact CD1-CD 3.94Å; F258-K270 HydrophobicContact CD1-CG 3.78Å; F258-K270 HydrophobicContact CE1-CB 3.67Å; F258-K270 HydrophobicContact CE1-CG 4Å; F258-K270 HydrophobicContact CG-CD 4.27Å; F258-K270 HydrophobicContact CZ-CB 4.25Å; F258-M272 HydrophobicContact CD2-CE 4.37Å; F258-M272 HydrophobicContact CE2-CB 4.3Å; F258-M272 HydrophobicContact CE2-CE 3.81Å; F258-M272 HydrophobicContact CZ-CB 4.43Å; F258-I298 HydrophobicContact CD2-CD1 3.87Å; F258-I298 HydrophobicContact CE2-CD1 4.19Å; F258-I298 HydrophobicContact CE2-CG2 4.09Å; F258-I298 HydrophobicContact CG-CD1 4.42Å; F258-I298 HydrophobicContact CZ-CG2 4.3Å
259	T	88.6	Confident	87.1	Confident	40 Å²	40	52.2 Å²	52.2	25%	0.245	26%	0.263	C	S	.	.	S	Bend	trans	-93.7	150.1	176	60.8	0	0	0	0	112.1	K255 E256 A257 E261 R262 G263 A264	K255-T259 WeakPolarHBondContact O-CG2 3.48Å; E256-T259 WeakPolarHBondContact O-CB 3.48Å; E256-T259 WeakPolarHBondContact O-CG2 3.47Å; E256-T259 PolarHBondContact O-N 3.49Å; E256-T259 PolarHBondContact O-OG1 3.03Å; A257-T259 PolarHBondContact O-N 2.97Å; T259-E261 PolarHBondContact O-N 2.85Å; T259-R262 CarbonylContact O-C 3.42Å; T259-R262 PolarHBondContact O-N 2.85Å; T259-R262 VanDerWaalsContact O-N 3.1Å; T259-R262 PolarHBondContact OG1-N 2.88Å; T259-G263 PolarHBondContact O-N 2.87Å; T259-A264 VanDerWaalsContact O-CB 3.26Å; T259-A264 WeakPolarHBondContact O-CB 3.34Å; T259-A264 PolarHBondContact O-N 2.92Å
260	Q	84.6	Confident	87	Confident	152 Å²	152	55 Å²	55	71%	0.71	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-60.7	-34.2	174.9	-71.3	-177.6	-13.1	0	0	112.1	R262 G263	Q260-R262 PolarHBondContact O-N 2.89Å; Q260-G263 PolarHBondContact O-N 3.08Å
261	E	83.3	Confident	86.9	Confident	193 Å²	193	55 Å²	55	90%	0.902	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-61.6	-30.5	176.5	-63.1	-174.7	179	0	0	112.6	T259	T259-E261 PolarHBondContact O-N 2.85Å
262	R	84.9	Confident	87	Confident	65 Å²	65	53.8 Å²	53.8	25%	0.245	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-99.5	17.7	175	-63.8	-161.9	-174.5	-128.9	14.6	113.4	N219 L220 E256 T259 Q260	N219-R262 HydrophobicContact CB-CB 4.44Å; N219-R262 PolarHBondContact OD1-NH1 2.78Å; L220-R262 CarbonylContact C-O 3.59Å; L220-R262 VanDerWaalsContact C-O 3.32Å; L220-R262 VanDerWaalsContact CA-O 3.28Å; L220-R262 WeakPolarHBondContact CA-O 3.4Å; L220-R262 WeakPolarHBondContact CB-O 3.28Å; L220-R262 PolarHBondContact N-O 3.02Å; L220-R262 CarbonylContact O-C 3Å; E256-R262 VanDerWaalsContact O-CD 3.28Å; E256-R262 WeakPolarHBondContact O-CD 3.42Å; E256-R262 IonicContact OE2-CZ 3.57Å; E256-R262 IonicContact OE2-NH2 3.62Å; E256-R262 PolarHBondContact OE2-NH2 3.48Å; T259-R262 CarbonylContact O-C 3.42Å; T259-R262 PolarHBondContact O-N 2.85Å; T259-R262 VanDerWaalsContact O-N 3.1Å; T259-R262 PolarHBondContact OG1-N 2.88Å; Q260-R262 PolarHBondContact O-N 2.89Å
263	G	82.6	Confident	87.1	Confident	12 Å²	12	52.8 Å²	52.8	12%	0.124	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.8	4.3	170	0	0	0	0	0	116.4	Q204 S221 T259 Q260	Q204-G263 PolarHBondContact OE1-O 2.89Å; S221-G263 WeakPolarHBondContact OG-CA 3.28Å; T259-G263 PolarHBondContact O-N 2.87Å; Q260-G263 PolarHBondContact O-N 3.08Å
264	A	86.1	Confident	87.2	Confident	9 Å²	9	52.9 Å²	52.9	7%	0.074	26%	0.263	C	S	.	.			trans	-69.2	139.2	178	0	0	0	0	0	112	D168 L220 F258 T259	D168-A264 WeakPolarHBondContact OD2-CA 3.42Å; L220-A264 HydrophobicContact CD1-CB 3.74Å; F258-A264 WeakPolarHBondContact O-CB 3.3Å; T259-A264 VanDerWaalsContact O-CB 3.26Å; T259-A264 WeakPolarHBondContact O-CB 3.34Å; T259-A264 PolarHBondContact O-N 2.92Å
265	R	86.7	Confident	87.2	Confident	31 Å²	31	51.3 Å²	51.3	12%	0.117	26%	0.257	C	S	.	.			trans	-101	138	-177.8	-68.2	174	-68.6	179.2	2.6	110.6	M167 D168 P200 Q202 D267 A268	M167-R265 VanDerWaalsContact C-NH2 3.34Å; M167-R265 PolarHBondContact O-NH2 2.71Å; D168-R265 IonicContact OD1-CZ 3.51Å; D168-R265 VanDerWaalsContact OD1-CZ 3.28Å; D168-R265 IonicContact OD1-NE 2.89Å; D168-R265 PolarHBondContact OD1-NE 2.8Å; D168-R265 IonicContact OD1-NH2 3.58Å; D168-R265 PolarHBondContact OD1-NH2 3.44Å; D168-R265 PolarHBondContact OD2-N 3.41Å; P200-R265 PolarHBondContact O-NH1 2.88Å; P200-R265 VanDerWaalsContact O-NH1 3.12Å; Q202-R265 VanDerWaalsContact O-CZ 3.29Å; Q202-R265 PolarHBondContact O-NH1 2.88Å; Q202-R265 PolarHBondContact O-NH2 2.96Å; R265-D267 VanDerWaalsContact C-N 3.33Å; R265-A268 HydrophobicContact CB-CB 3.68Å
266	S	78.4	Confident	87.2	Confident	105 Å²	105	45.6 Å²	45.6	73%	0.734	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-24.2	179.9	51.3	0	0	0	0	113.4
267	D	76.6	Confident	87	Confident	112 Å²	112	41.6 Å²	41.6	60%	0.599	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-0.3	179	64.9	-52.1	0	0	0	113.4	N166 R265	N166-D267 PolarHBondContact ND2-OD2 3.15Å; R265-D267 VanDerWaalsContact C-N 3.33Å
268	A	80	Confident	86.7	Confident	10 Å²	10	41.7 Å²	41.7	8%	0.083	22%	0.215	C	C	.	.	S	Bend	trans	-96.7	146.4	-179.6	0	0	0	0	0	112.2	N166 R265	N166-A268 HydrophobicContact CB-CB 3.92Å; N166-A268 VanDerWaalsContact O-CA 3.26Å; N166-A268 WeakPolarHBondContact O-CA 3.38Å; N166-A268 WeakPolarHBondContact O-CB 3.27Å; R265-A268 HydrophobicContact CB-CB 3.68Å
269	K	83.3	Confident	86.4	Confident	66 Å²	66	43.4 Å²	43.4	29%	0.287	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	130.7	169.6	-71.3	-171.8	177.6	-173.9	0	109.9	N166 M167 D168 L361 T364	N166-K269 PolarHBondContact O-N 2.76Å; M167-K269 WeakPolarHBondContact CA-O 3.27Å; M167-K269 HydrophobicContact CG-CB 4.22Å; D168-K269 PolarHBondContact N-O 2.91Å; K269-L361 HydrophobicContact CD-CB 4.42Å; K269-L361 WeakPolarHBondContact CD-O 3.28Å; K269-L361 WeakPolarHBondContact CE-O 3.11Å; K269-L361 PolarHBondContact NZ-O 2.84Å; K269-T364 PolarHBondContact NZ-O 3.44Å
270	K	89.7	Confident	86.2	Confident	59 Å²	59	42 Å²	42	26%	0.257	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	119.9	-179.4	-63.2	177.1	-173.9	175.4	0	110.4	F258 I298 E299	F258-K270 HydrophobicContact CB-CD 4.38Å; F258-K270 HydrophobicContact CD1-CB 3.94Å; F258-K270 HydrophobicContact CD1-CD 3.94Å; F258-K270 HydrophobicContact CD1-CG 3.78Å; F258-K270 HydrophobicContact CE1-CB 3.67Å; F258-K270 HydrophobicContact CE1-CG 4Å; F258-K270 HydrophobicContact CG-CD 4.27Å; F258-K270 HydrophobicContact CZ-CB 4.25Å; K270-I298 HydrophobicContact CB-CG1 4.16Å; K270-I298 HydrophobicContact CD-CG1 4.11Å; K270-E299 PolarHBondContact O-N 2.89Å
271	V	90.8	Very high	86.1	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	125.6	-178.4	-179.1	0	0	0	0	109.8	M167 D168 I169 V170 V273 E299 F301 I358 L361	M167-V271 HydrophobicContact SD-CG2 4.11Å; D168-V271 PolarHBondContact O-N 3.13Å; I169-V271 CarbonylContact C-O 3.56Å; I169-V271 WeakPolarHBondContact CA-O 3.15Å; I169-V271 HydrophobicContact CG1-CB 4.33Å; V170-V271 PolarHBondContact N-O 2.72Å; V271-V273 HydrophobicContact CG1-CG2 4.44Å; V271-E299 CarbonylContact C-O 3.53Å; V271-E299 WeakPolarHBondContact CA-O 3.43Å; V271-F301 HydrophobicContact CG1-CD2 3.78Å; V271-F301 HydrophobicContact CG1-CE2 3.77Å; V271-I358 HydrophobicContact CG1-CD1 4.23Å; V271-I358 HydrophobicContact CG1-CG1 4.33Å; V271-I358 HydrophobicContact CG1-CG2 4.35Å; V271-L361 HydrophobicContact CG2-CD1 4.1Å
272	M	93.9	Very high	86.2	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	127.9	176.3	-171.1	-173.2	-70.1	0	0	109.9	V170 V172 I250 A253 F258 I274 I298 E299 R300 F301	V170-M272 CarbonylContact O-C 3.42Å; V170-M272 WeakPolarHBondContact O-CA 3.19Å; V172-M272 HydrophobicContact CG2-CG 3.77Å; V172-M272 HydrophobicContact CG2-SD 4Å; I250-M272 HydrophobicContact CB-SD 4.43Å; I250-M272 HydrophobicContact CG1-SD 4.31Å; I250-M272 HydrophobicContact CG2-CE 4.31Å; I250-M272 HydrophobicContact CG2-SD 3.94Å; A253-M272 HydrophobicContact CB-CE 3.74Å; A253-M272 HydrophobicContact CB-SD 4.49Å; F258-M272 HydrophobicContact CD2-CE 4.37Å; F258-M272 HydrophobicContact CE2-CB 4.3Å; F258-M272 HydrophobicContact CE2-CE 3.81Å; F258-M272 HydrophobicContact CZ-CB 4.43Å; M272-I274 HydrophobicContact CB-CD1 4.28Å; M272-I274 HydrophobicContact CG-CD1 3.79Å; M272-I274 HydrophobicContact CG-CG1 4.13Å; M272-I274 HydrophobicContact SD-CD1 3.87Å; M272-I274 HydrophobicContact SD-CG1 4.03Å; M272-I298 HydrophobicContact CB-CG2 3.8Å; M272-I298 HydrophobicContact CE-CG2 4.29Å; M272-E299 PolarHBondContact N-O 2.78Å; M272-R300 HydrophobicContact CB-CG 4.25Å; M272-R300 CarbonylContact O-C 3.53Å; M272-R300 WeakPolarHBondContact O-CA 3.21Å; M272-F301 PolarHBondContact O-N 2.89Å
273	V	94.2	Very high	86	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	111.1	176.8	-177.6	0	0	0	0	108.9	I169 V170 F171 V172 V271 F301 I303 L354 I358	I169-V273 HydrophobicContact CG2-CG2 4.38Å; V170-V273 PolarHBondContact O-N 3.13Å; F171-V273 HydrophobicContact CD1-CB 3.69Å; F171-V273 HydrophobicContact CD1-CG1 3.84Å; F171-V273 HydrophobicContact CD1-CG2 4.33Å; F171-V273 HydrophobicContact CE1-CB 3.8Å; F171-V273 HydrophobicContact CE1-CG1 3.77Å; F171-V273 HydrophobicContact CE1-CG2 4.02Å; F171-V273 HydrophobicContact CG-CB 4.43Å; F171-V273 HydrophobicContact CZ-CG2 4.41Å; V172-V273 PolarHBondContact N-O 2.84Å; V271-V273 HydrophobicContact CG1-CG2 4.44Å; V273-F301 HydrophobicContact CG2-CB 4.4Å; V273-I303 HydrophobicContact CG1-CD1 3.81Å; V273-L354 HydrophobicContact CG1-CD2 3.89Å; V273-I358 HydrophobicContact CG2-CD1 3.75Å
274	I	94.2	Very high	86.1	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	125.6	-177.4	-53.2	88.9	0	0	0	109.2	V172 T246 I250 M272 R300 F301 I303 I329	V172-I274 HydrophobicContact CB-CG1 4.38Å; V172-I274 WeakPolarHBondContact O-CA 3.27Å; T246-I274 HydrophobicContact CG2-CG2 4.22Å; I250-I274 HydrophobicContact CD1-CG1 4.33Å; I250-I274 HydrophobicContact CG1-CG1 4.11Å; M272-I274 HydrophobicContact CB-CD1 4.28Å; M272-I274 HydrophobicContact CG-CD1 3.79Å; M272-I274 HydrophobicContact CG-CG1 4.13Å; M272-I274 HydrophobicContact SD-CD1 3.87Å; M272-I274 HydrophobicContact SD-CG1 4.03Å; I274-R300 HydrophobicContact CD1-CB 3.91Å; I274-R300 HydrophobicContact CD1-CG 4.34Å; I274-F301 PolarHBondContact N-O 3.39Å; I274-I303 PolarHBondContact O-N 2.99Å; I274-I329 HydrophobicContact CD1-CG2 4.12Å; I274-I329 HydrophobicContact CG1-CG2 4.29Å
275	L	93.4	Very high	86.2	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	123.7	178	-172.8	159.2	0	0	0	109.9	V172 L173 D174 I179 I185 F188 I303 V305 L347	V172-L275 PolarHBondContact O-N 2.82Å; L173-L275 HydrophobicContact CD2-CB 4.07Å; D174-L275 WeakPolarHBondContact CB-O 3.29Å; D174-L275 PolarHBondContact N-O 2.82Å; I179-L275 HydrophobicContact CD1-CD2 4.49Å; I185-L275 HydrophobicContact CD1-CD1 4Å; I185-L275 HydrophobicContact CD1-CD2 3.55Å; I185-L275 HydrophobicContact CD1-CG 4.46Å; F188-L275 HydrophobicContact CD1-CD1 4.22Å; F188-L275 HydrophobicContact CE1-CD1 4.16Å; L275-I303 HydrophobicContact CB-CB 4.42Å; L275-I303 HydrophobicContact CG-CB 4.35Å; L275-I303 HydrophobicContact CG-CG2 4.35Å; L275-V305 HydrophobicContact CD2-CG2 3.98Å; L275-V305 HydrophobicContact CG-CG2 4.18Å; L275-L347 HydrophobicContact CD1-CD1 4.12Å; L275-L347 HydrophobicContact CD1-CD2 3.91Å
276	T	91.3	Very high	86.2	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	155.5	-179.9	-178.1	0	0	0	0	112.4	D174 Y210 G278 I303 V305 F322 I326	D174-T276 PolarHBondContact OD2-OG1 3.07Å; Y210-T276 WeakPolarHBondContact OH-CB 3.16Å; T276-G278 PolarHBondContact OG1-O 2.82Å; T276-I303 PolarHBondContact N-O 2.74Å; T276-V305 PolarHBondContact O-N 2.81Å; T276-F322 HydrophobicContact CG2-CE2 4.15Å; T276-F322 HydrophobicContact CG2-CZ 4.35Å; T276-I326 HydrophobicContact CG2-CD1 3.29Å; T276-I326 HydrophobicContact CG2-CG1 4.11Å
277	D	85.9	Confident	86.5	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.216	C	C	.	.	S	Bend	trans	-117.3	7	178.7	76.8	-23.2	0	0	0	115	S178 I179 V305 Y309	S178-D277 VanDerWaalsContact CB-OD2 3.27Å; S178-D277 WeakPolarHBondContact CB-OD2 3.33Å; S178-D277 VanDerWaalsContact O-OD2 3.08Å; S178-D277 PolarHBondContact OG-OD1 2.84Å; S178-D277 PolarHBondContact OG-OD2 2.66Å; I179-D277 WeakPolarHBondContact CA-OD2 2.84Å; I179-D277 HydrophobicContact CD1-CB 3.39Å; I179-D277 HydrophobicContact CG1-CB 4.29Å; I179-D277 PolarHBondContact N-OD2 2.79Å; I179-D277 VanDerWaalsContact N-OD2 3.14Å; D277-V305 VanDerWaalsContact CA-O 3.29Å; D277-V305 WeakPolarHBondContact CA-O 3.26Å; D277-V305 HydrophobicContact CB-CB 4Å; D277-V305 WeakPolarHBondContact CB-O 3.46Å; D277-Y309 VanDerWaalsContact O-CE2 3.22Å; D277-Y309 WeakPolarHBondContact O-CE2 3.44Å
278	G	81.9	Confident	87.1	Confident	8 Å²	8	47.2 Å²	47.2	8%	0.082	22%	0.215	C	C	.	.	S	Bend	trans	-149.4	154.8	-174.4	0	0	0	0	0	114.1	T276 F322	T276-G278 PolarHBondContact OG1-O 2.82Å; G278-F322 VanDerWaalsContact C-CE2 3.44Å; G278-F322 VanDerWaalsContact O-CE2 3.32Å; G278-F322 WeakPolarHBondContact O-CE2 3.33Å
279	E	83.3	Confident	87.6	Confident	49 Å²	49	47 Å²	47	23%	0.229	21%	0.213	C	C	.	.			trans	-58.5	137.9	170.3	-78.6	176	-143.1	0	0	111.4	Y309 K321 F322	E279-Y309 PolarHBondContact N-OH 3.25Å; E279-K321 WeakPolarHBondContact OE2-CE 3.47Å; E279-K321 IonicContact OE2-NZ 2.84Å; E279-K321 PolarHBondContact OE2-NZ 3.39Å; E279-F322 HydrophobicContact CG-CB 4.09Å; E279-F322 HydrophobicContact CG-CD2 4.34Å
280	S	85.4	Confident	88	Confident	11 Å²	11	44.8 Å²	44.8	8%	0.077	20%	0.204	C	C	.	.			trans	-74.9	139.3	-179.4	-153.7	0	0	0	0	112.7	T244 T246 D282 E325	T244-S280 PolarHBondContact O-OG 3.06Å; T246-S280 WeakPolarHBondContact CB-OG 3.07Å; T246-S280 PolarHBondContact N-OG 2.94Å; T246-S280 PolarHBondContact OG1-OG 3.22Å; S280-D282 WeakPolarHBondContact CB-OD1 3.5Å; S280-D282 PolarHBondContact O-N 2.77Å; S280-D282 PolarHBondContact OG-OD1 2.91Å; S280-E325 WeakPolarHBondContact CB-OE1 3.28Å; S280-E325 PolarHBondContact N-OE1 3.21Å
281	H	82.6	Confident	87.9	Confident	117 Å²	117	43.3 Å²	43.3	54%	0.542	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-7.4	177.6	-68.4	71.4	0	0	0	113	T244	T244-H281 PolarHBondContact N-ND1 2.94Å; T244-H281 PolarHBondContact O-N 2.9Å
282	D	84.6	Confident	87.9	Confident	6 Å²	6	45.9 Å²	45.9	3%	0.032	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	27.7	-179.6	63.7	-5.2	0	0	0	113.2	H245 T246 F247 L248 S280 Y284 L285	H245-D282 WeakPolarHBondContact CA-OD2 3.27Å; T246-D282 PolarHBondContact N-OD1 3.5Å; F247-D282 WeakPolarHBondContact CD2-OD1 3.35Å; F247-D282 PolarHBondContact N-OD1 3.28Å; F247-D282 PolarHBondContact N-OD2 3.21Å; L248-D282 WeakPolarHBondContact CB-OD2 3.19Å; L248-D282 PolarHBondContact N-OD2 2.89Å; S280-D282 WeakPolarHBondContact CB-OD1 3.5Å; S280-D282 PolarHBondContact O-N 2.77Å; S280-D282 PolarHBondContact OG-OD1 2.91Å; D282-Y284 HydrophobicContact CB-CE1 4.17Å; D282-Y284 PolarHBondContact O-N 3.43Å; D282-L285 HydrophobicContact CB-CD1 4.35Å; D282-L285 PolarHBondContact O-N 2.84Å
283	H	82.1	Confident	87.8	Confident	80 Å²	80	45.9 Å²	45.9	37%	0.37	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-51.7	-25.5	-177.9	-172.9	90.9	0	0	0	115.1	F247 L285 Q286 E325	F247-H283 HydrophobicContact CE2-CB 4.44Å; H283-L285 PolarHBondContact O-N 2.82Å; H283-Q286 PolarHBondContact CE1-OE1 2.82Å; H283-Q286 VanDerWaalsContact CE1-OE1 3.24Å; H283-Q286 PolarHBondContact NE2-OE1 3.45Å; H283-Q286 VanDerWaalsContact NE2-OE1 3.15Å; H283-Q286 WeakPolarHBondContact O-CB 3.23Å; H283-Q286 PolarHBondContact O-N 2.87Å; H283-Q286 VanDerWaalsContact O-N 3.15Å; H283-E325 IonicContact CE1-OE2 2.71Å; H283-E325 IonicContact CG-OE2 2.82Å; H283-E325 IonicContact ND1-OE2 3.68Å; H283-E325 PolarHBondContact ND1-OE2 3.1Å
284	Y	84.5	Confident	87.4	Confident	188 Å²	188	50 Å²	50	74%	0.737	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-63.1	-20.8	178.3	64	-87.3	0	0	0	113.8	D282	D282-Y284 HydrophobicContact CB-CE1 4.17Å; D282-Y284 PolarHBondContact O-N 3.43Å
285	L	86.8	Confident	87.1	Confident	44 Å²	44	56.9 Å²	56.9	23%	0.23	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-83.8	-7.7	177.9	-64.5	176.4	0	0	0	113.9	F247 D282 H283 K287 E288 V289	F247-L285 HydrophobicContact CB-CB 4.02Å; D282-L285 HydrophobicContact CB-CD1 4.35Å; D282-L285 PolarHBondContact O-N 2.84Å; H283-L285 PolarHBondContact O-N 2.82Å; L285-K287 PolarHBondContact O-N 2.77Å; L285-E288 PolarHBondContact O-N 2.83Å; L285-V289 HydrophobicContact CB-CG2 4.13Å; L285-V289 PolarHBondContact O-N 3.24Å; L285-V289 VanDerWaalsContact O-N 3.11Å
286	Q	86.6	Confident	86.8	Confident	42 Å²	42	59.9 Å²	59.9	20%	0.196	29%	0.287	C	S	.	.	H	α-helix	trans	-49.7	-50.2	-171.9	177.8	-164.1	7	0	0	114	F247 H283 E288 I290 S328	F247-Q286 HydrophobicContact CD1-CB 4.19Å; F247-Q286 VanDerWaalsContact CE1-CA 3.48Å; F247-Q286 HydrophobicContact CE1-CB 3.6Å; F247-Q286 HydrophobicContact CE1-CG 3.62Å; F247-Q286 HydrophobicContact CE2-CB 4.06Å; F247-Q286 HydrophobicContact CZ-CB 3.53Å; F247-Q286 HydrophobicContact CZ-CG 3.58Å; H283-Q286 PolarHBondContact CE1-OE1 2.82Å; H283-Q286 VanDerWaalsContact CE1-OE1 3.24Å; H283-Q286 PolarHBondContact NE2-OE1 3.45Å; H283-Q286 VanDerWaalsContact NE2-OE1 3.15Å; H283-Q286 WeakPolarHBondContact O-CB 3.23Å; H283-Q286 PolarHBondContact O-N 2.87Å; H283-Q286 VanDerWaalsContact O-N 3.15Å; Q286-E288 VanDerWaalsContact C-N 3.34Å; Q286-E288 PolarHBondContact O-N 3.24Å; Q286-I290 WeakPolarHBondContact O-CB 3.33Å; Q286-I290 VanDerWaalsContact O-CG1 3.23Å; Q286-I290 WeakPolarHBondContact O-CG1 3.39Å; Q286-I290 PolarHBondContact O-N 2.87Å; Q286-I290 VanDerWaalsContact O-N 3.12Å; Q286-S328 PolarHBondContact NE2-OG 3.01Å
287	K	85.4	Confident	86.6	Confident	188 Å²	188	67.7 Å²	67.7	82%	0.817	32%	0.324	S	S	*	.	H	α-helix	trans	-66.6	-36.3	-173.7	-73.2	-174.1	179.7	178.6	0	113	L285 G291	L285-K287 PolarHBondContact O-N 2.77Å; K287-G291 PolarHBondContact O-N 2.82Å
288	E	89.5	Confident	86.7	Confident	123 Å²	123	67.8 Å²	67.8	58%	0.575	32%	0.324	S	S	*	.	H	α-helix	trans	-73.1	-55.6	-179	-175.3	175.8	178.8	0	0	109.8	L285 Q286 I290 G291 E292	L285-E288 PolarHBondContact O-N 2.83Å; Q286-E288 VanDerWaalsContact C-N 3.34Å; Q286-E288 PolarHBondContact O-N 3.24Å; E288-I290 PolarHBondContact O-N 2.82Å; E288-G291 PolarHBondContact O-N 3.29Å; E288-E292 WeakPolarHBondContact O-CG 2.97Å; E288-E292 PolarHBondContact O-N 2.9Å
289	V	90.7	Very high	87	Confident	6 Å²	6	68.2 Å²	68.2	4%	0.036	32%	0.324	C	S	.	.	H	α-helix	trans	-62.2	-43.6	-175.1	176.1	0	0	0	0	112.3	F247 I250 D251 L285 E292 C293	F247-V289 HydrophobicContact CB-CG2 4.49Å; I250-V289 HydrophobicContact CB-CG1 4.02Å; I250-V289 HydrophobicContact CG2-CG1 3.6Å; D251-V289 HydrophobicContact CB-CG1 3.96Å; D251-V289 HydrophobicContact CB-CG2 4.02Å; L285-V289 HydrophobicContact CB-CG2 4.13Å; L285-V289 PolarHBondContact O-N 3.24Å; L285-V289 VanDerWaalsContact O-N 3.11Å; V289-E292 PolarHBondContact O-N 3.36Å; V289-C293 PolarHBondContact O-N 3.48Å; V289-C293 PolarHBondContact O-SG 2.92Å
290	I	91.1	Very high	87.5	Confident	18 Å²	18	66.1 Å²	66.1	9%	0.092	31%	0.314	C	S	.	.	H	α-helix	trans	-69.6	-38.3	179.4	-61	-56.8	0	0	0	111.2	F247 Q286 E288 E292 C293 D294 I329	F247-I290 HydrophobicContact CE1-CD1 4.35Å; F247-I290 HydrophobicContact CE1-CG1 4.18Å; Q286-I290 WeakPolarHBondContact O-CB 3.33Å; Q286-I290 VanDerWaalsContact O-CG1 3.23Å; Q286-I290 WeakPolarHBondContact O-CG1 3.39Å; Q286-I290 PolarHBondContact O-N 2.87Å; Q286-I290 VanDerWaalsContact O-N 3.12Å; E288-I290 PolarHBondContact O-N 2.82Å; I290-E292 VanDerWaalsContact C-N 3.32Å; I290-E292 PolarHBondContact O-N 2.84Å; I290-C293 PolarHBondContact O-N 2.92Å; I290-D294 PolarHBondContact O-N 3.23Å; I290-I329 HydrophobicContact CD1-CB 4.28Å; I290-I329 HydrophobicContact CD1-CG1 4.32Å; I290-I329 HydrophobicContact CD1-CG2 4.12Å
291	G	88	Confident	87.8	Confident	28 Å²	28	65.6 Å²	65.6	29%	0.289	31%	0.31	S	S	.	.	H	α-helix	trans	-62.4	-38.9	175.6	0	0	0	0	0	112.7	K287 E288 D294 Q295	K287-G291 PolarHBondContact O-N 2.82Å; E288-G291 PolarHBondContact O-N 3.29Å; G291-D294 PolarHBondContact O-N 3.35Å; G291-Q295 WeakPolarHBondContact O-CG 3.39Å; G291-Q295 PolarHBondContact O-N 2.96Å
292	E	91.5	Very high	88.3	Confident	54 Å²	54	60 Å²	60	25%	0.252	29%	0.285	S	S	.	.	H	α-helix	trans	-71.8	-37.1	175.5	-68.2	-174.8	152.9	0	0	112.5	R254 E288 V289 I290 D294 Q295 D296	R254-E292 IonicContact CZ-OE2 3.31Å; R254-E292 VanDerWaalsContact CZ-OE2 3.28Å; R254-E292 IonicContact NE-OE2 3.33Å; R254-E292 IonicContact NH1-OE2 2.78Å; R254-E292 IonicContact NH2-OE2 3.76Å; R254-E292 PolarHBondContact NH2-OE2 3.21Å; E288-E292 WeakPolarHBondContact O-CG 2.97Å; E288-E292 PolarHBondContact O-N 2.9Å; V289-E292 PolarHBondContact O-N 3.36Å; I290-E292 VanDerWaalsContact C-N 3.32Å; I290-E292 PolarHBondContact O-N 2.84Å; E292-D294 VanDerWaalsContact C-N 3.28Å; E292-D294 PolarHBondContact O-N 3.48Å; E292-Q295 PolarHBondContact O-N 2.87Å; E292-D296 PolarHBondContact O-N 3.24Å
293	C	90.3	Very high	88.7	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-36.4	172.7	-67.8	0	0	0	0	112.8	V289 I290 D296 H297 I298	V289-C293 PolarHBondContact O-N 3.48Å; V289-C293 PolarHBondContact O-SG 2.92Å; I290-C293 PolarHBondContact O-N 2.92Å; C293-D296 PolarHBondContact O-N 2.9Å; C293-H297 PolarHBondContact O-N 3.5Å; C293-I298 PolarHBondContact O-N 3.34Å; C293-I298 VanDerWaalsContact O-N 3.11Å
294	D	87.2	Confident	89.1	Confident	86 Å²	86	55.9 Å²	55.9	46%	0.46	27%	0.265	S	S	.	.	H	α-helix	trans	-68.2	-36.6	175.5	-73.8	-23.1	0	0	0	112	I290 G291 E292 H297 R300	I290-D294 PolarHBondContact O-N 3.23Å; G291-D294 PolarHBondContact O-N 3.35Å; E292-D294 VanDerWaalsContact C-N 3.28Å; E292-D294 PolarHBondContact O-N 3.48Å; D294-H297 PolarHBondContact O-N 2.85Å; D294-R300 IonicContact OD1-CZ 2.76Å; D294-R300 IonicContact OD1-NH1 2.68Å; D294-R300 PolarHBondContact OD1-NH1 3.31Å; D294-R300 IonicContact OD1-NH2 2.7Å; D294-R300 PolarHBondContact OD1-NH2 3.37Å; D294-R300 IonicContact OD2-NH2 3.89Å
295	Q	87.6	Confident	89.4	Confident	146 Å²	146	47 Å²	47	68%	0.682	23%	0.23	S	C	*	.	H	α-helix	trans	-66.6	-36.2	174.3	-71.8	174.4	14.9	0	0	112.4	G291 E292 H297	G291-Q295 WeakPolarHBondContact O-CG 3.39Å; G291-Q295 PolarHBondContact O-N 2.96Å; E292-Q295 PolarHBondContact O-N 2.87Å; Q295-H297 PolarHBondContact O-N 3.33Å
296	D	87.1	Confident	89.3	Confident	63 Å²	63	45.7 Å²	45.7	34%	0.337	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	5.8	178.5	-69.7	-26.2	0	0	0	113.5	R254 E292 C293 I298	R254-D296 WeakPolarHBondContact CD-OD2 3.42Å; R254-D296 WeakPolarHBondContact CG-OD2 3.35Å; R254-D296 IonicContact CZ-OD2 3.85Å; R254-D296 IonicContact NE-OD2 3.48Å; R254-D296 IonicContact NH1-OD2 2.7Å; R254-D296 PolarHBondContact NH1-OD2 2.76Å; E292-D296 PolarHBondContact O-N 3.24Å; C293-D296 PolarHBondContact O-N 2.9Å; D296-I298 VanDerWaalsContact C-N 3.33Å; D296-I298 HydrophobicContact CB-CD1 4.09Å; D296-I298 HydrophobicContact CB-CG1 4.07Å; D296-I298 PolarHBondContact O-N 2.7Å
297	H	86.1	Confident	89.2	Confident	164 Å²	164	43.8 Å²	43.8	76%	0.759	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.1	42.3	-179.2	-59.3	-56.5	0	0	0	113.7	C293 D294 Q295	C293-H297 PolarHBondContact O-N 3.5Å; D294-H297 PolarHBondContact O-N 2.85Å; Q295-H297 PolarHBondContact O-N 3.33Å
298	I	89.3	Confident	89	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.015	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	119.1	178.1	-57.2	176.9	0	0	0	110.1	R254 F258 K270 M272 C293 D296 R300	R254-I298 HydrophobicContact CB-CD1 4.18Å; R254-I298 HydrophobicContact CG-CD1 3.73Å; F258-I298 HydrophobicContact CD2-CD1 3.87Å; F258-I298 HydrophobicContact CE2-CD1 4.19Å; F258-I298 HydrophobicContact CE2-CG2 4.09Å; F258-I298 HydrophobicContact CG-CD1 4.42Å; F258-I298 HydrophobicContact CZ-CG2 4.3Å; K270-I298 HydrophobicContact CB-CG1 4.16Å; K270-I298 HydrophobicContact CD-CG1 4.11Å; M272-I298 HydrophobicContact CB-CG2 3.8Å; M272-I298 HydrophobicContact CE-CG2 4.29Å; C293-I298 PolarHBondContact O-N 3.34Å; C293-I298 VanDerWaalsContact O-N 3.11Å; D296-I298 VanDerWaalsContact C-N 3.33Å; D296-I298 HydrophobicContact CB-CD1 4.09Å; D296-I298 HydrophobicContact CB-CG1 4.07Å; D296-I298 PolarHBondContact O-N 2.7Å; I298-R300 HydrophobicContact CG2-CG 4.24Å; I298-R300 PolarHBondContact O-NH1 3.17Å
299	E	88.4	Confident	88.7	Confident	17 Å²	17	33.4 Å²	33.4	8%	0.079	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	121.4	176.7	-157	62.7	-147.8	0	0	110.2	K270 V271 M272 F301 S331 H337 L361 N367	K270-E299 PolarHBondContact O-N 2.89Å; V271-E299 CarbonylContact C-O 3.53Å; V271-E299 WeakPolarHBondContact CA-O 3.43Å; M272-E299 PolarHBondContact N-O 2.78Å; E299-F301 HydrophobicContact CG-CE2 4.26Å; E299-S331 WeakPolarHBondContact OE1-CB 3.38Å; E299-S331 PolarHBondContact OE1-OG 3.08Å; E299-H337 IonicContact OE1-CD2 3.21Å; E299-H337 PolarHBondContact OE1-CD2 3.01Å; E299-H337 IonicContact OE1-CE1 2.78Å; E299-H337 PolarHBondContact OE1-CE1 3.4Å; E299-H337 VanDerWaalsContact OE1-CE1 3.22Å; E299-H337 IonicContact OE1-CG 3.83Å; E299-H337 IonicContact OE1-ND1 3.81Å; E299-H337 IonicContact OE1-NE2 3.68Å; E299-H337 PolarHBondContact OE1-NE2 3.3Å; E299-L361 HydrophobicContact CG-CD1 4.28Å; E299-N367 PolarHBondContact OE2-ND2 3.2Å
300	R	92.5	Very high	88.2	Confident	4 Å²	4	38.1 Å²	38.1	2%	0.015	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	121.6	-170	-62.6	175.4	-55	-78.3	3.3	111.7	M272 I274 D294 I298 I329 S330 S331 H337	M272-R300 HydrophobicContact CB-CG 4.25Å; M272-R300 CarbonylContact O-C 3.53Å; M272-R300 WeakPolarHBondContact O-CA 3.21Å; I274-R300 HydrophobicContact CD1-CB 3.91Å; I274-R300 HydrophobicContact CD1-CG 4.34Å; D294-R300 IonicContact OD1-CZ 2.76Å; D294-R300 IonicContact OD1-NH1 2.68Å; D294-R300 PolarHBondContact OD1-NH1 3.31Å; D294-R300 IonicContact OD1-NH2 2.7Å; D294-R300 PolarHBondContact OD1-NH2 3.37Å; D294-R300 IonicContact OD2-NH2 3.89Å; I298-R300 HydrophobicContact CG2-CG 4.24Å; I298-R300 PolarHBondContact O-NH1 3.17Å; R300-I329 PolarHBondContact NE-O 2.96Å; R300-S330 WeakPolarHBondContact O-CA 3.26Å; R300-S331 PolarHBondContact N-OG 2.87Å; R300-S331 PolarHBondContact O-N 3.21Å; R300-H337 WeakPolarHBondContact O-CB 3.37Å
301	F	92.4	Very high	87.8	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	119.1	173.4	-69.8	-92.6	0	0	0	110.4	V271 M272 V273 I274 E299 H337 F339 L354 K357 I358 L361 T369	V271-F301 HydrophobicContact CG1-CD2 3.78Å; V271-F301 HydrophobicContact CG1-CE2 3.77Å; M272-F301 PolarHBondContact O-N 2.89Å; V273-F301 HydrophobicContact CG2-CB 4.4Å; I274-F301 PolarHBondContact N-O 3.39Å; E299-F301 HydrophobicContact CG-CE2 4.26Å; F301-H337 CarbonylContact C-O 3.6Å; F301-H337 VanDerWaalsContact CA-O 3.23Å; F301-H337 WeakPolarHBondContact CA-O 3.47Å; F301-H337 HydrophobicContact CD1-CB 4.26Å; F301-H337 AromaticContact CD1-CD2 3.76Å; F301-H337 AromaticContact CE1-CD2 3.37Å; F301-H337 WeakPolarHBondContact CE1-CD2 3.43Å; F301-H337 AromaticContact CE1-NE2 3.91Å; F301-H337 AromaticContact CE2-CD2 3.75Å; F301-H337 AromaticContact CZ-CD2 3.37Å; F301-H337 WeakPolarHBondContact CZ-CD2 3.38Å; F301-H337 AromaticContact CZ-NE2 3.61Å; F301-F339 AromaticContact CD1-CE2 3.89Å; F301-F339 HydrophobicContact CD1-CE2 3.89Å; F301-L354 HydrophobicContact CB-CD1 4.13Å; F301-L354 HydrophobicContact CD1-CD1 3.83Å; F301-L354 HydrophobicContact CE1-CD1 4.47Å; F301-L354 HydrophobicContact CG-CD1 4.05Å; F301-K357 HydrophobicContact CE1-CB 4.31Å; F301-I358 HydrophobicContact CD2-CD1 4.38Å; F301-I358 HydrophobicContact CD2-CG1 4.13Å; F301-I358 HydrophobicContact CE1-CG1 4.36Å; F301-I358 HydrophobicContact CE2-CD1 4.45Å; F301-I358 HydrophobicContact CE2-CG1 3.74Å; F301-I358 HydrophobicContact CZ-CG1 3.85Å; F301-L361 HydrophobicContact CE2-CD1 4.17Å; F301-L361 HydrophobicContact CZ-CD1 4.24Å; F301-T369 HydrophobicContact CZ-CG2 4.25Å
302	G	92.6	Very high	87.4	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	125.4	178.3	0	0	0	0	0	112.4	S330 H337 F338 F339	G302-S330 WeakPolarHBondContact CA-OG 3.44Å; G302-S330 PolarHBondContact N-OG 3.03Å; G302-H337 PolarHBondContact N-O 2.98Å; G302-F338 CarbonylContact O-C 3.43Å; G302-F338 WeakPolarHBondContact O-CA 3.08Å; G302-F339 PolarHBondContact O-N 3.37Å
303	I	93.1	Very high	86.9	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	110.9	178.1	-54.5	173.6	0	0	0	108.7	F188 V273 I274 L275 T276 V305 F339 V341 L347 L350 L354	F188-I303 HydrophobicContact CZ-CD1 3.96Å; V273-I303 HydrophobicContact CG1-CD1 3.81Å; I274-I303 PolarHBondContact O-N 2.99Å; L275-I303 HydrophobicContact CB-CB 4.42Å; L275-I303 HydrophobicContact CG-CB 4.35Å; L275-I303 HydrophobicContact CG-CG2 4.35Å; T276-I303 PolarHBondContact N-O 2.74Å; I303-V305 HydrophobicContact CG2-CG2 4.36Å; I303-F339 WeakPolarHBondContact CA-O 3.04Å; I303-F339 HydrophobicContact CG1-CB 4.46Å; I303-F339 HydrophobicContact CG1-CD2 4.26Å; I303-V341 HydrophobicContact CG2-CG2 3.87Å; I303-L347 HydrophobicContact CG2-CD2 3.73Å; I303-L350 HydrophobicContact CD1-CD2 3.93Å; I303-L350 HydrophobicContact CG1-CD2 4.08Å; I303-L350 HydrophobicContact CG2-CD2 3.68Å; I303-L354 HydrophobicContact CD1-CD2 3.94Å
304	A	91.1	Very high	86.6	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	124.6	175.6	0	0	0	0	0	110.3	F322 I326 F338 F339 V341	A304-F322 HydrophobicContact CB-CD1 4.49Å; A304-F322 HydrophobicContact CB-CE1 3.68Å; A304-F322 HydrophobicContact CB-CZ 3.95Å; A304-I326 HydrophobicContact CB-CB 4.19Å; A304-I326 HydrophobicContact CB-CG1 4.02Å; A304-I326 HydrophobicContact CB-CG2 4.2Å; A304-F338 HydrophobicContact CB-CE2 3.84Å; A304-F338 HydrophobicContact CB-CZ 4.07Å; A304-F339 PolarHBondContact N-O 2.94Å; A304-V341 PolarHBondContact O-N 3.13Å
305	V	90.4	Very high	86.4	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	114.7	-179.7	-172.7	0	0	0	0	110	L275 T276 D277 I303 G307 E344 L347	L275-V305 HydrophobicContact CD2-CG2 3.98Å; L275-V305 HydrophobicContact CG-CG2 4.18Å; T276-V305 PolarHBondContact O-N 2.81Å; D277-V305 VanDerWaalsContact CA-O 3.29Å; D277-V305 WeakPolarHBondContact CA-O 3.26Å; D277-V305 HydrophobicContact CB-CB 4Å; D277-V305 WeakPolarHBondContact CB-O 3.46Å; I303-V305 HydrophobicContact CG2-CG2 4.36Å; V305-G307 VanDerWaalsContact C-N 3.3Å; V305-G307 PolarHBondContact O-N 3.19Å; V305-E344 HydrophobicContact CG1-CG 3.97Å; V305-L347 HydrophobicContact CG1-CD1 4.39Å; V305-L347 HydrophobicContact CG2-CD1 4Å; V305-L347 HydrophobicContact CG2-CD2 3.89Å; V305-L347 HydrophobicContact CG2-CG 4.26Å
306	L	85.6	Confident	86	Confident	18 Å²	18	54.9 Å²	54.9	9%	0.094	26%	0.26	C	S	.	.			trans	-89.1	12.2	-174	-61.1	179.4	0	0	0	114.3	Y308 Y309 K310 V319 F322 I323 N340 V341 S342	L306-Y308 PolarHBondContact O-N 3.33Å; L306-Y309 PolarHBondContact O-N 2.94Å; L306-K310 WeakPolarHBondContact O-CG 3.09Å; L306-K310 PolarHBondContact O-N 3.14Å; L306-V319 HydrophobicContact CD1-CG1 4.3Å; L306-V319 HydrophobicContact CD2-CG1 4.01Å; L306-F322 HydrophobicContact CD2-CD1 3.78Å; L306-F322 HydrophobicContact CD2-CE1 3.89Å; L306-I323 HydrophobicContact CD2-CG1 4.48Å; L306-N340 WeakPolarHBondContact CD1-OD1 3.25Å; L306-N340 WeakPolarHBondContact CG-OD1 3.29Å; L306-V341 WeakPolarHBondContact CB-O 3.5Å; L306-V341 PolarHBondContact N-O 2.82Å; L306-S342 CarbonylContact C-O 3.46Å
307	G	83.1	Confident	85.7	Confident	2 Å²	2	54.4 Å²	54.4	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-58	-50.2	-176.4	0	0	0	0	0	112.6	V305 K310 R311	V305-G307 VanDerWaalsContact C-N 3.3Å; V305-G307 PolarHBondContact O-N 3.19Å; G307-K310 PolarHBondContact O-N 2.95Å; G307-R311 VanDerWaalsContact C-CZ 3.42Å; G307-R311 VanDerWaalsContact C-NH1 3.32Å; G307-R311 WeakPolarHBondContact O-CG 3.13Å; G307-R311 PolarHBondContact O-N 3.08Å; G307-R311 PolarHBondContact O-NH1 2.81Å
308	Y	82.6	Confident	85.5	Confident	77 Å²	77	50 Å²	50	30%	0.302	25%	0.25	S	C	.	.	H	α-helix	trans	-61	-47.3	176.9	174.2	-106.3	0	0	0	112.6	L306 K310 R311 E312	L306-Y308 PolarHBondContact O-N 3.33Å; Y308-K310 VanDerWaalsContact C-N 3.28Å; Y308-K310 PolarHBondContact O-N 3.32Å; Y308-R311 PolarHBondContact O-N 2.88Å; Y308-R311 VanDerWaalsContact O-N 3.13Å; Y308-E312 HydrophobicContact CD2-CG 4.02Å; Y308-E312 HydrophobicContact CE1-CG 4.46Å; Y308-E312 HydrophobicContact CE2-CG 3.57Å; Y308-E312 PolarHBondContact O-N 2.96Å
309	Y	82.9	Confident	85.2	Confident	16 Å²	16	51.5 Å²	51.5	6%	0.063	26%	0.259	C	S	.	.	H	α-helix	trans	-60.9	-34.5	-180	-75.7	-98.6	0	0	0	113.2	D277 E279 L306 N313 K314 E318 V319 F322	D277-Y309 VanDerWaalsContact O-CE2 3.22Å; D277-Y309 WeakPolarHBondContact O-CE2 3.44Å; E279-Y309 PolarHBondContact N-OH 3.25Å; L306-Y309 PolarHBondContact O-N 2.94Å; Y309-N313 PolarHBondContact O-N 3.04Å; Y309-K314 HydrophobicContact CD1-CB 3.7Å; Y309-K314 HydrophobicContact CD1-CG 3.83Å; Y309-K314 HydrophobicContact CE1-CG 4.47Å; Y309-K314 HydrophobicContact CG-CB 4.46Å; Y309-K314 HydrophobicContact CG-CG 4.42Å; Y309-K314 PolarHBondContact O-N 3.36Å; Y309-K314 VanDerWaalsContact O-N 3.11Å; Y309-E318 HydrophobicContact CE1-CB 4.25Å; Y309-V319 HydrophobicContact CD1-CG2 3.8Å; Y309-V319 HydrophobicContact CG-CG2 4.27Å; Y309-F322 HydrophobicContact CD2-CD1 4.29Å; Y309-F322 HydrophobicContact CE1-CB 4.3Å; Y309-F322 HydrophobicContact CE2-CB 4.24Å; Y309-F322 AromaticContact CE2-CD1 3.79Å; Y309-F322 HydrophobicContact CE2-CD1 3.79Å; Y309-F322 HydrophobicContact CE2-CD2 4.37Å; Y309-F322 HydrophobicContact CE2-CE1 4.22Å; Y309-F322 AromaticContact CE2-CG 3.87Å; Y309-F322 HydrophobicContact CE2-CG 3.87Å; Y309-F322 AromaticContact CZ-CG 3.9Å; Y309-F322 WeakPolarHBondContact OH-CB 3.34Å
310	K	79.4	Confident	85.1	Confident	104 Å²	104	57.1 Å²	57.1	45%	0.452	28%	0.284	S	S	.	.	H	α-helix	trans	-72.7	-41.9	173.7	-73.7	-176.9	-178	173.4	0	112.7	L306 G307 Y308 E312 N313 S342	L306-K310 WeakPolarHBondContact O-CG 3.09Å; L306-K310 PolarHBondContact O-N 3.14Å; G307-K310 PolarHBondContact O-N 2.95Å; Y308-K310 VanDerWaalsContact C-N 3.28Å; Y308-K310 PolarHBondContact O-N 3.32Å; K310-E312 VanDerWaalsContact C-N 3.27Å; K310-E312 PolarHBondContact O-N 2.82Å; K310-N313 PolarHBondContact O-N 2.93Å; K310-S342 WeakPolarHBondContact CD-O 3.1Å; K310-S342 WeakPolarHBondContact CE-O 3.27Å; K310-S342 PolarHBondContact NZ-O 3.2Å; K310-S342 PolarHBondContact NZ-OG 3.04Å; K310-S342 VanDerWaalsContact NZ-OG 3.07Å
311	R	82.3	Confident	84.9	Confident	105 Å²	105	63 Å²	63	40%	0.396	31%	0.309	S	S	.	.	H	α-helix	trans	-62.7	-36.1	178.1	-72.7	-174.8	-67.2	-90.5	7.1	111.9	S178 Y180 G307 Y308 E344	S178-R311 PolarHBondContact O-NH2 2.99Å; Y180-R311 PolarHBondContact O-NH1 2.89Å; Y180-R311 PolarHBondContact O-NH2 2.6Å; G307-R311 VanDerWaalsContact C-CZ 3.42Å; G307-R311 VanDerWaalsContact C-NH1 3.32Å; G307-R311 WeakPolarHBondContact O-CG 3.13Å; G307-R311 PolarHBondContact O-N 3.08Å; G307-R311 PolarHBondContact O-NH1 2.81Å; Y308-R311 PolarHBondContact O-N 2.88Å; Y308-R311 VanDerWaalsContact O-N 3.13Å; R311-E344 IonicContact CZ-OE1 3.94Å; R311-E344 IonicContact CZ-OE2 2.85Å; R311-E344 VanDerWaalsContact NH1-CD 3.34Å; R311-E344 IonicContact NH1-OE1 2.97Å; R311-E344 PolarHBondContact NH1-OE1 2.81Å; R311-E344 VanDerWaalsContact NH1-OE1 3.07Å; R311-E344 IonicContact NH1-OE2 3.86Å; R311-E344 PolarHBondContact NH1-OE2 3.12Å; R311-E344 IonicContact NH2-OE1 3.07Å; R311-E344 PolarHBondContact NH2-OE1 3.19Å; R311-E344 IonicContact NH2-OE2 3.4Å
312	E	80.9	Confident	84.6	Confident	110 Å²	110	63 Å²	63	51%	0.514	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	5.7	-177.9	-67.8	-63.4	134.7	0	0	114.5	Y308 K310 K314	Y308-E312 HydrophobicContact CD2-CG 4.02Å; Y308-E312 HydrophobicContact CE1-CG 4.46Å; Y308-E312 HydrophobicContact CE2-CG 3.57Å; Y308-E312 PolarHBondContact O-N 2.96Å; K310-E312 VanDerWaalsContact C-N 3.27Å; K310-E312 PolarHBondContact O-N 2.82Å; E312-K314 VanDerWaalsContact C-N 3.27Å; E312-K314 HydrophobicContact CB-CD 4.37Å; E312-K314 HydrophobicContact CB-CG 4.04Å; E312-K314 PolarHBondContact O-N 2.83Å
313	N	80.9	Confident	84.4	Confident	151 Å²	151	64.1 Å²	64.1	81%	0.807	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.8	46.1	-178.2	-73.3	-34.2	0	0	0	113.8	Y309 K310	Y309-N313 PolarHBondContact O-N 3.04Å; K310-N313 PolarHBondContact O-N 2.93Å
314	K	82.2	Confident	84.2	Confident	76 Å²	76	67.6 Å²	67.6	33%	0.33	33%	0.333	S	S	.	.			trans	-67.1	153.7	-178.6	-67.2	-64.4	-170.9	170.8	0	112.5	Y309 E312 E318	Y309-K314 HydrophobicContact CD1-CB 3.7Å; Y309-K314 HydrophobicContact CD1-CG 3.83Å; Y309-K314 HydrophobicContact CE1-CG 4.47Å; Y309-K314 HydrophobicContact CG-CB 4.46Å; Y309-K314 HydrophobicContact CG-CG 4.42Å; Y309-K314 PolarHBondContact O-N 3.36Å; Y309-K314 VanDerWaalsContact O-N 3.11Å; E312-K314 VanDerWaalsContact C-N 3.27Å; E312-K314 HydrophobicContact CB-CD 4.37Å; E312-K314 HydrophobicContact CB-CG 4.04Å; E312-K314 PolarHBondContact O-N 2.83Å; K314-E318 IonicContact NZ-OE1 3.48Å
315	S	84.1	Confident	84	Confident	63 Å²	63	68 Å²	68	44%	0.441	34%	0.335	S	S	.	.			trans	-69.2	152.1	-179.1	67.3	0	0	0	0	112	G317 E318 V319	S315-G317 PolarHBondContact O-N 3.07Å; S315-G317 VanDerWaalsContact O-N 3.13Å; S315-E318 WeakPolarHBondContact CB-OE2 3.41Å; S315-E318 PolarHBondContact N-OE2 3.03Å; S315-E318 PolarHBondContact O-N 2.85Å; S315-E318 WeakPolarHBondContact OG-CG 3.31Å; S315-E318 PolarHBondContact OG-N 2.89Å; S315-E318 PolarHBondContact OG-OE2 2.8Å; S315-V319 PolarHBondContact O-N 2.92Å; S315-V319 VanDerWaalsContact O-N 3.14Å
316	E	79	Confident	84	Confident	179 Å²	179	68 Å²	68	84%	0.836	34%	0.335	S	S	*	.	H	α-helix	trans	-57.2	-29.4	177	-70.1	-171.9	163	0	0	112.9	K320	E316-K320 WeakPolarHBondContact O-CB 3.33Å; E316-K320 PolarHBondContact O-N 2.79Å
317	G	81.3	Confident	84.2	Confident	53 Å²	53	70.9 Å²	70.9	55%	0.546	35%	0.347	S	S	.	.	H	α-helix	trans	-66.5	-40.5	176.1	0	0	0	0	0	113.2	S315 K321	S315-G317 PolarHBondContact O-N 3.07Å; S315-G317 VanDerWaalsContact O-N 3.13Å; G317-K321 PolarHBondContact O-N 3.32Å; G317-K321 VanDerWaalsContact O-N 3.11Å
318	E	81	Confident	84.4	Confident	72 Å²	72	72.7 Å²	72.7	34%	0.336	36%	0.359	S	S	.	.	H	α-helix	trans	-69.5	-42.6	176.3	-69.5	166	108.8	0	0	111.1	Y309 K314 S315 K320 K321 F322	Y309-E318 HydrophobicContact CE1-CB 4.25Å; K314-E318 IonicContact NZ-OE1 3.48Å; S315-E318 WeakPolarHBondContact CB-OE2 3.41Å; S315-E318 PolarHBondContact N-OE2 3.03Å; S315-E318 PolarHBondContact O-N 2.85Å; S315-E318 WeakPolarHBondContact OG-CG 3.31Å; S315-E318 PolarHBondContact OG-N 2.89Å; S315-E318 PolarHBondContact OG-OE2 2.8Å; E318-K320 VanDerWaalsContact C-N 3.31Å; E318-K320 PolarHBondContact O-N 2.91Å; E318-K321 PolarHBondContact O-N 2.84Å; E318-F322 PolarHBondContact O-N 3.36Å; E318-F322 VanDerWaalsContact O-N 3.11Å
319	V	84.4	Confident	84.8	Confident	35 Å²	35	69 Å²	69	21%	0.212	35%	0.345	C	S	.	.	H	α-helix	trans	-60.1	-42.3	176.1	175.1	0	0	0	0	111.2	L306 Y309 S315 I323	L306-V319 HydrophobicContact CD1-CG1 4.3Å; L306-V319 HydrophobicContact CD2-CG1 4.01Å; Y309-V319 HydrophobicContact CD1-CG2 3.8Å; Y309-V319 HydrophobicContact CG-CG2 4.27Å; S315-V319 PolarHBondContact O-N 2.92Å; S315-V319 VanDerWaalsContact O-N 3.14Å; V319-I323 HydrophobicContact CG1-CD1 3.92Å; V319-I323 WeakPolarHBondContact O-CG1 3.39Å; V319-I323 PolarHBondContact O-N 2.92Å; V319-I323 VanDerWaalsContact O-N 3.09Å
320	K	85.8	Confident	85.2	Confident	135 Å²	135	68.6 Å²	68.6	59%	0.587	34%	0.344	S	S	*	.	H	α-helix	trans	-65.9	-41.8	178.7	-173.9	173.9	-179.6	-179.7	0	112.2	E316 E318 I323 D324	E316-K320 WeakPolarHBondContact O-CB 3.33Å; E316-K320 PolarHBondContact O-N 2.79Å; E318-K320 VanDerWaalsContact C-N 3.31Å; E318-K320 PolarHBondContact O-N 2.91Å; K320-I323 PolarHBondContact O-N 2.68Å; K320-D324 WeakPolarHBondContact O-CB 3.31Å; K320-D324 VanDerWaalsContact O-CG 3.32Å; K320-D324 PolarHBondContact O-N 3.07Å
321	K	86.9	Confident	85.6	Confident	127 Å²	127	63.9 Å²	63.9	55%	0.552	32%	0.324	S	S	*	.	H	α-helix	trans	-60.3	-45.9	178.4	-172.3	-175.9	172.8	-141.8	0	111.6	E279 G317 E318 D324 E325	E279-K321 WeakPolarHBondContact OE2-CE 3.47Å; E279-K321 IonicContact OE2-NZ 2.84Å; E279-K321 PolarHBondContact OE2-NZ 3.39Å; G317-K321 PolarHBondContact O-N 3.32Å; G317-K321 VanDerWaalsContact O-N 3.11Å; E318-K321 PolarHBondContact O-N 2.84Å; K321-D324 PolarHBondContact O-N 2.99Å; K321-E325 PolarHBondContact O-N 3.28Å
322	F	87.8	Confident	85.6	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-60.3	-47.7	174.3	171.4	-119.3	0	0	0	112.8	T276 G278 E279 A304 L306 Y309 E318 D324 E325 I326	T276-F322 HydrophobicContact CG2-CE2 4.15Å; T276-F322 HydrophobicContact CG2-CZ 4.35Å; G278-F322 VanDerWaalsContact C-CE2 3.44Å; G278-F322 VanDerWaalsContact O-CE2 3.32Å; G278-F322 WeakPolarHBondContact O-CE2 3.33Å; E279-F322 HydrophobicContact CG-CB 4.09Å; E279-F322 HydrophobicContact CG-CD2 4.34Å; A304-F322 HydrophobicContact CB-CD1 4.49Å; A304-F322 HydrophobicContact CB-CE1 3.68Å; A304-F322 HydrophobicContact CB-CZ 3.95Å; L306-F322 HydrophobicContact CD2-CD1 3.78Å; L306-F322 HydrophobicContact CD2-CE1 3.89Å; Y309-F322 HydrophobicContact CD2-CD1 4.29Å; Y309-F322 HydrophobicContact CE1-CB 4.3Å; Y309-F322 HydrophobicContact CE2-CB 4.24Å; Y309-F322 AromaticContact CE2-CD1 3.79Å; Y309-F322 HydrophobicContact CE2-CD1 3.79Å; Y309-F322 HydrophobicContact CE2-CD2 4.37Å; Y309-F322 HydrophobicContact CE2-CE1 4.22Å; Y309-F322 AromaticContact CE2-CG 3.87Å; Y309-F322 HydrophobicContact CE2-CG 3.87Å; Y309-F322 AromaticContact CZ-CG 3.9Å; Y309-F322 WeakPolarHBondContact OH-CB 3.34Å; E318-F322 PolarHBondContact O-N 3.36Å; E318-F322 VanDerWaalsContact O-N 3.11Å; F322-D324 VanDerWaalsContact C-N 3.28Å; F322-D324 PolarHBondContact O-N 3.04Å; F322-E325 WeakPolarHBondContact O-CB 3.38Å; F322-E325 PolarHBondContact O-N 2.97Å; F322-E325 VanDerWaalsContact O-N 3.16Å; F322-I326 HydrophobicContact CD2-CD1 4.48Å; F322-I326 HydrophobicContact CD2-CG1 4.18Å; F322-I326 HydrophobicContact CE2-CD1 3.88Å; F322-I326 HydrophobicContact CE2-CG1 3.69Å; F322-I326 HydrophobicContact CZ-CD1 4.48Å; F322-I326 HydrophobicContact CZ-CG1 3.96Å; F322-I326 PolarHBondContact O-N 2.97Å; F322-I326 VanDerWaalsContact O-N 3.11Å
323	I	88.1	Confident	85.5	Confident	23 Å²	23	63.7 Å²	63.7	12%	0.118	33%	0.328	C	S	.	.	H	α-helix	trans	-59	-41.7	177.8	-73.9	171	0	0	0	111.3	L306 V319 K320 E325 I326 K327 F338	L306-I323 HydrophobicContact CD2-CG1 4.48Å; V319-I323 HydrophobicContact CG1-CD1 3.92Å; V319-I323 WeakPolarHBondContact O-CG1 3.39Å; V319-I323 PolarHBondContact O-N 2.92Å; V319-I323 VanDerWaalsContact O-N 3.09Å; K320-I323 PolarHBondContact O-N 2.68Å; I323-E325 VanDerWaalsContact C-N 3.32Å; I323-I326 PolarHBondContact O-N 2.04Å; I323-K327 HydrophobicContact CG2-CD 4.15Å; I323-K327 VanDerWaalsContact CG2-CE 3.44Å; I323-K327 HydrophobicContact CG2-CG 4.47Å; I323-K327 WeakPolarHBondContact O-CB 3.36Å; I323-K327 VanDerWaalsContact O-CG 3.3Å; I323-K327 WeakPolarHBondContact O-CG 3.5Å; I323-K327 PolarHBondContact O-N 3.33Å; I323-F338 HydrophobicContact CG2-CE1 4.07Å; I323-F338 HydrophobicContact CG2-CZ 3.79Å
324	D	87.8	Confident	85.3	Confident	73 Å²	73	58.9 Å²	58.9	39%	0.39	31%	0.305	S	S	.	.	H	α-helix	trans	-69.9	-30.1	-179.8	-69.8	-20.8	0	0	0	112.2	K320 K321 F322 K327 S328	K320-D324 WeakPolarHBondContact O-CB 3.31Å; K320-D324 VanDerWaalsContact O-CG 3.32Å; K320-D324 PolarHBondContact O-N 3.07Å; K321-D324 PolarHBondContact O-N 2.99Å; F322-D324 VanDerWaalsContact C-N 3.28Å; F322-D324 PolarHBondContact O-N 3.04Å; D324-K327 IonicContact OD1-NZ 2.84Å; D324-K327 PolarHBondContact OD1-NZ 3.4Å; D324-S328 PolarHBondContact O-N 2.99Å
325	E	88.8	Confident	85	Confident	8 Å²	8	62.1 Å²	62.1	4%	0.037	32%	0.321	C	S	.	.	H	α-helix	trans	-62.8	-51.5	169.2	-178.1	173.1	128.4	0	0	111.6	F247 S280 H283 K321 F322 I323 K327 S328 I329	F247-E325 HydrophobicContact CZ-CG 4.46Å; S280-E325 WeakPolarHBondContact CB-OE1 3.28Å; S280-E325 PolarHBondContact N-OE1 3.21Å; H283-E325 IonicContact CE1-OE2 2.71Å; H283-E325 IonicContact CG-OE2 2.82Å; H283-E325 IonicContact ND1-OE2 3.68Å; H283-E325 PolarHBondContact ND1-OE2 3.1Å; K321-E325 PolarHBondContact O-N 3.28Å; F322-E325 WeakPolarHBondContact O-CB 3.38Å; F322-E325 PolarHBondContact O-N 2.97Å; F322-E325 VanDerWaalsContact O-N 3.16Å; I323-E325 VanDerWaalsContact C-N 3.32Å; E325-K327 VanDerWaalsContact C-N 3.32Å; E325-K327 PolarHBondContact O-N 3.03Å; E325-S328 WeakPolarHBondContact O-CA 3.42Å; E325-S328 WeakPolarHBondContact O-CB 3.4Å; E325-S328 PolarHBondContact O-N 2.95Å; E325-S328 PolarHBondContact O-OG 2.82Å; E325-I329 PolarHBondContact O-N 2.96Å
326	I	89.8	Confident	84.6	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-68.3	-33	-177.6	-54.3	-48.5	0	0	0	112.1	T276 A304 F322 I323 S328 I329 S330 F338	T276-I326 HydrophobicContact CG2-CD1 3.29Å; T276-I326 HydrophobicContact CG2-CG1 4.11Å; A304-I326 HydrophobicContact CB-CB 4.19Å; A304-I326 HydrophobicContact CB-CG1 4.02Å; A304-I326 HydrophobicContact CB-CG2 4.2Å; F322-I326 HydrophobicContact CD2-CD1 4.48Å; F322-I326 HydrophobicContact CD2-CG1 4.18Å; F322-I326 HydrophobicContact CE2-CD1 3.88Å; F322-I326 HydrophobicContact CE2-CG1 3.69Å; F322-I326 HydrophobicContact CZ-CD1 4.48Å; F322-I326 HydrophobicContact CZ-CG1 3.96Å; F322-I326 PolarHBondContact O-N 2.97Å; F322-I326 VanDerWaalsContact O-N 3.11Å; I323-I326 PolarHBondContact O-N 2.04Å; I326-S328 PolarHBondContact O-N 3.27Å; I326-I329 HydrophobicContact CD1-CD1 3.93Å; I326-I329 PolarHBondContact O-N 2.83Å; I326-S330 PolarHBondContact O-N 2.51Å; I326-S330 PolarHBondContact O-OG 2.9Å; I326-F338 HydrophobicContact CB-CD2 4.24Å; I326-F338 HydrophobicContact CB-CE2 3.75Å; I326-F338 HydrophobicContact CG2-CD2 3.8Å; I326-F338 HydrophobicContact CG2-CE2 3.63Å
327	K	89.3	Confident	84.9	Confident	79 Å²	79	50.9 Å²	50.9	34%	0.343	26%	0.262	S	S	.	.	H	α-helix	trans	-59.7	-34.4	169.9	-78.4	175.8	-172.2	161.7	0	112.7	I323 D324 E325 T334 F338	I323-K327 HydrophobicContact CG2-CD 4.15Å; I323-K327 VanDerWaalsContact CG2-CE 3.44Å; I323-K327 HydrophobicContact CG2-CG 4.47Å; I323-K327 WeakPolarHBondContact O-CB 3.36Å; I323-K327 VanDerWaalsContact O-CG 3.3Å; I323-K327 WeakPolarHBondContact O-CG 3.5Å; I323-K327 PolarHBondContact O-N 3.33Å; D324-K327 IonicContact OD1-NZ 2.84Å; D324-K327 PolarHBondContact OD1-NZ 3.4Å; E325-K327 VanDerWaalsContact C-N 3.32Å; E325-K327 PolarHBondContact O-N 3.03Å; K327-T334 HydrophobicContact CB-CG2 3.9Å; K327-T334 HydrophobicContact CG-CG2 3.88Å; K327-F338 HydrophobicContact CG-CB 4.42Å; K327-F338 HydrophobicContact CG-CD1 3.71Å; K327-F338 HydrophobicContact CG-CD2 3.94Å; K327-F338 HydrophobicContact CG-CE1 3.89Å; K327-F338 HydrophobicContact CG-CE2 4.14Å; K327-F338 HydrophobicContact CG-CG 3.73Å; K327-F338 HydrophobicContact CG-CZ 4.11Å
328	S	88.2	Confident	85.3	Confident	39 Å²	39	49.8 Å²	49.8	27%	0.273	24%	0.242	S	C	.	.	H	α-helix	trans	-75.5	-24.5	179.6	80.1	0	0	0	0	113.6	Q286 D324 E325 I326	Q286-S328 PolarHBondContact NE2-OG 3.01Å; D324-S328 PolarHBondContact O-N 2.99Å; E325-S328 WeakPolarHBondContact O-CA 3.42Å; E325-S328 WeakPolarHBondContact O-CB 3.4Å; E325-S328 PolarHBondContact O-N 2.95Å; E325-S328 PolarHBondContact O-OG 2.82Å; I326-S328 PolarHBondContact O-N 3.27Å
329	I	90	Very high	85.7	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-76	-35.8	174.5	-65.6	170.2	0	0	0	110.7	T246 F247 I250 I274 I290 R300 E325 I326	T246-I329 HydrophobicContact CG2-CD1 4.06Å; F247-I329 HydrophobicContact CE1-CD1 4.12Å; F247-I329 HydrophobicContact CE1-CG1 3.81Å; F247-I329 HydrophobicContact CZ-CD1 3.96Å; F247-I329 HydrophobicContact CZ-CG1 3.94Å; I250-I329 HydrophobicContact CD1-CD1 4.22Å; I250-I329 HydrophobicContact CD1-CG1 4.39Å; I250-I329 HydrophobicContact CD1-CG2 3.65Å; I274-I329 HydrophobicContact CD1-CG2 4.12Å; I274-I329 HydrophobicContact CG1-CG2 4.29Å; I290-I329 HydrophobicContact CD1-CB 4.28Å; I290-I329 HydrophobicContact CD1-CG1 4.32Å; I290-I329 HydrophobicContact CD1-CG2 4.12Å; R300-I329 PolarHBondContact NE-O 2.96Å; E325-I329 PolarHBondContact O-N 2.96Å; I326-I329 HydrophobicContact CD1-CD1 3.93Å; I326-I329 PolarHBondContact O-N 2.83Å
330	S	91.3	Very high	85.9	Confident	7 Å²	7	49.5 Å²	49.5	5%	0.049	24%	0.24	C	C	.	.	S	Bend	trans	-68.1	143.4	-176.6	-54.4	0	0	0	0	112.3	R300 G302 I326	R300-S330 WeakPolarHBondContact O-CA 3.26Å; G302-S330 WeakPolarHBondContact CA-OG 3.44Å; G302-S330 PolarHBondContact N-OG 3.03Å; I326-S330 PolarHBondContact O-N 2.51Å; I326-S330 PolarHBondContact O-OG 2.9Å
331	S	89	Confident	86	Confident	5 Å²	5	43.4 Å²	43.4	4%	0.035	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-65.2	162.9	175.4	-72.1	0	0	0	0	113.1	E299 R300 P333 H337	E299-S331 WeakPolarHBondContact OE1-CB 3.38Å; E299-S331 PolarHBondContact OE1-OG 3.08Å; R300-S331 PolarHBondContact N-OG 2.87Å; R300-S331 PolarHBondContact O-N 3.21Å; S331-P333 CarbonylContact O-C 3.43Å; S331-H337 WeakPolarHBondContact O-CB 3.35Å
332	K	80.3	Confident	85.9	Confident	177 Å²	177	40 Å²	40	77%	0.77	21%	0.207	S	C	*	.	S	Bend	trans	-92.6	135.4	176.4	-68.5	178.4	-176.8	170.5	0	110.2
333	P	79.6	Confident	85.7	Confident	35 Å²	35	41.8 Å²	41.8	23%	0.227	22%	0.216	C	C	.	.	S	Bend	cis	-80.1	137	4.7	31.9	-35.1	0	0	0	113	S331 Q335 D336 H337 L368	S331-P333 CarbonylContact O-C 3.43Å; P333-Q335 VanDerWaalsContact C-N 3.27Å; P333-Q335 HydrophobicContact CB-CG 4.27Å; P333-Q335 PolarHBondContact O-N 3.13Å; P333-D336 HydrophobicContact CG-CB 4.26Å; P333-D336 WeakPolarHBondContact CG-OD2 3.29Å; P333-D336 PolarHBondContact O-N 2.8Å; P333-D336 VanDerWaalsContact O-N 3.1Å; P333-H337 PolarHBondContact O-N 3.11Å; P333-H337 PolarHBondContact O-ND1 2.83Å; P333-L368 HydrophobicContact CG-CD2 4.48Å; P333-L368 HydrophobicContact CG-CG 4.19Å
334	T	77.9	Confident	85.6	Confident	50 Å²	50	40.9 Å²	40.9	31%	0.307	21%	0.212	S	C	.	.	H	α-helix	trans	-64.6	-27.7	-173.4	-46.2	0	0	0	0	113.2	K327 D336 H337 F338	K327-T334 HydrophobicContact CB-CG2 3.9Å; K327-T334 HydrophobicContact CG-CG2 3.88Å; T334-D336 PolarHBondContact O-N 2.92Å; T334-D336 VanDerWaalsContact O-N 3.17Å; T334-H337 PolarHBondContact O-N 3.46Å; T334-F338 HydrophobicContact CG2-CB 3.7Å; T334-F338 HydrophobicContact CG2-CG 4.43Å; T334-F338 WeakPolarHBondContact O-CB 3.49Å; T334-F338 PolarHBondContact O-N 2.78Å
335	Q	75.1	Confident	85.3	Confident	143 Å²	143	41.8 Å²	41.8	67%	0.668	22%	0.22	S	C	*	.	H	α-helix	trans	-59.8	-25.4	176.1	70.5	-168.9	7.3	0	0	113.4	P333 K357	P333-Q335 VanDerWaalsContact C-N 3.27Å; P333-Q335 HydrophobicContact CB-CG 4.27Å; P333-Q335 PolarHBondContact O-N 3.13Å; Q335-K357 PolarHBondContact O-NZ 3.04Å
336	D	74.6	Confident	85.1	Confident	7 Å²	7	46.5 Å²	46.5	4%	0.037	24%	0.24	C	C	.	.	H	α-helix	trans	-92.8	-35.7	-177.7	-73	-20.4	0	0	0	111.9	P333 T334 K357 T369 S370	P333-D336 HydrophobicContact CG-CB 4.26Å; P333-D336 WeakPolarHBondContact CG-OD2 3.29Å; P333-D336 PolarHBondContact O-N 2.8Å; P333-D336 VanDerWaalsContact O-N 3.1Å; T334-D336 PolarHBondContact O-N 2.92Å; T334-D336 VanDerWaalsContact O-N 3.17Å; D336-K357 VanDerWaalsContact CA-NZ 3.31Å; D336-K357 WeakPolarHBondContact O-CD 3.41Å; D336-K357 PolarHBondContact O-NZ 3.03Å; D336-T369 WeakPolarHBondContact CB-OG1 3.29Å; D336-S370 PolarHBondContact OD1-OG 3.36Å; D336-S370 PolarHBondContact OD2-OG 2.83Å
337	H	86.1	Confident	84.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-100.7	-12.9	-170.4	-62.5	91.1	0	0	0	114.5	E299 R300 F301 G302 S331 P333 T334 N367	E299-H337 IonicContact OE1-CD2 3.21Å; E299-H337 PolarHBondContact OE1-CD2 3.01Å; E299-H337 IonicContact OE1-CE1 2.78Å; E299-H337 PolarHBondContact OE1-CE1 3.4Å; E299-H337 VanDerWaalsContact OE1-CE1 3.22Å; E299-H337 IonicContact OE1-CG 3.83Å; E299-H337 IonicContact OE1-ND1 3.81Å; E299-H337 IonicContact OE1-NE2 3.68Å; E299-H337 PolarHBondContact OE1-NE2 3.3Å; R300-H337 WeakPolarHBondContact O-CB 3.37Å; F301-H337 CarbonylContact C-O 3.6Å; F301-H337 VanDerWaalsContact CA-O 3.23Å; F301-H337 WeakPolarHBondContact CA-O 3.47Å; F301-H337 HydrophobicContact CD1-CB 4.26Å; F301-H337 AromaticContact CD1-CD2 3.76Å; F301-H337 AromaticContact CE1-CD2 3.37Å; F301-H337 WeakPolarHBondContact CE1-CD2 3.43Å; F301-H337 AromaticContact CE1-NE2 3.91Å; F301-H337 AromaticContact CE2-CD2 3.75Å; F301-H337 AromaticContact CZ-CD2 3.37Å; F301-H337 WeakPolarHBondContact CZ-CD2 3.38Å; F301-H337 AromaticContact CZ-NE2 3.61Å; G302-H337 PolarHBondContact N-O 2.98Å; S331-H337 WeakPolarHBondContact O-CB 3.35Å; P333-H337 PolarHBondContact O-N 3.11Å; P333-H337 PolarHBondContact O-ND1 2.83Å; T334-H337 PolarHBondContact O-N 3.46Å; H337-N367 PolarHBondContact CE1-O 2.8Å
338	F	90.4	Very high	84.5	Confident	29 Å²	29	44.1 Å²	44.1	13%	0.127	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	134.3	178.9	174.8	-107.7	0	0	0	112.3	G302 A304 I323 I326 K327 T334 N340	G302-F338 CarbonylContact O-C 3.43Å; G302-F338 WeakPolarHBondContact O-CA 3.08Å; A304-F338 HydrophobicContact CB-CE2 3.84Å; A304-F338 HydrophobicContact CB-CZ 4.07Å; I323-F338 HydrophobicContact CG2-CE1 4.07Å; I323-F338 HydrophobicContact CG2-CZ 3.79Å; I326-F338 HydrophobicContact CB-CD2 4.24Å; I326-F338 HydrophobicContact CB-CE2 3.75Å; I326-F338 HydrophobicContact CG2-CD2 3.8Å; I326-F338 HydrophobicContact CG2-CE2 3.63Å; K327-F338 HydrophobicContact CG-CB 4.42Å; K327-F338 HydrophobicContact CG-CD1 3.71Å; K327-F338 HydrophobicContact CG-CD2 3.94Å; K327-F338 HydrophobicContact CG-CE1 3.89Å; K327-F338 HydrophobicContact CG-CE2 4.14Å; K327-F338 HydrophobicContact CG-CG 3.73Å; K327-F338 HydrophobicContact CG-CZ 4.11Å; T334-F338 HydrophobicContact CG2-CB 3.7Å; T334-F338 HydrophobicContact CG2-CG 4.43Å; T334-F338 WeakPolarHBondContact O-CB 3.49Å; T334-F338 PolarHBondContact O-N 2.78Å; F338-N340 HydrophobicContact CE1-CB 3.94Å; F338-N340 HydrophobicContact CZ-CB 3.93Å
339	F	88.7	Confident	84.1	Confident	20 Å²	20	46.8 Å²	46.8	9%	0.088	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	131.3	173.4	-56.2	-87.2	0	0	0	111	F301 G302 I303 A304 L350 T353 L354 K357	F301-F339 AromaticContact CD1-CE2 3.89Å; F301-F339 HydrophobicContact CD1-CE2 3.89Å; G302-F339 PolarHBondContact O-N 3.37Å; I303-F339 WeakPolarHBondContact CA-O 3.04Å; I303-F339 HydrophobicContact CG1-CB 4.46Å; I303-F339 HydrophobicContact CG1-CD2 4.26Å; A304-F339 PolarHBondContact N-O 2.94Å; F339-L350 HydrophobicContact CB-CD1 4.01Å; F339-L350 HydrophobicContact CB-CD2 3.74Å; F339-L350 HydrophobicContact CD1-CD1 3.4Å; F339-L350 HydrophobicContact CD2-CD1 4.47Å; F339-L350 HydrophobicContact CE1-CD1 3.86Å; F339-L350 HydrophobicContact CG-CD1 3.71Å; F339-L350 HydrophobicContact CG-CD2 4.08Å; F339-L350 HydrophobicContact CG-CG 4.49Å; F339-T353 HydrophobicContact CE1-CG2 4.08Å; F339-L354 HydrophobicContact CD2-CD1 4.18Å; F339-L354 HydrophobicContact CE2-CD1 3.44Å; F339-L354 VanDerWaalsContact CE2-CD1 3.44Å; F339-L354 HydrophobicContact CZ-CD1 4.01Å; F339-K357 HydrophobicContact CE1-CD 3.84Å; F339-K357 HydrophobicContact CZ-CD 3.41Å; F339-K357 VanDerWaalsContact CZ-CD 3.41Å
340	N	89.3	Confident	83.9	Confident	81 Å²	81	47.7 Å²	47.7	43%	0.433	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	124	173.8	-177.6	14.6	0	0	0	109.4	L306 F338	L306-N340 WeakPolarHBondContact CD1-OD1 3.25Å; L306-N340 WeakPolarHBondContact CG-OD1 3.29Å; F338-N340 HydrophobicContact CE1-CB 3.94Å; F338-N340 HydrophobicContact CZ-CB 3.93Å
341	V	87.9	Confident	83.5	Confident	8 Å²	8	47.4 Å²	47.4	5%	0.048	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	133.1	-175.3	-170.4	0	0	0	0	109.7	I303 A304 L306 D343 F346 L347 L350	I303-V341 HydrophobicContact CG2-CG2 3.87Å; A304-V341 PolarHBondContact O-N 3.13Å; L306-V341 WeakPolarHBondContact CB-O 3.5Å; L306-V341 PolarHBondContact N-O 2.82Å; V341-D343 VanDerWaalsContact CG1-O 3.24Å; V341-D343 WeakPolarHBondContact CG1-O 3.2Å; V341-D343 PolarHBondContact O-N 3.32Å; V341-F346 HydrophobicContact CG1-CB 3.67Å; V341-L347 HydrophobicContact CB-CD2 4.29Å; V341-L347 HydrophobicContact CG1-CD2 4.18Å; V341-L347 HydrophobicContact CG1-CG 4.12Å; V341-L347 HydrophobicContact CG2-CD2 3.98Å; V341-L350 HydrophobicContact CG2-CD2 3.67Å
342	S	84.6	Confident	82.8	Confident	55 Å²	55	48.7 Å²	48.7	39%	0.385	25%	0.253	S	S	.	.	S	Bend	trans	-62.1	-38.5	-174.6	-99.1	0	0	0	0	114.5	L306 K310	L306-S342 CarbonylContact C-O 3.46Å; K310-S342 WeakPolarHBondContact CD-O 3.1Å; K310-S342 WeakPolarHBondContact CE-O 3.27Å; K310-S342 PolarHBondContact NZ-O 3.2Å; K310-S342 PolarHBondContact NZ-OG 3.04Å; K310-S342 VanDerWaalsContact NZ-OG 3.07Å
343	D	83.4	Confident	82.7	Confident	38 Å²	38	42.6 Å²	42.6	20%	0.203	23%	0.231	C	C	.	.	S	Bend	trans	-165.6	177.4	178.1	58.6	48.8	0	0	0	109.1	V341 V345 F346	V341-D343 VanDerWaalsContact CG1-O 3.24Å; V341-D343 WeakPolarHBondContact CG1-O 3.2Å; V341-D343 PolarHBondContact O-N 3.32Å; D343-V345 PolarHBondContact O-N 3.29Å; D343-V345 WeakPolarHBondContact OD1-CA 3.27Å; D343-V345 WeakPolarHBondContact OD1-CB 3.3Å; D343-V345 PolarHBondContact OD1-N 3Å; D343-F346 PolarHBondContact O-N 3.31Å; D343-F346 WeakPolarHBondContact OD1-CD2 3.36Å; D343-F346 PolarHBondContact OD1-N 3.31Å; D343-F346 WeakPolarHBondContact OD2-CD2 3.49Å; D343-F346 WeakPolarHBondContact OD2-CE2 3.49Å
344	E	85	Confident	82.8	Confident	4 Å²	4	41 Å²	41	2%	0.019	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-27.7	-176.2	-59.8	78.4	179.2	0	0	112.7	N184 V305 R311 L347	N184-E344 HydrophobicContact CB-CB 3.88Å; N184-E344 VanDerWaalsContact CB-O 3.3Å; N184-E344 WeakPolarHBondContact CB-O 3.38Å; N184-E344 WeakPolarHBondContact ND2-CB 3.48Å; V305-E344 HydrophobicContact CG1-CG 3.97Å; R311-E344 IonicContact CZ-OE1 3.94Å; R311-E344 IonicContact CZ-OE2 2.85Å; R311-E344 VanDerWaalsContact NH1-CD 3.34Å; R311-E344 IonicContact NH1-OE1 2.97Å; R311-E344 PolarHBondContact NH1-OE1 2.81Å; R311-E344 VanDerWaalsContact NH1-OE1 3.07Å; R311-E344 IonicContact NH1-OE2 3.86Å; R311-E344 PolarHBondContact NH1-OE2 3.12Å; R311-E344 IonicContact NH2-OE1 3.07Å; R311-E344 PolarHBondContact NH2-OE1 3.19Å; R311-E344 IonicContact NH2-OE2 3.4Å; E344-L347 HydrophobicContact CB-CD1 4.41Å; E344-L347 WeakPolarHBondContact O-CB 3.41Å; E344-L347 PolarHBondContact O-N 3.4Å
345	V	83.2	Confident	82.7	Confident	92 Å²	92	38.7 Å²	38.7	56%	0.558	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-37.9	-178.6	-179	0	0	0	0	110.8	D343 L347	D343-V345 PolarHBondContact O-N 3.29Å; D343-V345 WeakPolarHBondContact OD1-CA 3.27Å; D343-V345 WeakPolarHBondContact OD1-CB 3.3Å; D343-V345 PolarHBondContact OD1-N 3Å; V345-L347 PolarHBondContact O-N 2.96Å
346	F	83.3	Confident	82.5	Confident	106 Å²	106	39 Å²	39	47%	0.465	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-13.8	178.4	-73.4	-77.7	0	0	0	113.9	V341 D343 V348 N349 L350	V341-F346 HydrophobicContact CG1-CB 3.67Å; D343-F346 PolarHBondContact O-N 3.31Å; D343-F346 WeakPolarHBondContact OD1-CD2 3.36Å; D343-F346 PolarHBondContact OD1-N 3.31Å; D343-F346 WeakPolarHBondContact OD2-CD2 3.49Å; D343-F346 WeakPolarHBondContact OD2-CE2 3.49Å; F346-V348 PolarHBondContact O-N 2.71Å; F346-N349 WeakPolarHBondContact O-CB 3.25Å; F346-N349 PolarHBondContact O-N 2.88Å; F346-N349 VanDerWaalsContact O-N 3.11Å; F346-L350 PolarHBondContact O-N 3.04Å
347	L	83.6	Confident	82.5	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-57.8	-37.6	176.6	-77.5	168.4	0	0	0	112.5	I185 F188 L275 I303 V305 V341 E344 V345 N349 L350 A351	I185-L347 HydrophobicContact CD1-CD1 3.35Å; F188-L347 HydrophobicContact CB-CB 4.24Å; F188-L347 HydrophobicContact CD2-CB 4.47Å; F188-L347 VanDerWaalsContact CD2-O 3.27Å; F188-L347 WeakPolarHBondContact CD2-O 3.44Å; L275-L347 HydrophobicContact CD1-CD1 4.12Å; L275-L347 HydrophobicContact CD1-CD2 3.91Å; I303-L347 HydrophobicContact CG2-CD2 3.73Å; V305-L347 HydrophobicContact CG1-CD1 4.39Å; V305-L347 HydrophobicContact CG2-CD1 4Å; V305-L347 HydrophobicContact CG2-CD2 3.89Å; V305-L347 HydrophobicContact CG2-CG 4.26Å; V341-L347 HydrophobicContact CB-CD2 4.29Å; V341-L347 HydrophobicContact CG1-CD2 4.18Å; V341-L347 HydrophobicContact CG1-CG 4.12Å; V341-L347 HydrophobicContact CG2-CD2 3.98Å; E344-L347 HydrophobicContact CB-CD1 4.41Å; E344-L347 WeakPolarHBondContact O-CB 3.41Å; E344-L347 PolarHBondContact O-N 3.4Å; V345-L347 PolarHBondContact O-N 2.96Å; L347-N349 PolarHBondContact O-N 3.32Å; L347-L350 WeakPolarHBondContact O-CA 3.02Å; L347-L350 VanDerWaalsContact O-CB 3.26Å; L347-L350 WeakPolarHBondContact O-CB 3.22Å; L347-L350 PolarHBondContact O-N 3.34Å; L347-A351 PolarHBondContact O-N 2.92Å
348	V	82.5	Confident	81.9	Confident	31 Å²	31	40.5 Å²	40.5	19%	0.188	21%	0.208	C	C	.	.	H	α-helix	trans	-62.3	-30.8	-178.7	-170.6	0	0	0	0	110.9	D187 R191 F346 L350	D187-V348 HydrophobicContact CB-CG2 4.07Å; R191-V348 HydrophobicContact CB-CG1 4.4Å; R191-V348 VanDerWaalsContact CD-CG1 3.47Å; R191-V348 VanDerWaalsContact CD-O 3.23Å; R191-V348 WeakPolarHBondContact CD-O 3.26Å; R191-V348 PolarHBondContact NE-O 3.34Å; R191-V348 PolarHBondContact NH1-O 3.33Å; F346-V348 PolarHBondContact O-N 2.71Å; V348-L350 VanDerWaalsContact C-N 3.31Å
349	N	81.5	Confident	80.9	Confident	95 Å²	95	40.6 Å²	40.6	51%	0.508	21%	0.208	S	C	.	.	H	α-helix	trans	-75.1	-21.5	174.6	-65.7	-24.9	0	0	0	113	R191 F346 L347	R191-N349 PolarHBondContact NH1-OD1 2.9Å; F346-N349 WeakPolarHBondContact O-CB 3.25Å; F346-N349 PolarHBondContact O-N 2.88Å; F346-N349 VanDerWaalsContact O-N 3.11Å; L347-N349 PolarHBondContact O-N 3.32Å
350	L	84.3	Confident	79.7	Confident	19 Å²	19	40.1 Å²	40.1	10%	0.099	21%	0.208	C	C	.	.	H	α-helix	trans	-75.4	-30.8	177.6	-179.6	62.6	0	0	0	112.4	I303 F339 V341 F346 L347 V348 D352 T353 L354	I303-L350 HydrophobicContact CD1-CD2 3.93Å; I303-L350 HydrophobicContact CG1-CD2 4.08Å; I303-L350 HydrophobicContact CG2-CD2 3.68Å; F339-L350 HydrophobicContact CB-CD1 4.01Å; F339-L350 HydrophobicContact CB-CD2 3.74Å; F339-L350 HydrophobicContact CD1-CD1 3.4Å; F339-L350 HydrophobicContact CD2-CD1 4.47Å; F339-L350 HydrophobicContact CE1-CD1 3.86Å; F339-L350 HydrophobicContact CG-CD1 3.71Å; F339-L350 HydrophobicContact CG-CD2 4.08Å; F339-L350 HydrophobicContact CG-CG 4.49Å; V341-L350 HydrophobicContact CG2-CD2 3.67Å; F346-L350 PolarHBondContact O-N 3.04Å; L347-L350 WeakPolarHBondContact O-CA 3.02Å; L347-L350 VanDerWaalsContact O-CB 3.26Å; L347-L350 WeakPolarHBondContact O-CB 3.22Å; L347-L350 PolarHBondContact O-N 3.34Å; V348-L350 VanDerWaalsContact C-N 3.31Å; L350-D352 PolarHBondContact O-N 2.84Å; L350-D352 VanDerWaalsContact O-N 3.08Å; L350-T353 PolarHBondContact O-N 3.45Å; L350-L354 HydrophobicContact CG-CB 4.47Å; L350-L354 PolarHBondContact O-N 3.2Å
351	A	82.8	Confident	78.5	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.008	19%	0.189	C	C	.	.	H	α-helix	trans	-48.1	-41.9	-178.6	0	0	0	0	0	112.7	F188 R191 F192 L347 T353 G355	F188-A351 HydrophobicContact CD2-CB 3.82Å; F188-A351 HydrophobicContact CE2-CB 4.04Å; R191-A351 HydrophobicContact CB-CB 4.05Å; R191-A351 HydrophobicContact CG-CB 3.97Å; F192-A351 HydrophobicContact CB-CB 4.24Å; L347-A351 PolarHBondContact O-N 2.92Å; A351-T353 PolarHBondContact O-N 3.06Å; A351-G355 PolarHBondContact O-N 2.9Å
352	D	74.9	Confident	77.2	Confident	31 Å²	31	37.6 Å²	37.6	17%	0.166	19%	0.193	C	C	.	.	H	α-helix	trans	-68.7	-34.3	-179.6	-66.5	9.7	0	0	0	113.3	R191 R195 L350 R356	R191-D352 IonicContact CZ-OD1 2.7Å; R191-D352 IonicContact CZ-OD2 3.38Å; R191-D352 IonicContact NE-OD1 3.95Å; R191-D352 PolarHBondContact NE-OD1 3.09Å; R191-D352 IonicContact NE-OD2 3.42Å; R191-D352 VanDerWaalsContact NH2-CG 3.32Å; R191-D352 IonicContact NH2-OD1 2.93Å; R191-D352 PolarHBondContact NH2-OD1 2.68Å; R191-D352 IonicContact NH2-OD2 2.78Å; R191-D352 PolarHBondContact NH2-OD2 3.28Å; R195-D352 IonicContact CZ-OD1 3.79Å; R195-D352 IonicContact CZ-OD2 3.99Å; R195-D352 IonicContact NE-OD1 3.53Å; R195-D352 IonicContact NH1-OD1 3.12Å; R195-D352 PolarHBondContact NH1-OD1 3.31Å; R195-D352 VanDerWaalsContact NH1-OD1 3.08Å; R195-D352 IonicContact NH1-OD2 2.77Å; R195-D352 PolarHBondContact NH1-OD2 3.34Å; R195-D352 IonicContact NH2-OD1 2.95Å; R195-D352 PolarHBondContact NH2-OD1 2.76Å; R195-D352 IonicContact NH2-OD2 2.64Å; R195-D352 PolarHBondContact NH2-OD2 3.36Å; L350-D352 PolarHBondContact O-N 2.84Å; L350-D352 VanDerWaalsContact O-N 3.08Å; D352-R356 WeakPolarHBondContact O-CG 3.16Å; D352-R356 PolarHBondContact O-N 3.2Å; D352-R356 PolarHBondContact O-NE 2.83Å
353	T	78.1	Confident	75.6	Confident	50 Å²	50	35.4 Å²	35.4	31%	0.307	18%	0.178	S	C	.	.	H	α-helix	trans	-82.6	-40.8	-179.3	-60.9	0	0	0	0	111	F339 L350 A351 R356 K357	F339-T353 HydrophobicContact CE1-CG2 4.08Å; L350-T353 PolarHBondContact O-N 3.45Å; A351-T353 PolarHBondContact O-N 3.06Å; T353-R356 PolarHBondContact O-N 3Å; T353-R356 PolarHBondContact OG1-NH2 3.24Å; T353-R356 VanDerWaalsContact OG1-NH2 3.16Å; T353-K357 PolarHBondContact O-N 2.98Å
354	L	82.3	Confident	74.3	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-62.8	-45.8	174	-177.8	69.6	0	0	0	111.1	F188 F192 V273 F301 I303 F339 L350 R356 K357 I358	F188-L354 HydrophobicContact CE2-CD2 4.15Å; F188-L354 HydrophobicContact CZ-CD2 3.63Å; F192-L354 HydrophobicContact CD2-CD2 4.28Å; F192-L354 HydrophobicContact CE2-CD2 4.15Å; F192-L354 HydrophobicContact CE2-CG 4.13Å; V273-L354 HydrophobicContact CG1-CD2 3.89Å; F301-L354 HydrophobicContact CB-CD1 4.13Å; F301-L354 HydrophobicContact CD1-CD1 3.83Å; F301-L354 HydrophobicContact CE1-CD1 4.47Å; F301-L354 HydrophobicContact CG-CD1 4.05Å; I303-L354 HydrophobicContact CD1-CD2 3.94Å; F339-L354 HydrophobicContact CD2-CD1 4.18Å; F339-L354 HydrophobicContact CE2-CD1 3.44Å; F339-L354 VanDerWaalsContact CE2-CD1 3.44Å; F339-L354 HydrophobicContact CZ-CD1 4.01Å; L350-L354 HydrophobicContact CG-CB 4.47Å; L350-L354 PolarHBondContact O-N 3.2Å; L354-R356 PolarHBondContact O-N 3.38Å; L354-K357 PolarHBondContact O-N 3.11Å; L354-I358 HydrophobicContact CD1-CD1 3.93Å; L354-I358 HydrophobicContact CD1-CG1 4.29Å; L354-I358 HydrophobicContact CD2-CD1 4.28Å; L354-I358 HydrophobicContact CG-CD1 3.76Å; L354-I358 HydrophobicContact CG-CG1 4.38Å; L354-I358 WeakPolarHBondContact O-CG1 3.49Å; L354-I358 PolarHBondContact O-N 2.68Å
355	G	75	Confident	72.7	Confident	3 Å²	3	38.2 Å²	38.2	3%	0.031	20%	0.201	C	C	.	.	H	α-helix	trans	-55	-49.1	176.4	0	0	0	0	0	112.2	A351 K357 I358 F359	A351-G355 PolarHBondContact O-N 2.9Å; G355-K357 VanDerWaalsContact C-N 3.33Å; G355-K357 PolarHBondContact O-N 3.04Å; G355-I358 PolarHBondContact O-N 3.24Å; G355-F359 VanDerWaalsContact C-CD2 3.46Å; G355-F359 WeakPolarHBondContact O-CB 3.5Å; G355-F359 WeakPolarHBondContact O-CD2 3.25Å; G355-F359 WeakPolarHBondContact O-CG 3.27Å; G355-F359 PolarHBondContact O-N 3.1Å
356	R	71.7	Confident	71.2	Confident	149 Å²	149	35.3 Å²	35.3	56%	0.562	19%	0.189	S	C	*	.	H	α-helix	trans	-58.4	-41.4	178	-75.4	-178.5	-66.7	147.7	-0.9	113.3	Q136 D352 T353 L354 A360	Q136-R356 PolarHBondContact NE2-O 2.66Å; D352-R356 WeakPolarHBondContact O-CG 3.16Å; D352-R356 PolarHBondContact O-N 3.2Å; D352-R356 PolarHBondContact O-NE 2.83Å; T353-R356 PolarHBondContact O-N 3Å; T353-R356 PolarHBondContact OG1-NH2 3.24Å; T353-R356 VanDerWaalsContact OG1-NH2 3.16Å; L354-R356 PolarHBondContact O-N 3.38Å; R356-A360 WeakPolarHBondContact O-CB 3.38Å; R356-A360 PolarHBondContact O-N 3.38Å
357	K	74.3	Confident	69.6	Low	39 Å²	39	34.8 Å²	34.8	17%	0.17	19%	0.192	C	C	.	.	H	α-helix	trans	-71	-39.5	179.1	-79.3	173.7	153.7	-166.4	0	112.4	F301 Q335 D336 F339 T353 L354 G355 A360 T369	F301-K357 HydrophobicContact CE1-CB 4.31Å; Q335-K357 PolarHBondContact O-NZ 3.04Å; D336-K357 VanDerWaalsContact CA-NZ 3.31Å; D336-K357 WeakPolarHBondContact O-CD 3.41Å; D336-K357 PolarHBondContact O-NZ 3.03Å; F339-K357 HydrophobicContact CE1-CD 3.84Å; F339-K357 HydrophobicContact CZ-CD 3.41Å; F339-K357 VanDerWaalsContact CZ-CD 3.41Å; T353-K357 PolarHBondContact O-N 2.98Å; L354-K357 PolarHBondContact O-N 3.11Å; G355-K357 VanDerWaalsContact C-N 3.33Å; G355-K357 PolarHBondContact O-N 3.04Å; K357-A360 PolarHBondContact O-N 3.43Å; K357-T369 VanDerWaalsContact O-CB 3.29Å; K357-T369 WeakPolarHBondContact O-CB 3.33Å; K357-T369 WeakPolarHBondContact O-CG2 3.22Å
358	I	74.3	Confident	68.1	Low	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-67.5	-45	175.7	-67.8	175.8	0	0	0	110.5	M167 I169 F192 V271 V273 F301 L354 G355 A360 L361	M167-I358 WeakPolarHBondContact CE-O 3.43Å; M167-I358 HydrophobicContact SD-CG2 4.23Å; I169-I358 HydrophobicContact CD1-CG2 4.03Å; F192-I358 HydrophobicContact CE2-CD1 3.94Å; F192-I358 HydrophobicContact CZ-CD1 3.82Å; V271-I358 HydrophobicContact CG1-CD1 4.23Å; V271-I358 HydrophobicContact CG1-CG1 4.33Å; V271-I358 HydrophobicContact CG1-CG2 4.35Å; V273-I358 HydrophobicContact CG2-CD1 3.75Å; F301-I358 HydrophobicContact CD2-CD1 4.38Å; F301-I358 HydrophobicContact CD2-CG1 4.13Å; F301-I358 HydrophobicContact CE1-CG1 4.36Å; F301-I358 HydrophobicContact CE2-CD1 4.45Å; F301-I358 HydrophobicContact CE2-CG1 3.74Å; F301-I358 HydrophobicContact CZ-CG1 3.85Å; L354-I358 HydrophobicContact CD1-CD1 3.93Å; L354-I358 HydrophobicContact CD1-CG1 4.29Å; L354-I358 HydrophobicContact CD2-CD1 4.28Å; L354-I358 HydrophobicContact CG-CD1 3.76Å; L354-I358 HydrophobicContact CG-CG1 4.38Å; L354-I358 WeakPolarHBondContact O-CG1 3.49Å; L354-I358 PolarHBondContact O-N 2.68Å; G355-I358 PolarHBondContact O-N 3.24Å; I358-A360 VanDerWaalsContact C-N 3.28Å; I358-A360 PolarHBondContact O-N 3.34Å; I358-L361 VanDerWaalsContact O-CB 3.24Å; I358-L361 WeakPolarHBondContact O-CB 3.45Å; I358-L361 PolarHBondContact O-N 2.88Å
359	F	68.9	Low	66.6	Low	30 Å²	30	37.5 Å²	37.5	13%	0.132	21%	0.205	C	C	.	.	H	α-helix	trans	-69.2	-23.7	179.6	-57	-40.2	0	0	0	113.4	R195 V196 G355 L361 E362	R195-F359 HydrophobicContact CB-CE2 4.33Å; V196-F359 HydrophobicContact CB-CZ 4.31Å; V196-F359 HydrophobicContact CG2-CE1 3.93Å; V196-F359 HydrophobicContact CG2-CZ 3.61Å; G355-F359 VanDerWaalsContact C-CD2 3.46Å; G355-F359 WeakPolarHBondContact O-CB 3.5Å; G355-F359 WeakPolarHBondContact O-CD2 3.25Å; G355-F359 WeakPolarHBondContact O-CG 3.27Å; G355-F359 PolarHBondContact O-N 3.1Å; F359-L361 PolarHBondContact O-N 3.47Å; F359-E362 WeakPolarHBondContact O-CB 3.32Å; F359-E362 WeakPolarHBondContact O-CG 2.81Å; F359-E362 PolarHBondContact O-N 3.1Å
360	A	62.6	Low	65.3	Low	10 Å²	10	36 Å²	36	8%	0.083	20%	0.202	C	C	.	.	H	α-helix	trans	-60	-26.3	170.7	0	0	0	0	0	112.1	R356 K357 I358 E362 A363 T364 T369	R356-A360 WeakPolarHBondContact O-CB 3.38Å; R356-A360 PolarHBondContact O-N 3.38Å; K357-A360 PolarHBondContact O-N 3.43Å; I358-A360 VanDerWaalsContact C-N 3.28Å; I358-A360 PolarHBondContact O-N 3.34Å; A360-E362 PolarHBondContact O-N 2.99Å; A360-A363 PolarHBondContact O-N 3.46Å; A360-T364 PolarHBondContact O-N 2.64Å; A360-T364 PolarHBondContact O-OG1 3.31Å; A360-T369 VanDerWaalsContact CB-O 3.32Å; A360-T369 WeakPolarHBondContact CB-O 3.44Å
361	L	64.9	Low	64.2	Low	6 Å²	6	36.2 Å²	36.2	3%	0.031	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-12.9	174.2	-60	169.2	0	0	0	113.3	M167 K269 V271 E299 F301 I358 F359 A363 T369	M167-L361 HydrophobicContact CE-CB 4.45Å; K269-L361 HydrophobicContact CD-CB 4.42Å; K269-L361 WeakPolarHBondContact CD-O 3.28Å; K269-L361 WeakPolarHBondContact CE-O 3.11Å; K269-L361 PolarHBondContact NZ-O 2.84Å; V271-L361 HydrophobicContact CG2-CD1 4.1Å; E299-L361 HydrophobicContact CG-CD1 4.28Å; F301-L361 HydrophobicContact CE2-CD1 4.17Å; F301-L361 HydrophobicContact CZ-CD1 4.24Å; I358-L361 VanDerWaalsContact O-CB 3.24Å; I358-L361 WeakPolarHBondContact O-CB 3.45Å; I358-L361 PolarHBondContact O-N 2.88Å; F359-L361 PolarHBondContact O-N 3.47Å; L361-A363 VanDerWaalsContact C-N 3.31Å; L361-T369 HydrophobicContact CD1-CG2 4.25Å; L361-T369 HydrophobicContact CD2-CG2 3.48Å; L361-T369 VanDerWaalsContact CD2-CG2 3.48Å; L361-T369 HydrophobicContact CG-CG2 3.68Å
362	E	61.1	Low	63.4	Low	30 Å²	30	39.2 Å²	39.2	14%	0.14	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-30.7	172.3	-62.3	-174.9	176.6	0	0	112.1	M167 F359 A360	M167-E362 HydrophobicContact CE-CB 4.14Å; M167-E362 HydrophobicContact CE-CG 2.94Å; M167-E362 WeakPolarHBondContact CE-OE1 3.45Å; F359-E362 WeakPolarHBondContact O-CB 3.32Å; F359-E362 WeakPolarHBondContact O-CG 2.81Å; F359-E362 PolarHBondContact O-N 3.1Å; A360-E362 PolarHBondContact O-N 2.99Å
363	A	49.4	Very low	63.5	Low	9 Å²	9	40.5 Å²	40.5	7%	0.074	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-25.3	-170	0	0	0	0	0	113.3	Y138 A360 L361	Y138-A363 HydrophobicContact CD2-CB 4.5Å; Y138-A363 HydrophobicContact CE2-CB 3.4Å; Y138-A363 VanDerWaalsContact CE2-CB 3.4Å; Y138-A363 VanDerWaalsContact OH-CB 3.22Å; Y138-A363 WeakPolarHBondContact OH-CB 3.45Å; A360-A363 PolarHBondContact O-N 3.46Å; L361-A363 VanDerWaalsContact C-N 3.31Å
364	T	56.1	Low	63.7	Low	13 Å²	13	38.7 Å²	38.7	8%	0.08	21%	0.213	C	C	.	.			trans	-98.2	139.3	-177	62	0	0	0	0	112.3	K269 A360 G366 L368	K269-T364 PolarHBondContact NZ-O 3.44Å; A360-T364 PolarHBondContact O-N 2.64Å; A360-T364 PolarHBondContact O-OG1 3.31Å; T364-G366 VanDerWaalsContact C-N 3.3Å; T364-G366 PolarHBondContact OG1-O 2.81Å; T364-L368 PolarHBondContact OG1-O 2.82Å
365	S	51.4	Low	63.6	Low	89 Å²	89	38.9 Å²	38.9	62%	0.622	21%	0.214	S	C	*	.	S	Bend	trans	-78.1	-9.6	171.9	35.8	0	0	0	0	114
366	G	53.1	Low	64.1	Low	30 Å²	30	40.4 Å²	40.4	31%	0.309	22%	0.221	S	C	.	.	S	Bend	trans	-112.8	174.3	-178.6	0	0	0	0	0	115.1	T364 L368	T364-G366 VanDerWaalsContact C-N 3.3Å; T364-G366 PolarHBondContact OG1-O 2.81Å; G366-L368 PolarHBondContact O-N 2.87Å
367	N	49.1	Very low	64.9	Low	96 Å²	96	33.3 Å²	33.3	51%	0.513	19%	0.194	S	C	.	.	S	Bend	trans	-80.1	12.6	179.2	-64.2	16.6	0	0	0	113.8	E299 H337	E299-N367 PolarHBondContact OE2-ND2 3.2Å; H337-N367 PolarHBondContact CE1-O 2.8Å
368	L	52	Low	65.8	Low	76 Å²	76	33 Å²	33	40%	0.398	19%	0.193	S	C	.	.			trans	-99.8	130	177.7	-77.3	91	0	0	0	110	P333 T364 G366 S371	P333-L368 HydrophobicContact CG-CD2 4.48Å; P333-L368 HydrophobicContact CG-CG 4.19Å; T364-L368 PolarHBondContact OG1-O 2.82Å; G366-L368 PolarHBondContact O-N 2.87Å; L368-S371 WeakPolarHBondContact CB-OG 3.34Å
369	T	52	Low	66.6	Low	12 Å²	12	33 Å²	33	7%	0.074	19%	0.193	C	C	.	.	S	Bend	trans	-104.8	-2.3	-175.9	59.6	0	0	0	0	113.6	F301 D336 K357 A360 L361	F301-T369 HydrophobicContact CZ-CG2 4.25Å; D336-T369 WeakPolarHBondContact CB-OG1 3.29Å; K357-T369 VanDerWaalsContact O-CB 3.29Å; K357-T369 WeakPolarHBondContact O-CB 3.33Å; K357-T369 WeakPolarHBondContact O-CG2 3.22Å; A360-T369 VanDerWaalsContact CB-O 3.32Å; A360-T369 WeakPolarHBondContact CB-O 3.44Å; L361-T369 HydrophobicContact CD1-CG2 4.25Å; L361-T369 HydrophobicContact CD2-CG2 3.48Å; L361-T369 VanDerWaalsContact CD2-CG2 3.48Å; L361-T369 HydrophobicContact CG-CG2 3.68Å
370	S	52.4	Low	67.8	Low	63 Å²	63	31.6 Å²	31.6	44%	0.441	19%	0.187	S	C	.	.	S	Bend	trans	-125	-2.8	-173.9	77.8	0	0	0	0	115.3	D336	D336-S370 PolarHBondContact OD1-OG 3.36Å; D336-S370 PolarHBondContact OD2-OG 2.83Å
371	S	61.5	Low	69.3	Low	23 Å²	23	33.6 Å²	33.6	16%	0.161	19%	0.194	C	C	.	.			trans	-112.8	132.8	180	57.3	0	0	0	0	110.4	L368 D399	L368-S371 WeakPolarHBondContact CB-OG 3.34Å; S371-D399 WeakPolarHBondContact CA-OD1 3.5Å; S371-D399 WeakPolarHBondContact CB-OD2 3.1Å
372	F	66.8	Low	70.8	Confident	65 Å²	65	33.7 Å²	33.7	29%	0.285	20%	0.195	S	C	.	.			trans	-91.8	126.9	173.4	-53.6	-76.8	0	0	0	109	Y138 M376 Y398 D399 W400	Y138-F372 HydrophobicContact CE1-CD1 4.47Å; Y138-F372 HydrophobicContact CE1-CE1 4.13Å; F372-M376 HydrophobicContact CB-CB 4.39Å; F372-M376 HydrophobicContact CB-CG 4.34Å; F372-M376 HydrophobicContact CD1-CG 3.85Å; F372-M376 HydrophobicContact CD2-CG 4.49Å; F372-M376 HydrophobicContact CE1-CG 4.27Å; F372-M376 HydrophobicContact CG-CB 4.48Å; F372-M376 HydrophobicContact CG-CG 3.97Å; F372-Y398 CarbonylContact O-C 3.57Å; F372-Y398 WeakPolarHBondContact O-CA 3.33Å; F372-Y398 PolarHBondContact O-N 2.62Å; F372-D399 PolarHBondContact N-OD1 2.05Å; F372-D399 PolarHBondContact O-N 3Å; F372-W400 HydrophobicContact CD2-CH2 4.15Å; F372-W400 HydrophobicContact CD2-CZ3 4.03Å; F372-W400 HydrophobicContact CE2-CH2 4.12Å; F372-W400 HydrophobicContact CE2-CZ3 4.23Å
373	D	77.3	Confident	72.4	Confident	58 Å²	58	33.1 Å²	33.1	31%	0.31	20%	0.195	S	C	.	.	S	Bend	trans	-86.4	-82	172.1	-74.4	-29	0	0	0	109.3	E375 A397 Y398	D373-E375 PolarHBondContact N-OE2 2.99Å; D373-A397 CarbonylContact O-C 3.57Å; D373-A397 VanDerWaalsContact O-CA 3.24Å; D373-A397 WeakPolarHBondContact O-CA 3.35Å; D373-Y398 HydrophobicContact CB-CD1 4.29Å; D373-Y398 HydrophobicContact CB-CE1 4.14Å; D373-Y398 PolarHBondContact O-N 3.12Å
374	M	80.8	Confident	74.5	Confident	12 Å²	12	34.2 Å²	34.2	6%	0.059	20%	0.199	C	C	.	.	S	Bend	trans	-117	-4.6	-176.3	-69.8	-64.1	-70.3	0	0	113.6	M376 S377 A397 T403 V405	M374-M376 VanDerWaalsContact C-N 3.28Å; M374-M376 PolarHBondContact O-N 2.87Å; M374-S377 WeakPolarHBondContact O-CB 3.46Å; M374-S377 PolarHBondContact O-N 2.81Å; M374-S377 PolarHBondContact O-OG 2.9Å; M374-A397 HydrophobicContact SD-CB 3.68Å; M374-T403 HydrophobicContact CE-CG2 4.35Å; M374-T403 HydrophobicContact SD-CG2 4.02Å; M374-V405 HydrophobicContact CE-CG2 3.9Å
375	E	80.4	Confident	76.1	Confident	4 Å²	4	34.5 Å²	34.5	2%	0.019	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-38.1	-173.8	-56.2	80.6	-179.9	0	0	111.5	Y138 I139 D373	Y138-E375 HydrophobicContact CD1-CB 3.92Å; Y138-E375 HydrophobicContact CD2-CB 4.44Å; Y138-E375 HydrophobicContact CE1-CB 4.38Å; Y138-E375 HydrophobicContact CG-CB 3.98Å; I139-E375 CarbonylContact C-O 3.57Å; I139-E375 PolarHBondContact N-O 2.84Å; D373-E375 PolarHBondContact N-OE2 2.99Å
376	M	85.2	Confident	77.7	Confident	35 Å²	35	30.9 Å²	30.9	17%	0.172	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103	22.7	177.4	-62.7	-63.4	-71.7	0	0	112.3	Y138 I139 F372 M374 Q378 G396	Y138-M376 HydrophobicContact CD1-CG 4.44Å; Y138-M376 HydrophobicContact CD1-SD 4Å; I139-M376 HydrophobicContact CB-CE 4.14Å; I139-M376 HydrophobicContact CB-SD 4.23Å; I139-M376 HydrophobicContact CD1-CE 4.23Å; I139-M376 HydrophobicContact CG1-CE 4.16Å; I139-M376 HydrophobicContact CG1-SD 4.46Å; I139-M376 PolarHBondContact N-SD 3Å; I139-M376 VanDerWaalsContact N-SD 3.36Å; I139-M376 CarbonylContact O-C 3.57Å; I139-M376 VanDerWaalsContact O-CA 3.22Å; I139-M376 WeakPolarHBondContact O-CA 3.45Å; F372-M376 HydrophobicContact CB-CB 4.39Å; F372-M376 HydrophobicContact CB-CG 4.34Å; F372-M376 HydrophobicContact CD1-CG 3.85Å; F372-M376 HydrophobicContact CD2-CG 4.49Å; F372-M376 HydrophobicContact CE1-CG 4.27Å; F372-M376 HydrophobicContact CG-CB 4.48Å; F372-M376 HydrophobicContact CG-CG 3.97Å; M374-M376 VanDerWaalsContact C-N 3.28Å; M374-M376 PolarHBondContact O-N 2.87Å; M376-Q378 VanDerWaalsContact C-N 3.27Å; M376-Q378 PolarHBondContact O-N 2.82Å; M376-G396 CarbonylContact O-C 3.54Å; M376-G396 WeakPolarHBondContact O-CA 3.22Å
377	S	88.7	Confident	78.9	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.201	C	C	.	.			trans	-60.2	-29	-168.7	51.2	0	0	0	0	115.3	S140 G159 M374 A379 A394 V395 G396	S140-S377 PolarHBondContact O-OG 3.34Å; G159-S377 WeakPolarHBondContact CA-OG 3.5Å; M374-S377 WeakPolarHBondContact O-CB 3.46Å; M374-S377 PolarHBondContact O-N 2.81Å; M374-S377 PolarHBondContact O-OG 2.9Å; S377-A379 PolarHBondContact O-N 2.88Å; S377-A394 CarbonylContact O-C 3.52Å; S377-A394 VanDerWaalsContact O-CA 3.25Å; S377-A394 WeakPolarHBondContact O-CA 3.48Å; S377-V395 PolarHBondContact O-N 2.84Å; S377-G396 PolarHBondContact O-N 2.84Å
378	Q	93	Very high	80.2	Confident	33 Å²	33	39.2 Å²	39.2	15%	0.154	20%	0.204	C	C	.	.			trans	50	40	-172	-51.5	-169	-88.2	0	0	112.4	P127 I139 S140 M376 G380 F381 V395	P127-Q378 HydrophobicContact CB-CB 4.47Å; P127-Q378 WeakPolarHBondContact O-CB 3.49Å; I139-Q378 HydrophobicContact CG2-CG 4.11Å; I139-Q378 PolarHBondContact O-N 3.46Å; S140-Q378 CarbonylContact O-C 3.3Å; S140-Q378 VanDerWaalsContact O-CA 3.31Å; S140-Q378 WeakPolarHBondContact O-CA 3.09Å; S140-Q378 PolarHBondContact O-N 3.3Å; M376-Q378 VanDerWaalsContact C-N 3.27Å; M376-Q378 PolarHBondContact O-N 2.82Å; Q378-G380 PolarHBondContact O-N 3.01Å; Q378-F381 WeakPolarHBondContact O-CB 3.5Å; Q378-F381 PolarHBondContact O-N 2.89Å; Q378-V395 HydrophobicContact CB-CG2 4.1Å
379	A	92.9	Very high	81.7	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	133.9	179.3	0	0	0	0	0	111	S140 P158 S377 G393 A394	S140-A379 PolarHBondContact O-N 3.29Å; P158-A379 HydrophobicContact CB-CB 4.37Å; P158-A379 HydrophobicContact CG-CB 4.11Å; S377-A379 PolarHBondContact O-N 2.88Å; A379-G393 WeakPolarHBondContact CA-O 3.45Å; A379-A394 HydrophobicContact CB-CB 4.21Å
380	G	92.8	Very high	83.4	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	89.9	16.8	-171.3	0	0	0	0	0	113.8	T113 C125 Q378 S382 G393	T113-G380 PolarHBondContact OG1-O 3.15Å; T113-G380 VanDerWaalsContact OG1-O 3.12Å; C125-G380 WeakPolarHBondContact CB-O 3.08Å; Q378-G380 PolarHBondContact O-N 3.01Å; G380-S382 VanDerWaalsContact C-N 3.32Å; G380-G393 PolarHBondContact N-O 2.84Å
381	F	95.2	Very high	85.3	Confident	52 Å²	52	33.8 Å²	33.8	23%	0.228	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	-44.4	169.8	-169.7	-85.1	0	0	0	111	T113 P127 Q378 G393 V395 Y438	T113-F381 PolarHBondContact OG1-O 2.68Å; P127-F381 HydrophobicContact CB-CB 4.32Å; P127-F381 HydrophobicContact CB-CD2 4.26Å; P127-F381 HydrophobicContact CG-CD2 4.48Å; Q378-F381 WeakPolarHBondContact O-CB 3.5Å; Q378-F381 PolarHBondContact O-N 2.89Å; F381-G393 PolarHBondContact N-O 2.83Å; F381-V395 HydrophobicContact CB-CG1 4.2Å; F381-V395 HydrophobicContact CB-CG2 4.1Å; F381-V395 HydrophobicContact CD1-CG1 3.93Å; F381-V395 HydrophobicContact CD2-CG2 3.81Å; F381-V395 HydrophobicContact CE2-CG2 4.42Å; F381-V395 HydrophobicContact CG-CG1 3.99Å; F381-V395 HydrophobicContact CG-CG2 3.89Å; F381-Y438 HydrophobicContact CD1-CD2 4.3Å; F381-Y438 HydrophobicContact CD1-CG 4.45Å; F381-Y438 WeakPolarHBondContact CD1-O 3.29Å; F381-Y438 HydrophobicContact CE1-CD1 4.05Å; F381-Y438 AromaticContact CE1-CD2 3.53Å; F381-Y438 HydrophobicContact CE1-CD2 3.53Å; F381-Y438 AromaticContact CE1-CE1 3.93Å; F381-Y438 HydrophobicContact CE1-CE1 3.93Å; F381-Y438 AromaticContact CE1-CE2 3.39Å; F381-Y438 HydrophobicContact CE1-CE2 3.39Å; F381-Y438 AromaticContact CE1-CG 3.87Å; F381-Y438 HydrophobicContact CE1-CG 3.87Å; F381-Y438 AromaticContact CE1-CZ 3.6Å; F381-Y438 AromaticContact CZ-CD2 3.99Å; F381-Y438 HydrophobicContact CZ-CD2 3.99Å; F381-Y438 AromaticContact CZ-CE2 3.46Å; F381-Y438 HydrophobicContact CZ-CE2 3.46Å; F381-Y438 VanDerWaalsContact CZ-CE2 3.46Å; F381-Y438 AromaticContact CZ-CZ 3.78Å
382	S	95.8	Very high	86.9	Confident	7 Å²	7	32.7 Å²	32.7	5%	0.049	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	156.8	165.7	56.6	0	0	0	0	109.5	G380 G393 G437 Y438	G380-S382 VanDerWaalsContact C-N 3.32Å; S382-G393 PolarHBondContact O-N 3.45Å; S382-G437 PolarHBondContact OG-O 3.43Å; S382-Y438 VanDerWaalsContact CB-O 3.27Å; S382-Y438 WeakPolarHBondContact CB-O 3.41Å; S382-Y438 PolarHBondContact OG-O 3.2Å
383	A	94.1	Very high	88.2	Confident	18 Å²	18	29.6 Å²	29.6	15%	0.149	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	136.9	178.8	0	0	0	0	0	110.6	T113 V115 L391 L392	T113-A383 HydrophobicContact CG2-CB 3.74Å; V115-A383 HydrophobicContact CB-CB 4.28Å; V115-A383 HydrophobicContact CG1-CB 3.87Å; A383-L391 VanDerWaalsContact CA-O 3.25Å; A383-L391 WeakPolarHBondContact CA-O 3.45Å; A383-L392 HydrophobicContact CB-CD2 3.76Å
384	H	93.6	Very high	89	Confident	32 Å²	32	26.9 Å²	26.9	15%	0.148	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	129	175.5	178.6	60	0	0	0	111	L391 V440 Q441 S442	H384-L391 PolarHBondContact N-O 3.32Å; H384-L391 PolarHBondContact O-N 2.9Å; H384-V440 HydrophobicContact CB-CG2 3.94Å; H384-V440 VanDerWaalsContact CB-O 3.26Å; H384-V440 WeakPolarHBondContact CB-O 3.36Å; H384-Q441 PolarHBondContact CE1-OE1 2.99Å; H384-Q441 VanDerWaalsContact CG-OE1 3.3Å; H384-Q441 PolarHBondContact ND1-OE1 2.82Å; H384-S442 PolarHBondContact CD2-N 2.8Å; H384-S442 VanDerWaalsContact CD2-N 3.3Å; H384-S442 PolarHBondContact CD2-OG 2.79Å; H384-S442 PolarHBondContact NE2-N 3.3Å; H384-S442 PolarHBondContact NE2-OG 2.85Å
385	A	89.6	Confident	89.6	Confident	20 Å²	20	26.5 Å²	26.5	17%	0.165	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	133	178.4	0	0	0	0	0	110.6	V115 T116 P118 L390	V115-A385 HydrophobicContact CG2-CB 3.95Å; T116-A385 WeakPolarHBondContact O-CB 3.47Å; P118-A385 HydrophobicContact CG-CB 3.93Å; A385-L390 HydrophobicContact CB-CD1 4.19Å
386	F	86.4	Confident	90	Very high	13 Å²	13	26.3 Å²	26.3	6%	0.057	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	173.5	173.2	70.1	-80.1	0	0	0	109.8	D388 G389 L391 M406 Y451	F386-D388 HydrophobicContact CD2-CB 4.31Å; F386-D388 HydrophobicContact CE2-CB 3.83Å; F386-D388 PolarHBondContact O-N 2.82Å; F386-D388 VanDerWaalsContact O-N 3.1Å; F386-G389 VanDerWaalsContact CD1-C 3.47Å; F386-G389 WeakPolarHBondContact CD1-O 3.37Å; F386-G389 PolarHBondContact N-O 2.84Å; F386-G389 PolarHBondContact O-N 2.81Å; F386-L391 HydrophobicContact CD1-CD1 4.44Å; F386-L391 HydrophobicContact CD1-CD2 4.39Å; F386-L391 HydrophobicContact CD1-CG 3.92Å; F386-L391 HydrophobicContact CE1-CD2 3.96Å; F386-L391 HydrophobicContact CE1-CG 3.94Å; F386-M406 HydrophobicContact CE1-CE 4.43Å; F386-M406 HydrophobicContact CE1-CG 4.22Å; F386-M406 HydrophobicContact CE1-SD 4.46Å; F386-M406 HydrophobicContact CZ-CE 4.17Å; F386-M406 HydrophobicContact CZ-CG 4.1Å; F386-M406 HydrophobicContact CZ-SD 3.89Å; F386-Y451 HydrophobicContact CD1-CE1 4.38Å; F386-Y451 HydrophobicContact CD2-CE1 4.11Å; F386-Y451 HydrophobicContact CE1-CE1 4.32Å; F386-Y451 HydrophobicContact CE2-CE1 4.05Å; F386-Y451 VanDerWaalsContact CE2-OH 3.32Å; F386-Y451 WeakPolarHBondContact CE2-OH 3.36Å; F386-Y451 HydrophobicContact CG-CE1 4.29Å; F386-Y451 HydrophobicContact CZ-CE1 4.17Å
387	K	76.9	Confident	90.1	Very high	191 Å²	191	24.6 Å²	24.6	83%	0.83	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	-35.6	-169.3	-168.9	175.5	178.7	178.6	0	114.5
388	D	76.4	Confident	89.8	Confident	109 Å²	109	26 Å²	26	58%	0.583	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.1	6.2	-172.3	-51.8	-47.4	0	0	0	113.5	F386	F386-D388 HydrophobicContact CD2-CB 4.31Å; F386-D388 HydrophobicContact CE2-CB 3.83Å; F386-D388 PolarHBondContact O-N 2.82Å; F386-D388 VanDerWaalsContact O-N 3.1Å
389	G	83.1	Confident	89.2	Confident	20 Å²	20	26.1 Å²	26.1	21%	0.206	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.4	-157.7	-178.6	0	0	0	0	0	115.6	F386 Q407	F386-G389 VanDerWaalsContact CD1-C 3.47Å; F386-G389 WeakPolarHBondContact CD1-O 3.37Å; F386-G389 PolarHBondContact N-O 2.84Å; F386-G389 PolarHBondContact O-N 2.81Å; G389-Q407 CarbonylContact C-O 3.57Å; G389-Q407 VanDerWaalsContact CA-O 3.22Å; G389-Q407 WeakPolarHBondContact CA-O 3.33Å
390	L	89.3	Confident	88.9	Confident	18 Å²	18	30.1 Å²	30.1	9%	0.094	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	139.3	-177.5	-174.6	74.1	0	0	0	110.8	V115 M123 A385 L392 M406 Q407	V115-L390 HydrophobicContact CG1-CD1 4.07Å; M123-L390 HydrophobicContact CE-CD2 3.53Å; M123-L390 HydrophobicContact SD-CD2 3.25Å; M123-L390 WeakPolarHBondContact SD-CD2 3.04Å; A385-L390 HydrophobicContact CB-CD1 4.19Å; L390-L392 HydrophobicContact CD2-CD1 4.23Å; L390-L392 HydrophobicContact CD2-CD2 3.57Å; L390-L392 HydrophobicContact CD2-CG 3.84Å; L390-L392 HydrophobicContact CG-CD2 4.06Å; L390-L392 HydrophobicContact CG-CG 4.2Å; L390-M406 WeakPolarHBondContact O-CA 3.37Å; L390-Q407 HydrophobicContact CB-CB 4.46Å; L390-Q407 PolarHBondContact N-O 3.22Å; L390-Q407 PolarHBondContact O-N 2.83Å
391	L	92.3	Very high	88.6	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	131.4	168.2	-58.3	172.2	0	0	0	108.6	A383 H384 F386 V404 M406 V440 Y451	A383-L391 VanDerWaalsContact CA-O 3.25Å; A383-L391 WeakPolarHBondContact CA-O 3.45Å; H384-L391 PolarHBondContact N-O 3.32Å; H384-L391 PolarHBondContact O-N 2.9Å; F386-L391 HydrophobicContact CD1-CD1 4.44Å; F386-L391 HydrophobicContact CD1-CD2 4.39Å; F386-L391 HydrophobicContact CD1-CG 3.92Å; F386-L391 HydrophobicContact CE1-CD2 3.96Å; F386-L391 HydrophobicContact CE1-CG 3.94Å; L391-V404 HydrophobicContact CB-CG1 4.23Å; L391-V404 HydrophobicContact CD2-CG1 4.22Å; L391-M406 HydrophobicContact CD2-CB 4.24Å; L391-M406 HydrophobicContact CD2-CE 3.36Å; L391-M406 HydrophobicContact CD2-CG 4.03Å; L391-V440 HydrophobicContact CB-CB 4.26Å; L391-V440 HydrophobicContact CB-CG2 4.01Å; L391-Y451 HydrophobicContact CD1-CD1 3.79Å; L391-Y451 HydrophobicContact CD1-CE1 4.41Å; L391-Y451 HydrophobicContact CD2-CD1 4.09Å; L391-Y451 HydrophobicContact CD2-CE1 4.32Å; L391-Y451 HydrophobicContact CG-CD1 4.48Å
392	L	94	Very high	88.3	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	120	175.4	-65.3	177.3	0	0	0	109.3	M123 P158 A383 L390 V404 V405	M123-L392 HydrophobicContact SD-CD2 4.49Å; P158-L392 HydrophobicContact CG-CD1 4.02Å; A383-L392 HydrophobicContact CB-CD2 3.76Å; L390-L392 HydrophobicContact CD2-CD1 4.23Å; L390-L392 HydrophobicContact CD2-CD2 3.57Å; L390-L392 HydrophobicContact CD2-CG 3.84Å; L390-L392 HydrophobicContact CG-CD2 4.06Å; L390-L392 HydrophobicContact CG-CG 4.2Å; L392-V404 CarbonylContact O-C 3.57Å; L392-V404 WeakPolarHBondContact O-CA 3.41Å; L392-V405 HydrophobicContact CB-CB 4.2Å; L392-V405 PolarHBondContact N-O 2.94Å; L392-V405 PolarHBondContact O-N 2.99Å
393	G	94.9	Very high	88.1	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	132.4	173.1	0	0	0	0	0	112	A379 G380 F381 S382 G437	A379-G393 WeakPolarHBondContact CA-O 3.45Å; G380-G393 PolarHBondContact N-O 2.84Å; F381-G393 PolarHBondContact N-O 2.83Å; S382-G393 PolarHBondContact O-N 3.45Å; G393-G437 WeakPolarHBondContact CA-O 3.16Å
394	A	94.2	Very high	88	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	76.7	-179.6	0	0	0	0	0	110.2	S377 A379 G396 A397 G402 T403 V405	S377-A394 CarbonylContact O-C 3.52Å; S377-A394 VanDerWaalsContact O-CA 3.25Å; S377-A394 WeakPolarHBondContact O-CA 3.48Å; A379-A394 HydrophobicContact CB-CB 4.21Å; A394-G396 VanDerWaalsContact C-N 3.33Å; A394-G396 PolarHBondContact O-N 2.81Å; A394-A397 HydrophobicContact CB-CB 4.46Å; A394-A397 WeakPolarHBondContact O-CB 3.37Å; A394-A397 PolarHBondContact O-N 2.82Å; A394-G402 CarbonylContact O-C 3.58Å; A394-G402 VanDerWaalsContact O-CA 3.26Å; A394-G402 WeakPolarHBondContact O-CA 3.46Å; A394-T403 HydrophobicContact CB-CG2 3.85Å; A394-T403 PolarHBondContact N-O 2.75Å; A394-T403 PolarHBondContact O-N 3.14Å; A394-V405 HydrophobicContact CB-CG2 4.26Å
395	V	93.8	Very high	87.9	Confident	4 Å²	4	25.3 Å²	25.3	2%	0.024	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-29	-170.2	-67.1	0	0	0	0	114.8	S377 Q378 F381 W400 Y438	S377-V395 PolarHBondContact O-N 2.84Å; Q378-V395 HydrophobicContact CB-CG2 4.1Å; F381-V395 HydrophobicContact CB-CG1 4.2Å; F381-V395 HydrophobicContact CB-CG2 4.1Å; F381-V395 HydrophobicContact CD1-CG1 3.93Å; F381-V395 HydrophobicContact CD2-CG2 3.81Å; F381-V395 HydrophobicContact CE2-CG2 4.42Å; F381-V395 HydrophobicContact CG-CG1 3.99Å; F381-V395 HydrophobicContact CG-CG2 3.89Å; V395-W400 CarbonylContact O-C 3.52Å; V395-W400 WeakPolarHBondContact O-CA 3.47Å; V395-Y438 VanDerWaalsContact CG1-CA 3.49Å; V395-Y438 HydrophobicContact CG1-CD2 4.28Å
396	G	87.9	Confident	87.9	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-0.6	-175.4	0	0	0	0	0	114	M376 S377 A394 W400	M376-G396 CarbonylContact O-C 3.54Å; M376-G396 WeakPolarHBondContact O-CA 3.22Å; S377-G396 PolarHBondContact O-N 2.84Å; A394-G396 VanDerWaalsContact C-N 3.33Å; A394-G396 PolarHBondContact O-N 2.81Å; G396-W400 PolarHBondContact O-N 2.88Å
397	A	87.1	Confident	87.8	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-66.2	148.1	179.7	0	0	0	0	0	112	D373 M374 A394 D399 W400 N401 G402 T403	D373-A397 CarbonylContact O-C 3.57Å; D373-A397 VanDerWaalsContact O-CA 3.24Å; D373-A397 WeakPolarHBondContact O-CA 3.35Å; M374-A397 HydrophobicContact SD-CB 3.68Å; A394-A397 HydrophobicContact CB-CB 4.46Å; A394-A397 WeakPolarHBondContact O-CB 3.37Å; A394-A397 PolarHBondContact O-N 2.82Å; A397-D399 PolarHBondContact O-N 3.42Å; A397-W400 PolarHBondContact O-N 3.27Å; A397-N401 PolarHBondContact O-N 3.48Å; A397-G402 PolarHBondContact O-N 2.64Å; A397-T403 HydrophobicContact CB-CG2 3.65Å
398	Y	82.6	Confident	88	Confident	30 Å²	30	18.9 Å²	18.9	12%	0.118	10%	0.098	C	C	.	.	H	α-helix	trans	55.3	49	173.5	-54.5	-60.8	0	0	0	114.3	F372 D373 N401 T403 P415 K417	F372-Y398 CarbonylContact O-C 3.57Å; F372-Y398 WeakPolarHBondContact O-CA 3.33Å; F372-Y398 PolarHBondContact O-N 2.62Å; D373-Y398 HydrophobicContact CB-CD1 4.29Å; D373-Y398 HydrophobicContact CB-CE1 4.14Å; D373-Y398 PolarHBondContact O-N 3.12Å; Y398-N401 WeakPolarHBondContact O-CB 3.5Å; Y398-N401 PolarHBondContact O-N 3.06Å; Y398-T403 HydrophobicContact CE2-CG2 4.18Å; Y398-P415 PolarHBondContact OH-O 3.12Å; Y398-K417 HydrophobicContact CD1-CB 4.17Å; Y398-K417 HydrophobicContact CD2-CB 4.05Å; Y398-K417 HydrophobicContact CD2-CG 4.49Å; Y398-K417 HydrophobicContact CE2-CB 4.46Å; Y398-K417 HydrophobicContact CG-CB 3.88Å; Y398-K417 HydrophobicContact CG-CD 4.42Å; Y398-K417 HydrophobicContact CG-CG 4.16Å; Y398-K417 PolarHBondContact O-NZ 3.29Å
399	D	80.7	Confident	87.8	Confident	35 Å²	35	19 Å²	19	19%	0.187	11%	0.114	C	C	.	.	H	α-helix	trans	60.6	51.5	-172.3	-51.9	-55.9	0	0	0	112.8	S371 F372 A397 N401 K417	S371-D399 WeakPolarHBondContact CA-OD1 3.5Å; S371-D399 WeakPolarHBondContact CB-OD2 3.1Å; F372-D399 PolarHBondContact N-OD1 2.05Å; F372-D399 PolarHBondContact O-N 3Å; A397-D399 PolarHBondContact O-N 3.42Å; D399-N401 PolarHBondContact O-N 2.82Å; D399-N401 VanDerWaalsContact O-N 3.1Å; D399-K417 IonicContact OD2-NZ 2.87Å
400	W	86.4	Confident	86.9	Confident	83 Å²	83	27.1 Å²	27.1	31%	0.314	15%	0.147	S	C	.	.	H	α-helix	trans	59.6	16.1	-177.6	-62.6	-90.4	0	0	0	114.8	F372 V395 G396 A397 G402 A433 E434 Y435	F372-W400 HydrophobicContact CD2-CH2 4.15Å; F372-W400 HydrophobicContact CD2-CZ3 4.03Å; F372-W400 HydrophobicContact CE2-CH2 4.12Å; F372-W400 HydrophobicContact CE2-CZ3 4.23Å; V395-W400 CarbonylContact O-C 3.52Å; V395-W400 WeakPolarHBondContact O-CA 3.47Å; G396-W400 PolarHBondContact O-N 2.88Å; A397-W400 PolarHBondContact O-N 3.27Å; W400-G402 PolarHBondContact O-N 3.45Å; W400-A433 HydrophobicContact CB-CB 3.91Å; W400-A433 CarbonylContact O-C 3.53Å; W400-A433 VanDerWaalsContact O-C 3.3Å; W400-A433 WeakPolarHBondContact O-CA 3.2Å; W400-E434 PolarHBondContact O-N 3.26Å; W400-Y435 HydrophobicContact CB-CD1 3.98Å; W400-Y435 HydrophobicContact CB-CE1 3.74Å; W400-Y435 AromaticContact CD1-CE1 3.64Å; W400-Y435 AromaticContact CG-CE1 3.96Å; W400-Y435 HydrophobicContact CG-CE1 3.96Å; W400-Y435 PolarHBondContact O-N 3.38Å
401	N	85.4	Confident	86.2	Confident	5 Å²	5	29 Å²	29	3%	0.027	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-35.6	168.7	-152.9	36.1	0	0	0	110.1	A397 Y398 D399 Y421 G431 E434 L436	A397-N401 PolarHBondContact O-N 3.48Å; Y398-N401 WeakPolarHBondContact O-CB 3.5Å; Y398-N401 PolarHBondContact O-N 3.06Å; D399-N401 PolarHBondContact O-N 2.82Å; D399-N401 VanDerWaalsContact O-N 3.1Å; N401-Y421 PolarHBondContact ND2-OH 3.03Å; N401-Y421 PolarHBondContact OD1-OH 3.13Å; N401-G431 PolarHBondContact OD1-O 2.83Å; N401-E434 WeakPolarHBondContact OD1-CG 3.37Å; N401-L436 WeakPolarHBondContact O-CB 3.35Å; N401-L436 PolarHBondContact O-N 3.41Å
402	G	89.4	Confident	85.7	Confident	2 Å²	2	32.6 Å²	32.6	2%	0.021	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	86.2	157.6	177.7	0	0	0	0	0	112.6	A394 A397 W400 L436	A394-G402 CarbonylContact O-C 3.58Å; A394-G402 VanDerWaalsContact O-CA 3.26Å; A394-G402 WeakPolarHBondContact O-CA 3.46Å; A397-G402 PolarHBondContact O-N 2.64Å; W400-G402 PolarHBondContact O-N 3.45Å; G402-L436 CarbonylContact C-O 3.58Å; G402-L436 VanDerWaalsContact CA-O 3.24Å; G402-L436 WeakPolarHBondContact CA-O 3.31Å
403	T	91.5	Very high	85.2	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	175.2	172.9	-165.7	0	0	0	0	109.9	M374 A394 A397 Y398 P415 L436	M374-T403 HydrophobicContact CE-CG2 4.35Å; M374-T403 HydrophobicContact SD-CG2 4.02Å; A394-T403 HydrophobicContact CB-CG2 3.85Å; A394-T403 PolarHBondContact N-O 2.75Å; A394-T403 PolarHBondContact O-N 3.14Å; A397-T403 HydrophobicContact CB-CG2 3.65Å; Y398-T403 HydrophobicContact CE2-CG2 4.18Å; T403-P415 PolarHBondContact OG1-O 2.96Å; T403-L436 PolarHBondContact N-O 3.25Å
404	V	92.9	Very high	84.8	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	119.5	173	-178.3	0	0	0	0	108.1	L391 L392 P415 V440 T453	L391-V404 HydrophobicContact CB-CG1 4.23Å; L391-V404 HydrophobicContact CD2-CG1 4.22Å; L392-V404 CarbonylContact O-C 3.57Å; L392-V404 WeakPolarHBondContact O-CA 3.41Å; V404-P415 WeakPolarHBondContact O-CD 3.05Å; V404-V440 HydrophobicContact CG1-CG1 4Å; V404-V440 HydrophobicContact CG2-CG1 3.8Å; V404-T453 HydrophobicContact CG2-CG2 4.14Å
405	V	91.1	Very high	84.2	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	123.4	173.5	173.3	0	0	0	0	108.1	P158 M374 L392 A394 T412 N414	P158-V405 HydrophobicContact CB-CB 4.47Å; P158-V405 HydrophobicContact CB-CG1 3.79Å; P158-V405 HydrophobicContact CB-CG2 4.18Å; P158-V405 HydrophobicContact CG-CG1 4.08Å; M374-V405 HydrophobicContact CE-CG2 3.9Å; L392-V405 HydrophobicContact CB-CB 4.2Å; L392-V405 PolarHBondContact N-O 2.94Å; L392-V405 PolarHBondContact O-N 2.99Å; A394-V405 HydrophobicContact CB-CG2 4.26Å; V405-T412 HydrophobicContact CG1-CG2 3.75Å; V405-N414 WeakPolarHBondContact CG1-OD1 3.43Å
406	M	89	Confident	83.5	Confident	8 Å²	8	43.3 Å²	43.3	4%	0.039	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	127	174.4	-175.1	-179	-72.7	0	0	109.9	F386 L390 L391 T408 T412 I413 Y451 L469	F386-M406 HydrophobicContact CE1-CE 4.43Å; F386-M406 HydrophobicContact CE1-CG 4.22Å; F386-M406 HydrophobicContact CE1-SD 4.46Å; F386-M406 HydrophobicContact CZ-CE 4.17Å; F386-M406 HydrophobicContact CZ-CG 4.1Å; F386-M406 HydrophobicContact CZ-SD 3.89Å; L390-M406 WeakPolarHBondContact O-CA 3.37Å; L391-M406 HydrophobicContact CD2-CB 4.24Å; L391-M406 HydrophobicContact CD2-CE 3.36Å; L391-M406 HydrophobicContact CD2-CG 4.03Å; M406-T408 HydrophobicContact CG-CG2 4.28Å; M406-T408 HydrophobicContact SD-CG2 4.31Å; M406-T412 WeakPolarHBondContact O-CA 2.84Å; M406-I413 HydrophobicContact CB-CB 4.35Å; M406-I413 PolarHBondContact N-O 3.13Å; M406-I413 PolarHBondContact O-N 2.92Å; M406-I413 HydrophobicContact SD-CD1 4.38Å; M406-Y451 HydrophobicContact CE-CD1 4.02Å; M406-Y451 HydrophobicContact CE-CD2 4.05Å; M406-Y451 HydrophobicContact CE-CE1 3.64Å; M406-Y451 HydrophobicContact CE-CE2 3.68Å; M406-Y451 HydrophobicContact CE-CG 4.19Å; M406-Y451 VanDerWaalsContact CE-CZ 3.46Å; M406-L469 HydrophobicContact CE-CD1 3.36Å; M406-L469 HydrophobicContact CE-CG 4.14Å; M406-L469 HydrophobicContact SD-CD1 3.25Å; M406-L469 WeakPolarHBondContact SD-CD1 3.28Å
407	Q	85.2	Confident	82.7	Confident	42 Å²	42	45.6 Å²	45.6	20%	0.196	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	114.9	177.6	-168.7	173.3	14.2	0	0	109.8	I156 G389 L390	I156-Q407 VanDerWaalsContact CD1-NE2 3.26Å; G389-Q407 CarbonylContact C-O 3.57Å; G389-Q407 VanDerWaalsContact CA-O 3.22Å; G389-Q407 WeakPolarHBondContact CA-O 3.33Å; L390-Q407 HydrophobicContact CB-CB 4.46Å; L390-Q407 PolarHBondContact N-O 3.22Å; L390-Q407 PolarHBondContact O-N 2.83Å
408	T	80.9	Confident	82	Confident	39 Å²	39	48 Å²	48	24%	0.239	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	171.6	173	67.8	0	0	0	0	109.7	M406 E410 S411	M406-T408 HydrophobicContact CG-CG2 4.28Å; M406-T408 HydrophobicContact SD-CG2 4.31Å; T408-E410 PolarHBondContact O-N 3.02Å; T408-S411 PolarHBondContact N-O 2.03Å; T408-S411 PolarHBondContact OG1-N 2.83Å; T408-S411 VanDerWaalsContact OG1-N 3.14Å; T408-S411 PolarHBondContact OG1-O 3.35Å
409	A	70.8	Confident	81.8	Confident	110 Å²	110	48.3 Å²	48.3	91%	0.909	26%	0.262	S	S	*	.	S	Bend	trans	-63.1	-26.2	176.7	0	0	0	0	0	113.3
410	E	66.1	Low	81.8	Confident	192 Å²	192	46.8 Å²	46.8	90%	0.897	25%	0.253	S	S	*	.	S	Bend	trans	-100.7	-33	-173.7	-62.7	-176.2	175.9	0	0	113.3	T408	T408-E410 PolarHBondContact O-N 3.02Å
411	S	74	Confident	81.2	Confident	57 Å²	57	44 Å²	44	40%	0.399	24%	0.243	S	C	.	.			trans	-156.1	160.4	-176.7	69.6	0	0	0	0	113.7	T408	T408-S411 PolarHBondContact N-O 2.03Å; T408-S411 PolarHBondContact OG1-N 2.83Å; T408-S411 VanDerWaalsContact OG1-N 3.14Å; T408-S411 PolarHBondContact OG1-O 3.35Å
412	T	82	Confident	80.4	Confident	75 Å²	75	46.9 Å²	46.9	46%	0.46	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	125.2	168.4	-56.8	0	0	0	0	108.7	V405 M406	V405-T412 HydrophobicContact CG1-CG2 3.75Å; M406-T412 WeakPolarHBondContact O-CA 2.84Å
413	I	83.9	Confident	79.1	Confident	23 Å²	23	51.4 Å²	51.4	12%	0.118	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	122.2	-178.4	-57.6	163.3	0	0	0	108	M406 L469	M406-I413 HydrophobicContact CB-CB 4.35Å; M406-I413 PolarHBondContact N-O 3.13Å; M406-I413 PolarHBondContact O-N 2.92Å; M406-I413 HydrophobicContact SD-CD1 4.38Å; I413-L469 HydrophobicContact CD1-CD1 4.32Å
414	N	84.6	Confident	77.6	Confident	66 Å²	66	60.6 Å²	60.6	35%	0.353	33%	0.327	S	S	.	.			trans	-116.2	97.3	176.6	-66.5	-12.6	0	0	0	108.6	V405	V405-N414 WeakPolarHBondContact CG1-OD1 3.43Å
415	P	83.6	Confident	76	Confident	7 Å²	7	63.8 Å²	63.8	5%	0.045	34%	0.344	C	S	.	.			trans	-63.5	141.7	179.3	-21.2	33.6	0	0	0	112.1	Y398 T403 V404 F420 V475	Y398-P415 PolarHBondContact OH-O 3.12Å; T403-P415 PolarHBondContact OG1-O 2.96Å; V404-P415 WeakPolarHBondContact O-CD 3.05Å; P415-F420 HydrophobicContact CB-CE2 3.72Å; P415-F420 HydrophobicContact CB-CZ 3.91Å; P415-F420 HydrophobicContact CG-CE2 4.25Å; P415-F420 HydrophobicContact CG-CZ 3.98Å; P415-V475 HydrophobicContact CB-CG2 3.78Å; P415-V475 HydrophobicContact CG-CG2 3.77Å
416	E	78.8	Confident	74.3	Confident	133 Å²	133	70.5 Å²	70.5	62%	0.621	37%	0.37	S	S	*	.			trans	-73.6	159.7	178.9	-66	-174.5	177.9	0	0	112.7	D418 E419	E416-D418 PolarHBondContact O-N 3.04Å; E416-E419 HydrophobicContact CB-CG 4.24Å; E416-E419 PolarHBondContact N-OE1 3.16Å; E416-E419 PolarHBondContact O-N 3.45Å; E416-E419 VanDerWaalsContact O-N 3.12Å
417	K	70.8	Confident	72.2	Confident	48 Å²	48	80 Å²	80	21%	0.209	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.9	-36.4	-176.5	-172.8	179.2	-173.1	139.5	0	114.9	Y398 D399 Y421	Y398-K417 HydrophobicContact CD1-CB 4.17Å; Y398-K417 HydrophobicContact CD2-CB 4.05Å; Y398-K417 HydrophobicContact CD2-CG 4.49Å; Y398-K417 HydrophobicContact CE2-CB 4.46Å; Y398-K417 HydrophobicContact CG-CB 3.88Å; Y398-K417 HydrophobicContact CG-CD 4.42Å; Y398-K417 HydrophobicContact CG-CG 4.16Å; Y398-K417 PolarHBondContact O-NZ 3.29Å; D399-K417 IonicContact OD2-NZ 2.87Å; K417-Y421 WeakPolarHBondContact O-CE2 3.08Å
418	D	72.3	Confident	70.4	Confident	52 Å²	52	82.5 Å²	82.5	28%	0.278	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-0.4	-172	-72.4	-44.8	0	0	0	114.1	E416 R430	E416-D418 PolarHBondContact O-N 3.04Å; D418-R430 IonicContact OD1-CZ 2.68Å; D418-R430 IonicContact OD1-NE 2.7Å; D418-R430 PolarHBondContact OD1-NE 3.43Å; D418-R430 IonicContact OD1-NH2 3.18Å; D418-R430 PolarHBondContact OD1-NH2 3.11Å; D418-R430 IonicContact OD2-CZ 3.96Å; D418-R430 IonicContact OD2-NH2 3.47Å; D418-R430 PolarHBondContact OD2-NH2 3.39Å
419	E	78.6	Confident	69	Low	36 Å²	36	92.2 Å²	92.2	17%	0.168	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-27.1	-174.1	-67.3	-169.5	-140.2	0	0	114.1	E416 Y421 V475	E416-E419 HydrophobicContact CB-CG 4.24Å; E416-E419 PolarHBondContact N-OE1 3.16Å; E416-E419 PolarHBondContact O-N 3.45Å; E416-E419 VanDerWaalsContact O-N 3.12Å; E419-Y421 VanDerWaalsContact C-N 3.3Å; E419-Y421 PolarHBondContact O-N 2.75Å; E419-V475 HydrophobicContact CB-CB 4.03Å; E419-V475 PolarHBondContact OE2-N 3.17Å
420	F	80.4	Confident	68.3	Low	2 Å²	2	93.8 Å²	93.8	1%	0.009	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	5.2	179.3	-61.8	-80.5	0	0	0	114.1	P415 L436 V465 Y467 V475	P415-F420 HydrophobicContact CB-CE2 3.72Å; P415-F420 HydrophobicContact CB-CZ 3.91Å; P415-F420 HydrophobicContact CG-CE2 4.25Å; P415-F420 HydrophobicContact CG-CZ 3.98Å; F420-L436 HydrophobicContact CB-CD2 3.85Å; F420-L436 HydrophobicContact CD1-CD2 3.95Å; F420-L436 HydrophobicContact CD2-CD2 3.37Å; F420-L436 HydrophobicContact CE1-CD2 4.32Å; F420-L436 HydrophobicContact CE2-CD2 3.78Å; F420-L436 HydrophobicContact CG-CD2 3.45Å; F420-L436 VanDerWaalsContact CG-CD2 3.45Å; F420-L436 HydrophobicContact CZ-CD2 4.24Å; F420-V465 HydrophobicContact CD1-CG1 4.36Å; F420-Y467 HydrophobicContact CD1-CD1 4.44Å; F420-Y467 HydrophobicContact CE1-CD1 4.09Å; F420-Y467 HydrophobicContact CE1-CD2 4.45Å; F420-Y467 AromaticContact CE1-CE1 3.88Å; F420-Y467 HydrophobicContact CE1-CE1 3.88Å; F420-Y467 HydrophobicContact CE1-CE2 4.23Å; F420-Y467 HydrophobicContact CE1-CG 4.37Å; F420-Y467 AromaticContact CE1-CZ 3.95Å; F420-V475 HydrophobicContact CD1-CG1 3.84Å; F420-V475 HydrophobicContact CE1-CG1 3.82Å; F420-V475 HydrophobicContact CE1-CG2 4.1Å; F420-V475 HydrophobicContact CZ-CG2 4.09Å
421	Y	74.6	Confident	67.7	Low	25 Å²	25	85.9 Å²	85.9	10%	0.098	41%	0.413	C	S	.	.	S	Bend	trans	-100.3	144.9	176.1	-67.6	-86.4	0	0	0	111.6	N401 K417 E419 E434	N401-Y421 PolarHBondContact ND2-OH 3.03Å; N401-Y421 PolarHBondContact OD1-OH 3.13Å; K417-Y421 WeakPolarHBondContact O-CE2 3.08Å; E419-Y421 VanDerWaalsContact C-N 3.3Å; E419-Y421 PolarHBondContact O-N 2.75Å; Y421-E434 PolarHBondContact OH-OE1 3.08Å; Y421-E434 PolarHBondContact OH-OE2 2.9Å
422	D	67.3	Low	67.2	Low	66 Å²	66	89.6 Å²	89.6	35%	0.353	43%	0.428	S	S	.	.			trans	-58.4	128.7	172.8	-172.7	-36	0	0	0	109.4	K424 D425 R426	D422-K424 PolarHBondContact O-N 3.06Å; D422-K424 WeakPolarHBondContact OD1-CB 3.22Å; D422-K424 PolarHBondContact OD1-N 3.44Å; D422-D425 HydrophobicContact CB-CB 4.38Å; D422-D425 PolarHBondContact O-N 3.41Å; D422-R426 PolarHBondContact O-N 3.04Å
423	P	62.4	Low	67.1	Low	96 Å²	96	87.5 Å²	87.5	62%	0.623	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	-29.9	175.9	-27.7	33.1	0	0	0	114.3
424	K	60.6	Low	67.2	Low	194 Å²	194	86.5 Å²	86.5	84%	0.843	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-24.5	-179.4	-64	177.7	-178.4	174	0	113.8	D422	D422-K424 PolarHBondContact O-N 3.06Å; D422-K424 WeakPolarHBondContact OD1-CB 3.22Å; D422-K424 PolarHBondContact OD1-N 3.44Å
425	D	58.1	Low	67.6	Low	69 Å²	69	85.8 Å²	85.8	37%	0.369	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	3.2	-174	-133.5	-11.9	0	0	0	113	D422 K427 T428	D422-D425 HydrophobicContact CB-CB 4.38Å; D422-D425 PolarHBondContact O-N 3.41Å; D425-K427 PolarHBondContact O-N 2.68Å; D425-T428 PolarHBondContact O-N 3.1Å; D425-T428 VanDerWaalsContact O-N 3.14Å; D425-T428 PolarHBondContact OD1-OG1 3.21Å
426	R	55.7	Low	68.1	Low	141 Å²	141	85.7 Å²	85.7	53%	0.532	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-13.6	-179.8	-75.3	-176.4	174	-172.5	-3.2	115.3	D422	D422-R426 PolarHBondContact O-N 3.04Å
427	K	46.4	Very low	68.8	Low	208 Å²	208	79.3 Å²	79.3	90%	0.904	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	-6.7	-177	-72.8	-173.9	177.4	-179.3	0	114.7	D425	D425-K427 PolarHBondContact O-N 2.68Å
428	T	45.9	Very low	70	Confident	93 Å²	93	79.9 Å²	79.9	57%	0.571	38%	0.376	S	S	*	.	S	Bend	trans	-118	107.1	-169.6	-3.3	0	0	0	0	111.2	D425	D425-T428 PolarHBondContact O-N 3.1Å; D425-T428 VanDerWaalsContact O-N 3.14Å; D425-T428 PolarHBondContact OD1-OG1 3.21Å
429	R	51.6	Low	71.2	Confident	244 Å²	244	78.9 Å²	78.9	92%	0.921	37%	0.371	S	S	*	.			trans	32.8	93.6	171.7	-72.8	-176.5	178.8	174.9	-0.4	116	G431	R429-G431 PolarHBondContact O-N 3.21Å
430	R	56.5	Low	72	Confident	143 Å²	143	77.2 Å²	77.2	54%	0.54	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-57.7	123	165.9	-66.9	175.3	174.3	170.2	-7.6	109.7	D418	D418-R430 IonicContact OD1-CZ 2.68Å; D418-R430 IonicContact OD1-NE 2.7Å; D418-R430 PolarHBondContact OD1-NE 3.43Å; D418-R430 IonicContact OD1-NH2 3.18Å; D418-R430 PolarHBondContact OD1-NH2 3.11Å; D418-R430 IonicContact OD2-CZ 3.96Å; D418-R430 IonicContact OD2-NH2 3.47Å; D418-R430 PolarHBondContact OD2-NH2 3.39Å
431	G	53.3	Low	72.7	Confident	25 Å²	25	78 Å²	78	26%	0.258	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-62.6	138.9	166.9	0	0	0	0	0	109.1	N401 R429 E434	N401-G431 PolarHBondContact OD1-O 2.83Å; R429-G431 PolarHBondContact O-N 3.21Å; G431-E434 WeakPolarHBondContact CA-OE1 3.38Å; G431-E434 PolarHBondContact N-OE1 3.41Å
432	L	64.3	Low	73.7	Confident	136 Å²	136	77.8 Å²	77.8	71%	0.712	37%	0.369	S	S	*	.	S	Bend	trans	-97.9	142.8	166.3	-68.5	167.5	0	0	0	107
433	A	78.8	Confident	74.9	Confident	30 Å²	30	74.6 Å²	74.6	25%	0.248	35%	0.352	C	S	.	.	S	Bend	trans	60.6	53.3	176.5	0	0	0	0	0	115.8	W400 Y435 R457	W400-A433 HydrophobicContact CB-CB 3.91Å; W400-A433 CarbonylContact O-C 3.53Å; W400-A433 VanDerWaalsContact O-C 3.3Å; W400-A433 WeakPolarHBondContact O-CA 3.2Å; A433-Y435 HydrophobicContact CB-CE1 4.4Å; A433-R457 VanDerWaalsContact O-CB 3.29Å; A433-R457 WeakPolarHBondContact O-CB 2.93Å
434	E	86.8	Confident	76.3	Confident	2 Å²	2	72.2 Å²	72.2	1%	0.009	34%	0.337	C	S	.	.			trans	-81.4	-21.7	-179.8	-56.9	-178.6	175.9	0	0	114.2	W400 N401 Y421 G431 A455 R457 Y458 R463	W400-E434 PolarHBondContact O-N 3.26Å; N401-E434 WeakPolarHBondContact OD1-CG 3.37Å; Y421-E434 PolarHBondContact OH-OE1 3.08Å; Y421-E434 PolarHBondContact OH-OE2 2.9Å; G431-E434 WeakPolarHBondContact CA-OE1 3.38Å; G431-E434 PolarHBondContact N-OE1 3.41Å; E434-A455 CarbonylContact O-C 3.32Å; E434-R457 PolarHBondContact O-N 2.91Å; E434-Y458 HydrophobicContact CG-CD2 3.94Å; E434-Y458 WeakPolarHBondContact OE1-CD2 3.47Å; E434-Y458 WeakPolarHBondContact OE1-CE2 3.46Å; E434-Y458 WeakPolarHBondContact OE2-CD2 3.41Å; E434-R463 IonicContact OE2-CZ 2.6Å; E434-R463 VanDerWaalsContact OE2-CZ 3.31Å; E434-R463 IonicContact OE2-NE 3.81Å; E434-R463 IonicContact OE2-NH2 3.2Å; E434-R463 PolarHBondContact OE2-NH2 2.66Å
435	Y	92.7	Very high	77.7	Confident	52 Å²	52	63.3 Å²	63.3	20%	0.204	30%	0.299	C	S	.	.			trans	58.5	43.8	-175.9	-62.4	-2.9	0	0	0	113.7	W400 A433 Y438 R457	W400-Y435 HydrophobicContact CB-CD1 3.98Å; W400-Y435 HydrophobicContact CB-CE1 3.74Å; W400-Y435 AromaticContact CD1-CE1 3.64Å; W400-Y435 AromaticContact CG-CE1 3.96Å; W400-Y435 HydrophobicContact CG-CE1 3.96Å; W400-Y435 PolarHBondContact O-N 3.38Å; A433-Y435 HydrophobicContact CB-CE1 4.4Å; Y435-Y438 HydrophobicContact CD2-CD2 4.31Å; Y435-Y438 WeakPolarHBondContact O-CB 3.33Å; Y435-Y438 PolarHBondContact O-N 3.32Å; Y435-R457 HydrophobicContact CD2-CG 3.77Å; Y435-R457 HydrophobicContact CE2-CG 4.12Å; Y435-R457 HydrophobicContact CG-CB 4.47Å; Y435-R457 HydrophobicContact CG-CG 4.18Å; Y435-R457 PolarHBondContact OH-NH1 2.88Å
436	L	93.4	Very high	79	Confident	4 Å²	4	65.3 Å²	65.3	2%	0.021	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-59.4	139	170.5	-170.7	78.6	0	0	0	110.5	N401 G402 T403 F420 T453 G454 A455 V465	N401-L436 WeakPolarHBondContact O-CB 3.35Å; N401-L436 PolarHBondContact O-N 3.41Å; G402-L436 CarbonylContact C-O 3.58Å; G402-L436 VanDerWaalsContact CA-O 3.24Å; G402-L436 WeakPolarHBondContact CA-O 3.31Å; T403-L436 PolarHBondContact N-O 3.25Å; F420-L436 HydrophobicContact CB-CD2 3.85Å; F420-L436 HydrophobicContact CD1-CD2 3.95Å; F420-L436 HydrophobicContact CD2-CD2 3.37Å; F420-L436 HydrophobicContact CE1-CD2 4.32Å; F420-L436 HydrophobicContact CE2-CD2 3.78Å; F420-L436 HydrophobicContact CG-CD2 3.45Å; F420-L436 VanDerWaalsContact CG-CD2 3.45Å; F420-L436 HydrophobicContact CZ-CD2 4.24Å; L436-T453 HydrophobicContact CD1-CG2 3.58Å; L436-T453 HydrophobicContact CG-CG2 4.06Å; L436-G454 WeakPolarHBondContact CA-O 3.12Å; L436-A455 HydrophobicContact CB-CB 4.18Å; L436-A455 HydrophobicContact CD1-CB 3.8Å; L436-V465 HydrophobicContact CD1-CG2 4.07Å
437	G	94.1	Very high	80.3	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.4	12.9	-172.8	0	0	0	0	0	113.3	S382 G393 D439 T453 G454	S382-G437 PolarHBondContact OG-O 3.43Å; G393-G437 WeakPolarHBondContact CA-O 3.16Å; G437-D439 PolarHBondContact O-N 3.21Å; G437-T453 VanDerWaalsContact CA-OG1 3.29Å; G437-T453 WeakPolarHBondContact CA-OG1 3.4Å; G437-T453 PolarHBondContact N-OG1 3.2Å; G437-T453 VanDerWaalsContact N-OG1 3.12Å; G437-G454 PolarHBondContact N-O 3.05Å
438	Y	96.8	Very high	82.2	Confident	59 Å²	59	56.1 Å²	56.1	23%	0.231	29%	0.291	C	S	.	.	S	Bend	trans	-59.8	-39.7	172.9	-166	-84.1	0	0	0	111.1	F381 S382 V395 Y435 G454 P456 Y489 S492	F381-Y438 HydrophobicContact CD1-CD2 4.3Å; F381-Y438 HydrophobicContact CD1-CG 4.45Å; F381-Y438 WeakPolarHBondContact CD1-O 3.29Å; F381-Y438 HydrophobicContact CE1-CD1 4.05Å; F381-Y438 AromaticContact CE1-CD2 3.53Å; F381-Y438 HydrophobicContact CE1-CD2 3.53Å; F381-Y438 AromaticContact CE1-CE1 3.93Å; F381-Y438 HydrophobicContact CE1-CE1 3.93Å; F381-Y438 AromaticContact CE1-CE2 3.39Å; F381-Y438 HydrophobicContact CE1-CE2 3.39Å; F381-Y438 AromaticContact CE1-CG 3.87Å; F381-Y438 HydrophobicContact CE1-CG 3.87Å; F381-Y438 AromaticContact CE1-CZ 3.6Å; F381-Y438 AromaticContact CZ-CD2 3.99Å; F381-Y438 HydrophobicContact CZ-CD2 3.99Å; F381-Y438 AromaticContact CZ-CE2 3.46Å; F381-Y438 HydrophobicContact CZ-CE2 3.46Å; F381-Y438 VanDerWaalsContact CZ-CE2 3.46Å; F381-Y438 AromaticContact CZ-CZ 3.78Å; S382-Y438 VanDerWaalsContact CB-O 3.27Å; S382-Y438 WeakPolarHBondContact CB-O 3.41Å; S382-Y438 PolarHBondContact OG-O 3.2Å; V395-Y438 VanDerWaalsContact CG1-CA 3.49Å; V395-Y438 HydrophobicContact CG1-CD2 4.28Å; Y435-Y438 HydrophobicContact CD2-CD2 4.31Å; Y435-Y438 WeakPolarHBondContact O-CB 3.33Å; Y435-Y438 PolarHBondContact O-N 3.32Å; Y438-G454 PolarHBondContact N-O 3.44Å; Y438-P456 HydrophobicContact CD1-CG 4.17Å; Y438-P456 HydrophobicContact CD2-CG 4.02Å; Y438-P456 HydrophobicContact CG-CG 3.72Å; Y438-Y489 HydrophobicContact CE1-CE1 4.02Å; Y438-Y489 HydrophobicContact CE2-CE1 4.11Å; Y438-Y489 AromaticContact CE2-CZ 4Å; Y438-Y489 WeakPolarHBondContact CE2-OH 3.34Å; Y438-Y489 AromaticContact CZ-CE1 3.7Å; Y438-S492 WeakPolarHBondContact CD1-O 3Å
439	D	96.9	Very high	84.3	Confident	32 Å²	32	54 Å²	54	17%	0.171	28%	0.278	C	S	.	.	S	Bend	trans	-137.5	150.2	167.8	-162.8	16.8	0	0	0	110.3	G437 T453 G454 V493 L494	G437-D439 PolarHBondContact O-N 3.21Å; D439-T453 WeakPolarHBondContact O-CA 3.2Å; D439-T453 PolarHBondContact O-OG1 3.31Å; D439-G454 PolarHBondContact O-N 3.03Å; D439-V493 WeakPolarHBondContact OD2-CA 3.43Å; D439-L494 HydrophobicContact CB-CD1 4.31Å; D439-L494 HydrophobicContact CB-CG 4.28Å; D439-L494 WeakPolarHBondContact OD2-CB 3.26Å; D439-L494 PolarHBondContact OD2-N 3.21Å
440	V	95.9	Very high	86.2	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.006	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	136.1	-175	-65.8	0	0	0	0	110	H384 L391 V404 I452	H384-V440 HydrophobicContact CB-CG2 3.94Å; H384-V440 VanDerWaalsContact CB-O 3.26Å; H384-V440 WeakPolarHBondContact CB-O 3.36Å; L391-V440 HydrophobicContact CB-CB 4.26Å; L391-V440 HydrophobicContact CB-CG2 4.01Å; V404-V440 HydrophobicContact CG1-CG1 4Å; V404-V440 HydrophobicContact CG2-CG1 3.8Å; V440-I452 WeakPolarHBondContact CA-O 3.3Å
441	Q	95.6	Very high	88	Confident	18 Å²	18	36.6 Å²	36.6	8%	0.084	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	162.7	179.7	-165.1	61.2	1.1	0	0	110.8	H384 I452 L494 T496	H384-Q441 PolarHBondContact CE1-OE1 2.99Å; H384-Q441 VanDerWaalsContact CG-OE1 3.3Å; H384-Q441 PolarHBondContact ND1-OE1 2.82Å; Q441-I452 HydrophobicContact CB-CB 4.49Å; Q441-I452 PolarHBondContact N-O 3.16Å; Q441-I452 PolarHBondContact O-N 2.95Å; Q441-L494 HydrophobicContact CB-CB 4.33Å; Q441-T496 HydrophobicContact CG-CG2 3.66Å; Q441-T496 VanDerWaalsContact CG-OG1 3.28Å; Q441-T496 WeakPolarHBondContact CG-OG1 3.27Å; Q441-T496 PolarHBondContact NE2-OG1 2.93Å
442	S	94.4	Very high	90.1	Very high	20 Å²	20	35.4 Å²	35.4	14%	0.14	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	146.8	170.9	69.3	0	0	0	0	112	H384 L450 T496	H384-S442 PolarHBondContact CD2-N 2.8Å; H384-S442 VanDerWaalsContact CD2-N 3.3Å; H384-S442 PolarHBondContact CD2-OG 2.79Å; H384-S442 PolarHBondContact NE2-N 3.3Å; H384-S442 PolarHBondContact NE2-OG 2.85Å; S442-L450 CarbonylContact C-O 3.53Å; S442-L450 WeakPolarHBondContact CA-O 2.99Å; S442-T496 PolarHBondContact O-OG1 2.78Å
443	A	93.5	Very high	91.6	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	133.4	170.4	0	0	0	0	0	110.6	L450 I452 T496 T505 F537	A443-L450 HydrophobicContact CB-CB 4.24Å; A443-L450 PolarHBondContact N-O 3.02Å; A443-L450 PolarHBondContact O-N 2.8Å; A443-I452 HydrophobicContact CB-CD1 3.98Å; A443-T496 HydrophobicContact CB-CG2 4.01Å; A443-T505 WeakPolarHBondContact CA-OG1 3.41Å; A443-T505 HydrophobicContact CB-CG2 3.83Å; A443-F537 HydrophobicContact CB-CZ 4.03Å
444	S	91.6	Very high	92.4	Very high	46 Å²	46	27.5 Å²	27.5	32%	0.322	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	127.3	175.5	-177	0	0	0	0	109.2	S503 T505	S444-S503 PolarHBondContact OG-O 2.82Å; S444-T505 PolarHBondContact N-OG1 3.29Å; S444-T505 PolarHBondContact O-N 2.86Å
445	T	89.8	Confident	92.8	Very high	7 Å²	7	27.4 Å²	27.4	4%	0.043	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	159.9	176.9	77.4	0	0	0	0	110.5	E447 G448 L450 L531	T445-E447 PolarHBondContact O-N 2.82Å; T445-E447 VanDerWaalsContact O-N 3.11Å; T445-E447 PolarHBondContact OG1-N 2.67Å; T445-G448 WeakPolarHBondContact CB-O 3.37Å; T445-G448 PolarHBondContact N-O 3.4Å; T445-G448 PolarHBondContact O-N 3.38Å; T445-G448 PolarHBondContact OG1-N 2.82Å; T445-G448 PolarHBondContact OG1-O 2.86Å; T445-L450 HydrophobicContact CG2-CD1 3.64Å; T445-L450 HydrophobicContact CG2-CG 3.95Å; T445-L531 HydrophobicContact CG2-CD2 3.59Å
446	P	84.6	Confident	93	Very high	110 Å²	110	25 Å²	25	71%	0.714	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-24.9	176	-26.8	35.6	0	0	0	114.2	F504	P446-F504 HydrophobicContact CB-CE1 4.34Å; P446-F504 HydrophobicContact CG-CD1 4.13Å; P446-F504 HydrophobicContact CG-CE1 4.01Å; P446-F504 HydrophobicContact CG-CG 4.45Å; P446-F504 HydrophobicContact CG-CZ 4.21Å
447	E	83.3	Confident	92.9	Very high	125 Å²	125	29.5 Å²	29.5	58%	0.584	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-5.2	178.1	-63.7	-177.1	172.6	0	0	113.8	T445 R468	T445-E447 PolarHBondContact O-N 2.82Å; T445-E447 VanDerWaalsContact O-N 3.11Å; T445-E447 PolarHBondContact OG1-N 2.67Å; E447-R468 IonicContact OE2-CZ 3.77Å; E447-R468 IonicContact OE2-NH1 2.66Å; E447-R468 PolarHBondContact OE2-NH1 2.78Å; E447-R468 IonicContact OE2-NH2 2.82Å; E447-R468 PolarHBondContact OE2-NH2 2.7Å
448	G	85.9	Confident	92.7	Very high	32 Å²	32	31.6 Å²	31.6	33%	0.33	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	128	-170.9	-175.9	0	0	0	0	0	113.6	T445	T445-G448 WeakPolarHBondContact CB-O 3.37Å; T445-G448 PolarHBondContact N-O 3.4Å; T445-G448 PolarHBondContact O-N 3.38Å; T445-G448 PolarHBondContact OG1-N 2.82Å; T445-G448 PolarHBondContact OG1-O 2.86Å
449	V	89.8	Confident	92.2	Very high	48 Å²	48	34.3 Å²	34.3	29%	0.291	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	132.5	-177.6	-175.9	0	0	0	0	110.6	Y451	V449-Y451 HydrophobicContact CG1-CD1 4.2Å; V449-Y451 HydrophobicContact CG1-CE1 3.79Å
450	L	92.9	Very high	91.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	132.4	167	-67.4	176	0	0	0	109	S442 A443 T445 I466 R468 V478 L531 F537	S442-L450 CarbonylContact C-O 3.53Å; S442-L450 WeakPolarHBondContact CA-O 2.99Å; A443-L450 HydrophobicContact CB-CB 4.24Å; A443-L450 PolarHBondContact N-O 3.02Å; A443-L450 PolarHBondContact O-N 2.8Å; T445-L450 HydrophobicContact CG2-CD1 3.64Å; T445-L450 HydrophobicContact CG2-CG 3.95Å; L450-I466 HydrophobicContact CB-CG2 4.19Å; L450-I466 HydrophobicContact CD1-CG2 4.25Å; L450-I466 HydrophobicContact CD2-CG2 4.26Å; L450-I466 HydrophobicContact CG-CG2 4.49Å; L450-R468 HydrophobicContact CD2-CG 3.56Å; L450-V478 HydrophobicContact CD2-CG2 4.21Å; L450-L531 HydrophobicContact CD1-CD1 4.34Å; L450-F537 HydrophobicContact CD1-CE2 4.27Å
451	Y	94.2	Very high	91.4	Very high	22 Å²	22	39.3 Å²	39.3	9%	0.086	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	140.5	173.2	-56.5	-69.1	0	0	0	109.5	F386 L391 M406 V449 I466 Y467 L469	F386-Y451 HydrophobicContact CD1-CE1 4.38Å; F386-Y451 HydrophobicContact CD2-CE1 4.11Å; F386-Y451 HydrophobicContact CE1-CE1 4.32Å; F386-Y451 HydrophobicContact CE2-CE1 4.05Å; F386-Y451 VanDerWaalsContact CE2-OH 3.32Å; F386-Y451 WeakPolarHBondContact CE2-OH 3.36Å; F386-Y451 HydrophobicContact CG-CE1 4.29Å; F386-Y451 HydrophobicContact CZ-CE1 4.17Å; L391-Y451 HydrophobicContact CD1-CD1 3.79Å; L391-Y451 HydrophobicContact CD1-CE1 4.41Å; L391-Y451 HydrophobicContact CD2-CD1 4.09Å; L391-Y451 HydrophobicContact CD2-CE1 4.32Å; L391-Y451 HydrophobicContact CG-CD1 4.48Å; M406-Y451 HydrophobicContact CE-CD1 4.02Å; M406-Y451 HydrophobicContact CE-CD2 4.05Å; M406-Y451 HydrophobicContact CE-CE1 3.64Å; M406-Y451 HydrophobicContact CE-CE2 3.68Å; M406-Y451 HydrophobicContact CE-CG 4.19Å; M406-Y451 VanDerWaalsContact CE-CZ 3.46Å; V449-Y451 HydrophobicContact CG1-CD1 4.2Å; V449-Y451 HydrophobicContact CG1-CE1 3.79Å; Y451-I466 CarbonylContact O-C 3.48Å; Y451-I466 WeakPolarHBondContact O-CA 3.48Å; Y451-Y467 HydrophobicContact CD2-CD2 4.28Å; Y451-Y467 HydrophobicContact CD2-CE2 4.02Å; Y451-Y467 HydrophobicContact CG-CE2 4.07Å; Y451-Y467 PolarHBondContact N-O 2.91Å; Y451-Y467 WeakPolarHBondContact O-CD1 3.38Å; Y451-Y467 PolarHBondContact O-N 2.82Å; Y451-L469 HydrophobicContact CD2-CG 4.25Å; Y451-L469 HydrophobicContact CE2-CB 4.34Å; Y451-L469 HydrophobicContact CE2-CD1 4.11Å; Y451-L469 HydrophobicContact CE2-CG 3.91Å
452	I	96.1	Very high	91.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	132.7	-172.3	-50.5	176.1	0	0	0	107.5	V440 Q441 A443 V464 V465 I466 L494 T496 L508 F537	V440-I452 WeakPolarHBondContact CA-O 3.3Å; Q441-I452 HydrophobicContact CB-CB 4.49Å; Q441-I452 PolarHBondContact N-O 3.16Å; Q441-I452 PolarHBondContact O-N 2.95Å; A443-I452 HydrophobicContact CB-CD1 3.98Å; I452-V464 HydrophobicContact CG2-CG1 3.46Å; I452-V464 VanDerWaalsContact CG2-CG1 3.46Å; I452-V465 WeakPolarHBondContact CA-O 3.44Å; I452-I466 HydrophobicContact CG1-CG1 4.2Å; I452-I466 HydrophobicContact CG1-CG2 4.44Å; I452-I466 HydrophobicContact CG2-CG1 4.18Å; I452-L494 HydrophobicContact CG2-CD1 3.95Å; I452-T496 HydrophobicContact CD1-CG2 3.79Å; I452-L508 HydrophobicContact CD1-CD1 3.88Å; I452-L508 HydrophobicContact CD1-CD2 4.12Å; I452-L508 HydrophobicContact CG2-CD1 4.38Å; I452-L508 HydrophobicContact CG2-CD2 4.27Å; I452-F537 HydrophobicContact CD1-CE2 3.98Å; I452-F537 HydrophobicContact CD1-CZ 4.15Å
453	T	96.3	Very high	91.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	143.1	175.8	-174.9	0	0	0	0	112.2	V404 L436 G437 D439 V464 V465 Y467	V404-T453 HydrophobicContact CG2-CG2 4.14Å; L436-T453 HydrophobicContact CD1-CG2 3.58Å; L436-T453 HydrophobicContact CG-CG2 4.06Å; G437-T453 VanDerWaalsContact CA-OG1 3.29Å; G437-T453 WeakPolarHBondContact CA-OG1 3.4Å; G437-T453 PolarHBondContact N-OG1 3.2Å; G437-T453 VanDerWaalsContact N-OG1 3.12Å; D439-T453 WeakPolarHBondContact O-CA 3.2Å; D439-T453 PolarHBondContact O-OG1 3.31Å; T453-V464 CarbonylContact O-C 3.54Å; T453-V464 WeakPolarHBondContact O-CA 3.43Å; T453-V465 HydrophobicContact CG2-CB 4.09Å; T453-V465 PolarHBondContact N-O 2.8Å; T453-V465 PolarHBondContact O-N 2.8Å; T453-Y467 HydrophobicContact CG2-CD1 4.41Å; T453-Y467 HydrophobicContact CG2-CE1 3.86Å
454	G	96.4	Very high	91.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	141	179.3	0	0	0	0	0	113	L436 G437 Y438 D439 G491	L436-G454 WeakPolarHBondContact CA-O 3.12Å; G437-G454 PolarHBondContact N-O 3.05Å; Y438-G454 PolarHBondContact N-O 3.44Å; D439-G454 PolarHBondContact O-N 3.03Å; G454-G491 WeakPolarHBondContact CA-O 3.4Å
455	A	95.3	Very high	91.5	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	78.5	170.5	0	0	0	0	0	109.3	E434 L436 R457 Y458 G462 R463	E434-A455 CarbonylContact O-C 3.32Å; L436-A455 HydrophobicContact CB-CB 4.18Å; L436-A455 HydrophobicContact CD1-CB 3.8Å; A455-R457 PolarHBondContact O-N 2.71Å; A455-Y458 WeakPolarHBondContact O-CB 3.48Å; A455-Y458 PolarHBondContact O-N 2.95Å; A455-G462 WeakPolarHBondContact O-CA 3.45Å; A455-R463 HydrophobicContact CB-CG 3.81Å; A455-R463 PolarHBondContact N-O 2.93Å; A455-R463 PolarHBondContact O-N 2.94Å
456	P	95.7	Very high	91.8	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.013	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-15.8	-169	26.9	-35.2	0	0	0	114.4	Y438 G462 Y489 F490	Y438-P456 HydrophobicContact CD1-CG 4.17Å; Y438-P456 HydrophobicContact CD2-CG 4.02Å; Y438-P456 HydrophobicContact CG-CG 3.72Å; P456-G462 VanDerWaalsContact O-CA 3.29Å; P456-G462 WeakPolarHBondContact O-CA 3.46Å; P456-G462 PolarHBondContact O-N 2.95Å; P456-Y489 HydrophobicContact CB-CD1 4.04Å; P456-Y489 HydrophobicContact CB-CD2 3.8Å; P456-Y489 HydrophobicContact CB-CE1 4.16Å; P456-Y489 HydrophobicContact CB-CE2 3.94Å; P456-Y489 HydrophobicContact CB-CG 3.84Å; P456-Y489 HydrophobicContact CG-CD1 4.44Å; P456-Y489 HydrophobicContact CG-CD2 4.44Å; P456-Y489 HydrophobicContact CG-CE1 4.06Å; P456-Y489 HydrophobicContact CG-CE2 4.08Å; P456-F490 WeakPolarHBondContact CA-O 3.39Å
457	R	92.5	Very high	92.1	Very high	97 Å²	97	30.2 Å²	30.2	37%	0.366	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-2	177.1	-67.2	-164.9	69.5	160.4	2.6	114.2	A433 E434 Y435 A455 N459 H460 Y489	A433-R457 VanDerWaalsContact O-CB 3.29Å; A433-R457 WeakPolarHBondContact O-CB 2.93Å; E434-R457 PolarHBondContact O-N 2.91Å; Y435-R457 HydrophobicContact CD2-CG 3.77Å; Y435-R457 HydrophobicContact CE2-CG 4.12Å; Y435-R457 HydrophobicContact CG-CB 4.47Å; Y435-R457 HydrophobicContact CG-CG 4.18Å; Y435-R457 PolarHBondContact OH-NH1 2.88Å; A455-R457 PolarHBondContact O-N 2.71Å; R457-N459 PolarHBondContact O-N 2.95Å; R457-N459 VanDerWaalsContact O-N 3.11Å; R457-H460 PolarHBondContact O-N 3.02Å; R457-Y489 HydrophobicContact CG-CE2 3.96Å
458	Y	89.3	Confident	92.5	Very high	45 Å²	45	27.1 Å²	27.1	18%	0.176	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-54.2	120.1	177.2	179.2	-98.3	0	0	0	111.4	E434 A455 H460 T461 G462 R463	E434-Y458 HydrophobicContact CG-CD2 3.94Å; E434-Y458 WeakPolarHBondContact OE1-CD2 3.47Å; E434-Y458 WeakPolarHBondContact OE1-CE2 3.46Å; E434-Y458 WeakPolarHBondContact OE2-CD2 3.41Å; A455-Y458 WeakPolarHBondContact O-CB 3.48Å; A455-Y458 PolarHBondContact O-N 2.95Å; Y458-H460 PolarHBondContact O-N 2.64Å; Y458-T461 PolarHBondContact O-N 2.99Å; Y458-T461 PolarHBondContact O-OG1 2.89Å; Y458-G462 PolarHBondContact O-N 3.01Å; Y458-R463 HydrophobicContact CD1-CB 3.88Å; Y458-R463 HydrophobicContact CD1-CG 3.91Å; Y458-R463 HydrophobicContact CD2-CG 4.24Å; Y458-R463 VanDerWaalsContact CD2-NE 3.27Å; Y458-R463 HydrophobicContact CG-CB 4.11Å; Y458-R463 HydrophobicContact CG-CG 3.63Å
459	N	86.4	Confident	92.5	Very high	116 Å²	116	27.9 Å²	27.9	62%	0.62	13%	0.131	S	C	*	.	G	3₁₀ helix	trans	49.3	25.8	-176.8	-164.3	37.4	0	0	0	113.7	R457 T461	R457-N459 PolarHBondContact O-N 2.95Å; R457-N459 VanDerWaalsContact O-N 3.11Å; N459-T461 PolarHBondContact O-N 2.84Å
460	H	86.9	Confident	92.1	Very high	114 Å²	114	27.9 Å²	27.9	53%	0.528	13%	0.131	S	C	.	.	G	3₁₀ helix	trans	59.1	-0.6	-172.5	-51	83	0	0	0	115.8	R457 Y458 I486 G487	R457-H460 PolarHBondContact O-N 3.02Å; Y458-H460 PolarHBondContact O-N 2.64Å; H460-I486 HydrophobicContact CB-CD1 3.83Å; H460-I486 HydrophobicContact CB-CG1 3.57Å; H460-I486 CarbonylContact O-C 3.47Å; H460-I486 WeakPolarHBondContact O-CA 3.34Å; H460-G487 PolarHBondContact O-N 3.13Å
461	T	89.8	Confident	91.3	Very high	24 Å²	24	38 Å²	38	15%	0.147	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-27.4	176.6	56.6	0	0	0	0	112.4	Y458 N459 I486 S488 F490	Y458-T461 PolarHBondContact O-N 2.99Å; Y458-T461 PolarHBondContact O-OG1 2.89Å; N459-T461 PolarHBondContact O-N 2.84Å; T461-I486 HydrophobicContact CG2-CB 4.31Å; T461-S488 PolarHBondContact O-OG 2.85Å; T461-F490 WeakPolarHBondContact O-CB 3.29Å
462	G	93.1	Very high	90.4	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.204	C	C	.	.			trans	92.5	153.4	-174.9	0	0	0	0	0	113.5	A455 P456 Y458 G483 F490	A455-G462 WeakPolarHBondContact O-CA 3.45Å; P456-G462 VanDerWaalsContact O-CA 3.29Å; P456-G462 WeakPolarHBondContact O-CA 3.46Å; P456-G462 PolarHBondContact O-N 2.95Å; Y458-G462 PolarHBondContact O-N 3.01Å; G462-G483 PolarHBondContact O-N 2.62Å; G462-F490 WeakPolarHBondContact CA-O 3.15Å
463	R	93.9	Very high	89.5	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.015	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	160.1	172	72.6	177.2	173	169.9	3.2	111.4	E434 A455 Y458 V465 I480 L481	E434-R463 IonicContact OE2-CZ 2.6Å; E434-R463 VanDerWaalsContact OE2-CZ 3.31Å; E434-R463 IonicContact OE2-NE 3.81Å; E434-R463 IonicContact OE2-NH2 3.2Å; E434-R463 PolarHBondContact OE2-NH2 2.66Å; A455-R463 HydrophobicContact CB-CG 3.81Å; A455-R463 PolarHBondContact N-O 2.93Å; A455-R463 PolarHBondContact O-N 2.94Å; Y458-R463 HydrophobicContact CD1-CB 3.88Å; Y458-R463 HydrophobicContact CD1-CG 3.91Å; Y458-R463 HydrophobicContact CD2-CG 4.24Å; Y458-R463 VanDerWaalsContact CD2-NE 3.27Å; Y458-R463 HydrophobicContact CG-CB 4.11Å; Y458-R463 HydrophobicContact CG-CG 3.63Å; R463-V465 HydrophobicContact CG-CG2 4.4Å; R463-I480 HydrophobicContact CB-CG2 4.35Å; R463-L481 CarbonylContact C-O 3.57Å; R463-L481 WeakPolarHBondContact CA-O 3.33Å; R463-L481 WeakPolarHBondContact CB-O 3.45Å
464	V	96.5	Very high	88.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	130.5	169.5	-179.5	0	0	0	0	108.4	I452 T453 I480 L481 F490 L494 V510	I452-V464 HydrophobicContact CG2-CG1 3.46Å; I452-V464 VanDerWaalsContact CG2-CG1 3.46Å; T453-V464 CarbonylContact O-C 3.54Å; T453-V464 WeakPolarHBondContact O-CA 3.43Å; V464-I480 CarbonylContact O-C 3.52Å; V464-I480 WeakPolarHBondContact O-CA 3.24Å; V464-L481 HydrophobicContact CB-CB 4.2Å; V464-L481 HydrophobicContact CB-CD1 4.48Å; V464-L481 PolarHBondContact N-O 2.86Å; V464-L481 PolarHBondContact O-N 2.94Å; V464-F490 HydrophobicContact CG2-CD1 4.35Å; V464-F490 HydrophobicContact CG2-CE1 3.81Å; V464-F490 HydrophobicContact CG2-CZ 4.39Å; V464-L494 HydrophobicContact CG1-CD1 4.28Å; V464-L494 HydrophobicContact CG1-CD2 3.97Å; V464-L494 HydrophobicContact CG2-CD2 3.71Å; V464-V510 HydrophobicContact CG2-CG1 3.75Å; V464-V510 HydrophobicContact CG2-CG2 4.31Å
465	V	93.9	Very high	88.2	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	125.4	-179.2	-176.2	0	0	0	0	108.6	F420 L436 I452 T453 R463 Y467 T477	F420-V465 HydrophobicContact CD1-CG1 4.36Å; L436-V465 HydrophobicContact CD1-CG2 4.07Å; I452-V465 WeakPolarHBondContact CA-O 3.44Å; T453-V465 HydrophobicContact CG2-CB 4.09Å; T453-V465 PolarHBondContact N-O 2.8Å; T453-V465 PolarHBondContact O-N 2.8Å; R463-V465 HydrophobicContact CG-CG2 4.4Å; V465-Y467 HydrophobicContact CG1-CD1 4.49Å; V465-T477 HydrophobicContact CG1-CG2 3.97Å
466	I	94.6	Very high	87.9	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	126.2	174.5	-58	118.2	0	0	0	108.1	L450 Y451 I452 V478 Q479 L481 F537	L450-I466 HydrophobicContact CB-CG2 4.19Å; L450-I466 HydrophobicContact CD1-CG2 4.25Å; L450-I466 HydrophobicContact CD2-CG2 4.26Å; L450-I466 HydrophobicContact CG-CG2 4.49Å; Y451-I466 CarbonylContact O-C 3.48Å; Y451-I466 WeakPolarHBondContact O-CA 3.48Å; I452-I466 HydrophobicContact CG1-CG1 4.2Å; I452-I466 HydrophobicContact CG1-CG2 4.44Å; I452-I466 HydrophobicContact CG2-CG1 4.18Å; I466-V478 PolarHBondContact O-N 2.81Å; I466-Q479 HydrophobicContact CB-CB 4.3Å; I466-Q479 HydrophobicContact CD1-CB 3.94Å; I466-Q479 HydrophobicContact CD1-CG 4.02Å; I466-Q479 PolarHBondContact N-O 3.01Å; I466-Q479 PolarHBondContact O-N 3.41Å; I466-Q479 VanDerWaalsContact O-N 3.13Å; I466-L481 HydrophobicContact CD1-CD1 3.92Å; I466-L481 HydrophobicContact CD1-CD2 4.46Å; I466-L481 HydrophobicContact CD1-CG 3.82Å; I466-F537 HydrophobicContact CD1-CD2 3.99Å; I466-F537 HydrophobicContact CG1-CD2 4.11Å; I466-F537 HydrophobicContact CG1-CE2 4.41Å; I466-F537 HydrophobicContact CG2-CE2 4.42Å
467	Y	91.9	Very high	87.6	Confident	5 Å²	5	61.8 Å²	61.8	2%	0.02	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	161.2	-172.5	66.3	-83.7	0	0	0	112.9	F420 Y451 T453 V465 V475 E476	F420-Y467 HydrophobicContact CD1-CD1 4.44Å; F420-Y467 HydrophobicContact CE1-CD1 4.09Å; F420-Y467 HydrophobicContact CE1-CD2 4.45Å; F420-Y467 AromaticContact CE1-CE1 3.88Å; F420-Y467 HydrophobicContact CE1-CE1 3.88Å; F420-Y467 HydrophobicContact CE1-CE2 4.23Å; F420-Y467 HydrophobicContact CE1-CG 4.37Å; F420-Y467 AromaticContact CE1-CZ 3.95Å; Y451-Y467 HydrophobicContact CD2-CD2 4.28Å; Y451-Y467 HydrophobicContact CD2-CE2 4.02Å; Y451-Y467 HydrophobicContact CG-CE2 4.07Å; Y451-Y467 PolarHBondContact N-O 2.91Å; Y451-Y467 WeakPolarHBondContact O-CD1 3.38Å; Y451-Y467 PolarHBondContact O-N 2.82Å; T453-Y467 HydrophobicContact CG2-CD1 4.41Å; T453-Y467 HydrophobicContact CG2-CE1 3.86Å; V465-Y467 HydrophobicContact CG1-CD1 4.49Å; Y467-V475 HydrophobicContact CD2-CB 4.38Å; Y467-V475 HydrophobicContact CD2-CG1 3.63Å; Y467-V475 HydrophobicContact CD2-CG2 4.14Å; Y467-V475 HydrophobicContact CE2-CG1 4.39Å; Y467-V475 HydrophobicContact CE2-CG2 4.2Å; Y467-V475 HydrophobicContact CG-CG1 3.83Å; Y467-E476 CarbonylContact C-O 3.51Å; Y467-E476 WeakPolarHBondContact CA-O 3.43Å; Y467-E476 WeakPolarHBondContact CB-O 3.49Å
468	R	90.5	Very high	87.4	Confident	60 Å²	60	59.1 Å²	59.1	23%	0.226	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	157.4	170.4	-73.3	-178.2	175.8	168.7	3.7	109.1	E447 L450 E476 V478	E447-R468 IonicContact OE2-CZ 3.77Å; E447-R468 IonicContact OE2-NH1 2.66Å; E447-R468 PolarHBondContact OE2-NH1 2.78Å; E447-R468 IonicContact OE2-NH2 2.82Å; E447-R468 PolarHBondContact OE2-NH2 2.7Å; L450-R468 HydrophobicContact CD2-CG 3.56Å; R468-E476 PolarHBondContact N-O 2.76Å; R468-E476 PolarHBondContact O-N 3.12Å; R468-V478 HydrophobicContact CB-CG2 4.36Å; R468-V478 HydrophobicContact CG-CG2 3.89Å
469	L	86	Confident	87.5	Confident	48 Å²	48	58.9 Å²	58.9	25%	0.251	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	131.9	167.4	-72.4	-176.8	0	0	0	110.2	M406 I413 Y451 V475	M406-L469 HydrophobicContact CE-CD1 3.36Å; M406-L469 HydrophobicContact CE-CG 4.14Å; M406-L469 HydrophobicContact SD-CD1 3.25Å; M406-L469 WeakPolarHBondContact SD-CD1 3.28Å; I413-L469 HydrophobicContact CD1-CD1 4.32Å; Y451-L469 HydrophobicContact CD2-CG 4.25Å; Y451-L469 HydrophobicContact CE2-CB 4.34Å; Y451-L469 HydrophobicContact CE2-CD1 4.11Å; Y451-L469 HydrophobicContact CE2-CG 3.91Å; L469-V475 HydrophobicContact CD2-CG2 3.96Å
470	T	81.9	Confident	87.8	Confident	48 Å²	48	55.6 Å²	55.6	29%	0.294	27%	0.27	S	S	.	.			trans	-76	165.8	170.6	59.2	0	0	0	0	110.5	D472 S473 R474 E476	T470-D472 PolarHBondContact O-N 2.86Å; T470-D472 VanDerWaalsContact O-N 3.13Å; T470-S473 PolarHBondContact O-N 2.87Å; T470-R474 PolarHBondContact N-O 2.84Å; T470-R474 WeakPolarHBondContact OG1-CB 3.07Å; T470-R474 PolarHBondContact OG1-N 2.78Å; T470-R474 VanDerWaalsContact OG1-N 3.14Å; T470-R474 PolarHBondContact OG1-O 3.36Å; T470-E476 HydrophobicContact CG2-CB 4.03Å
471	K	76.2	Confident	88.2	Confident	212 Å²	212	50.7 Å²	50.7	92%	0.922	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-26.9	176.7	-67.5	-174.1	178.4	-177.4	0	113.4	S473	K471-S473 PolarHBondContact O-N 2.83Å
472	D	74.7	Confident	88.3	Confident	132 Å²	132	56.7 Å²	56.7	71%	0.706	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	15.8	177.7	-56.6	-34.1	0	0	0	112.6	T470 R474	T470-D472 PolarHBondContact O-N 2.86Å; T470-D472 VanDerWaalsContact O-N 3.13Å; D472-R474 PolarHBondContact O-N 3.18Å
473	S	76.8	Confident	88.2	Confident	55 Å²	55	57.2 Å²	57.2	39%	0.385	27%	0.273	S	S	.	.	S	Bend	trans	61.6	21.4	-179.1	-56	0	0	0	0	115.3	T470 K471	T470-S473 PolarHBondContact O-N 2.87Å; K471-S473 PolarHBondContact O-N 2.83Å
474	R	80.8	Confident	88	Confident	168 Å²	168	63.5 Å²	63.5	63%	0.634	30%	0.303	S	S	*	.			trans	-92.7	147.7	173.4	-66.3	-178.4	172.8	172.7	-1.8	112	T470 D472	T470-R474 PolarHBondContact N-O 2.84Å; T470-R474 WeakPolarHBondContact OG1-CB 3.07Å; T470-R474 PolarHBondContact OG1-N 2.78Å; T470-R474 VanDerWaalsContact OG1-N 3.14Å; T470-R474 PolarHBondContact OG1-O 3.36Å; D472-R474 PolarHBondContact O-N 3.18Å
475	V	86.4	Confident	87.8	Confident	16 Å²	16	65.8 Å²	65.8	10%	0.097	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	125.2	177.9	172.5	0	0	0	0	110.8	P415 E419 F420 Y467 L469	P415-V475 HydrophobicContact CB-CG2 3.78Å; P415-V475 HydrophobicContact CG-CG2 3.77Å; E419-V475 HydrophobicContact CB-CB 4.03Å; E419-V475 PolarHBondContact OE2-N 3.17Å; F420-V475 HydrophobicContact CD1-CG1 3.84Å; F420-V475 HydrophobicContact CE1-CG1 3.82Å; F420-V475 HydrophobicContact CE1-CG2 4.1Å; F420-V475 HydrophobicContact CZ-CG2 4.09Å; Y467-V475 HydrophobicContact CD2-CB 4.38Å; Y467-V475 HydrophobicContact CD2-CG1 3.63Å; Y467-V475 HydrophobicContact CD2-CG2 4.14Å; Y467-V475 HydrophobicContact CE2-CG1 4.39Å; Y467-V475 HydrophobicContact CE2-CG2 4.2Å; Y467-V475 HydrophobicContact CG-CG1 3.83Å; L469-V475 HydrophobicContact CD2-CG2 3.96Å
476	E	88.4	Confident	87.7	Confident	115 Å²	115	71 Å²	71	54%	0.537	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	110.2	170.6	-175.8	178.1	-170.1	0	0	109.5	Y467 R468 T470 V478	Y467-E476 CarbonylContact C-O 3.51Å; Y467-E476 WeakPolarHBondContact CA-O 3.43Å; Y467-E476 WeakPolarHBondContact CB-O 3.49Å; R468-E476 PolarHBondContact N-O 2.76Å; R468-E476 PolarHBondContact O-N 3.12Å; T470-E476 HydrophobicContact CG2-CB 4.03Å; E476-V478 PolarHBondContact O-N 3.27Å
477	T	89	Confident	87.5	Confident	38 Å²	38	72.8 Å²	72.8	23%	0.233	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	119.1	179	-61.4	0	0	0	0	110.6	V465 I480	V465-T477 HydrophobicContact CG1-CG2 3.97Å; T477-I480 HydrophobicContact CG2-CD1 4.13Å; T477-I480 HydrophobicContact CG2-CG1 3.75Å
478	V	89.2	Confident	87.6	Confident	41 Å²	41	72.6 Å²	72.6	25%	0.248	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-42.4	179.9	178	0	0	0	0	111.3	L450 I466 R468 E476	L450-V478 HydrophobicContact CD2-CG2 4.21Å; I466-V478 PolarHBondContact O-N 2.81Å; R468-V478 HydrophobicContact CB-CG2 4.36Å; R468-V478 HydrophobicContact CG-CG2 3.89Å; E476-V478 PolarHBondContact O-N 3.27Å
479	Q	91.5	Very high	87.8	Confident	39 Å²	39	71.7 Å²	71.7	18%	0.182	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	148.5	-175.9	-179.1	173	10.3	0	0	111.4	I466 L481 F537	I466-Q479 HydrophobicContact CB-CB 4.3Å; I466-Q479 HydrophobicContact CD1-CB 3.94Å; I466-Q479 HydrophobicContact CD1-CG 4.02Å; I466-Q479 PolarHBondContact N-O 3.01Å; I466-Q479 PolarHBondContact O-N 3.41Å; I466-Q479 VanDerWaalsContact O-N 3.13Å; Q479-L481 HydrophobicContact CG-CD2 4.1Å; Q479-L481 VanDerWaalsContact NE2-CD2 3.3Å; Q479-F537 PolarHBondContact NE2-O 2.83Å
480	I	92	Very high	88.3	Confident	48 Å²	48	69.5 Å²	69.5	25%	0.246	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	124.6	171.6	-57.6	175.2	0	0	0	108.4	R463 V464 T477 R482	R463-I480 HydrophobicContact CB-CG2 4.35Å; V464-I480 CarbonylContact O-C 3.52Å; V464-I480 WeakPolarHBondContact O-CA 3.24Å; T477-I480 HydrophobicContact CG2-CD1 4.13Å; T477-I480 HydrophobicContact CG2-CG1 3.75Å; I480-R482 HydrophobicContact CG2-CG 4.33Å
481	L	94.5	Very high	89	Confident	11 Å²	11	67.2 Å²	67.2	6%	0.058	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	137.2	171.6	-50.6	176.2	0	0	0	108.7	R463 V464 I466 Q479 F490 L508 Y529	R463-L481 CarbonylContact C-O 3.57Å; R463-L481 WeakPolarHBondContact CA-O 3.33Å; R463-L481 WeakPolarHBondContact CB-O 3.45Å; V464-L481 HydrophobicContact CB-CB 4.2Å; V464-L481 HydrophobicContact CB-CD1 4.48Å; V464-L481 PolarHBondContact N-O 2.86Å; V464-L481 PolarHBondContact O-N 2.94Å; I466-L481 HydrophobicContact CD1-CD1 3.92Å; I466-L481 HydrophobicContact CD1-CD2 4.46Å; I466-L481 HydrophobicContact CD1-CG 3.82Å; Q479-L481 HydrophobicContact CG-CD2 4.1Å; Q479-L481 VanDerWaalsContact NE2-CD2 3.3Å; L481-F490 HydrophobicContact CB-CE1 4.32Å; L481-F490 HydrophobicContact CB-CZ 4.32Å; L481-L508 HydrophobicContact CD1-CD2 4.08Å; L481-Y529 HydrophobicContact CD1-CD1 3.95Å; L481-Y529 HydrophobicContact CD1-CD2 4.12Å; L481-Y529 HydrophobicContact CD1-CE1 3.89Å; L481-Y529 HydrophobicContact CD1-CE2 4.04Å; L481-Y529 HydrophobicContact CD1-CG 4.09Å; L481-Y529 HydrophobicContact CD2-CD1 4.15Å; L481-Y529 HydrophobicContact CD2-CE1 3.87Å; L481-Y529 HydrophobicContact CG-CE1 4.36Å
482	R	92.8	Very high	89.9	Confident	149 Å²	149	57.4 Å²	57.4	56%	0.562	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	137.6	-176.1	-65.7	-177.7	177.3	179.1	-2.2	110.5	I480	I480-R482 HydrophobicContact CG2-CG 4.33Å
483	G	90.6	Very high	91	Very high	11 Å²	11	52.2 Å²	52.2	11%	0.113	26%	0.261	C	S	.	.			trans	-71.6	148.9	173.1	0	0	0	0	0	112.1	G462	G462-G483 PolarHBondContact O-N 2.62Å
484	E	89.7	Confident	91.9	Very high	137 Å²	137	49.8 Å²	49.8	64%	0.64	24%	0.243	S	C	*	.	S	Bend	trans	-89.9	-35.3	-175	-60.3	173.7	145.1	0	0	112.8	Y527	E484-Y527 PolarHBondContact OE2-OH 3.21Å
485	Q	92.4	Very high	92.7	Very high	47 Å²	47	43.6 Å²	43.6	22%	0.22	22%	0.222	C	C	.	.	S	Bend	trans	-112.7	132.4	-171.8	-171.7	-169.5	88.7	0	0	111.4	S488 Y515 M516	Q485-S488 VanDerWaalsContact O-CB 3.32Å; Q485-S488 WeakPolarHBondContact O-CB 3.33Å; Q485-S488 PolarHBondContact O-N 2.92Å; Q485-S488 PolarHBondContact O-OG 2.87Å; Q485-Y515 HydrophobicContact CB-CD2 4.16Å; Q485-Y515 HydrophobicContact CB-CE2 4.02Å; Q485-M516 PolarHBondContact NE2-O 2.75Å
486	I	91.8	Very high	93.1	Very high	110 Å²	110	43.6 Å²	43.6	56%	0.564	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	137.4	173.9	-167.5	171.2	0	0	0	110.8	H460 T461 S488	H460-I486 HydrophobicContact CB-CD1 3.83Å; H460-I486 HydrophobicContact CB-CG1 3.57Å; H460-I486 CarbonylContact O-C 3.47Å; H460-I486 WeakPolarHBondContact O-CA 3.34Å; T461-I486 HydrophobicContact CG2-CB 4.31Å; I486-S488 PolarHBondContact O-N 2.93Å
487	G	90.1	Very high	93.3	Very high	39 Å²	39	38.2 Å²	38.2	40%	0.402	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.7	-3.7	-179.3	0	0	0	0	0	114.7	H460 Y489 M514	H460-G487 PolarHBondContact O-N 3.13Å; G487-Y489 PolarHBondContact O-N 3.24Å; G487-Y489 VanDerWaalsContact O-N 3.16Å; G487-M514 VanDerWaalsContact O-CB 3.22Å; G487-M514 WeakPolarHBondContact O-CB 3.46Å
488	S	93.6	Very high	93.5	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.193	C	C	.	.	S	Bend	trans	-67.2	-15.8	-178.4	64.4	0	0	0	0	114.5	T461 Q485 I486 F490 A512 M514	T461-S488 PolarHBondContact O-OG 2.85Å; Q485-S488 VanDerWaalsContact O-CB 3.32Å; Q485-S488 WeakPolarHBondContact O-CB 3.33Å; Q485-S488 PolarHBondContact O-N 2.92Å; Q485-S488 PolarHBondContact O-OG 2.87Å; I486-S488 PolarHBondContact O-N 2.93Å; S488-F490 VanDerWaalsContact C-N 3.26Å; S488-F490 PolarHBondContact O-N 3.41Å; S488-A512 CarbonylContact O-C 3.49Å; S488-A512 VanDerWaalsContact O-C 3.25Å; S488-A512 WeakPolarHBondContact O-CA 3.25Å; S488-M514 PolarHBondContact O-N 3.08Å
489	Y	95.6	Very high	93.6	Very high	42 Å²	42	36 Å²	36	17%	0.165	18%	0.183	C	C	.	.			trans	61.8	34.1	-178.9	-138.1	-124	0	0	0	112.7	Y438 P456 R457 G487 G491 S492 M514	Y438-Y489 HydrophobicContact CE1-CE1 4.02Å; Y438-Y489 HydrophobicContact CE2-CE1 4.11Å; Y438-Y489 AromaticContact CE2-CZ 4Å; Y438-Y489 WeakPolarHBondContact CE2-OH 3.34Å; Y438-Y489 AromaticContact CZ-CE1 3.7Å; P456-Y489 HydrophobicContact CB-CD1 4.04Å; P456-Y489 HydrophobicContact CB-CD2 3.8Å; P456-Y489 HydrophobicContact CB-CE1 4.16Å; P456-Y489 HydrophobicContact CB-CE2 3.94Å; P456-Y489 HydrophobicContact CB-CG 3.84Å; P456-Y489 HydrophobicContact CG-CD1 4.44Å; P456-Y489 HydrophobicContact CG-CD2 4.44Å; P456-Y489 HydrophobicContact CG-CE1 4.06Å; P456-Y489 HydrophobicContact CG-CE2 4.08Å; R457-Y489 HydrophobicContact CG-CE2 3.96Å; G487-Y489 PolarHBondContact O-N 3.24Å; G487-Y489 VanDerWaalsContact O-N 3.16Å; Y489-G491 PolarHBondContact O-N 3.03Å; Y489-S492 WeakPolarHBondContact CD1-OG 3.38Å; Y489-S492 VanDerWaalsContact O-CB 3.27Å; Y489-S492 WeakPolarHBondContact O-CB 3.34Å; Y489-S492 PolarHBondContact O-N 2.75Å; Y489-S492 PolarHBondContact O-OG 3.34Å; Y489-M514 HydrophobicContact CG-SD 4.25Å
490	F	97.3	Very high	93.4	Very high	1 Å²	1	37.6 Å²	37.6	0%	0.004	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	126.8	-180	175.6	-91.7	0	0	0	112.2	P456 T461 G462 V464 L481 S488 V510 A512 Y527 Y529	P456-F490 WeakPolarHBondContact CA-O 3.39Å; T461-F490 WeakPolarHBondContact O-CB 3.29Å; G462-F490 WeakPolarHBondContact CA-O 3.15Å; V464-F490 HydrophobicContact CG2-CD1 4.35Å; V464-F490 HydrophobicContact CG2-CE1 3.81Å; V464-F490 HydrophobicContact CG2-CZ 4.39Å; L481-F490 HydrophobicContact CB-CE1 4.32Å; L481-F490 HydrophobicContact CB-CZ 4.32Å; S488-F490 VanDerWaalsContact C-N 3.26Å; S488-F490 PolarHBondContact O-N 3.41Å; F490-V510 HydrophobicContact CD1-CG1 4.37Å; F490-V510 HydrophobicContact CD2-CG1 3.88Å; F490-V510 HydrophobicContact CE1-CG1 4.06Å; F490-V510 HydrophobicContact CE2-CB 4.05Å; F490-V510 HydrophobicContact CE2-CG1 3.52Å; F490-V510 HydrophobicContact CG-CG1 4.3Å; F490-V510 HydrophobicContact CZ-CB 4.23Å; F490-V510 HydrophobicContact CZ-CG1 3.62Å; F490-A512 HydrophobicContact CB-CB 4.23Å; F490-A512 HydrophobicContact CD2-CB 4.37Å; F490-Y527 AromaticContact CD2-CD2 3.66Å; F490-Y527 HydrophobicContact CD2-CD2 3.66Å; F490-Y527 AromaticContact CD2-CE2 3.71Å; F490-Y527 HydrophobicContact CD2-CE2 3.71Å; F490-Y527 HydrophobicContact CD2-CG 4.4Å; F490-Y527 AromaticContact CE2-CD2 3.58Å; F490-Y527 HydrophobicContact CE2-CD2 3.58Å; F490-Y527 AromaticContact CE2-CE2 3.99Å; F490-Y527 HydrophobicContact CE2-CE2 3.99Å; F490-Y527 AromaticContact CE2-CG 3.87Å; F490-Y527 HydrophobicContact CE2-CG 3.87Å; F490-Y529 HydrophobicContact CE2-CE2 4.5Å; F490-Y529 HydrophobicContact CZ-CE2 4.31Å; F490-Y529 WeakPolarHBondContact CZ-OH 3.43Å
491	G	95.4	Very high	93.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	86	21.4	-177	0	0	0	0	0	113.4	G454 Y489 G511	G454-G491 WeakPolarHBondContact CA-O 3.4Å; Y489-G491 PolarHBondContact O-N 3.03Å; G491-G511 PolarHBondContact N-O 2.91Å
492	S	95.5	Very high	92.9	Very high	7 Å²	7	43.2 Å²	43.2	5%	0.049	22%	0.223	C	C	.	.	S	Bend	trans	-84.1	-21.2	171.2	48.3	0	0	0	0	113.6	Y438 Y489 P513	Y438-S492 WeakPolarHBondContact CD1-O 3Å; Y489-S492 WeakPolarHBondContact CD1-OG 3.38Å; Y489-S492 VanDerWaalsContact O-CB 3.27Å; Y489-S492 WeakPolarHBondContact O-CB 3.34Å; Y489-S492 PolarHBondContact O-N 2.75Å; Y489-S492 PolarHBondContact O-OG 3.34Å; S492-P513 WeakPolarHBondContact OG-CD 3.43Å
493	V	97	Very high	92.7	Very high	23 Å²	23	40.5 Å²	40.5	14%	0.139	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	129.9	175.8	-174	0	0	0	0	107.8	D439 G511 G570 T571 I573	D439-V493 WeakPolarHBondContact OD2-CA 3.43Å; V493-G511 PolarHBondContact O-N 3.25Å; V493-G570 WeakPolarHBondContact CG2-O 3.37Å; V493-T571 WeakPolarHBondContact CG2-O 3.03Å; V493-I573 HydrophobicContact CG1-CB 4.11Å; V493-I573 HydrophobicContact CG1-CD1 4.04Å; V493-I573 HydrophobicContact CG1-CG1 3.92Å
494	L	97.1	Very high	92.6	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.016	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	128.7	-176	-59.9	176.2	0	0	0	108.3	D439 Q441 I452 V464 L509 V510	D439-L494 HydrophobicContact CB-CD1 4.31Å; D439-L494 HydrophobicContact CB-CG 4.28Å; D439-L494 WeakPolarHBondContact OD2-CB 3.26Å; D439-L494 PolarHBondContact OD2-N 3.21Å; Q441-L494 HydrophobicContact CB-CB 4.33Å; I452-L494 HydrophobicContact CG2-CD1 3.95Å; V464-L494 HydrophobicContact CG1-CD1 4.28Å; V464-L494 HydrophobicContact CG1-CD2 3.97Å; V464-L494 HydrophobicContact CG2-CD2 3.71Å; L494-L509 WeakPolarHBondContact CA-O 2.79Å; L494-V510 HydrophobicContact CD2-CB 4.32Å; L494-V510 HydrophobicContact CD2-CG1 3.96Å; L494-V510 HydrophobicContact CD2-CG2 3.91Å
495	Q	96.3	Very high	92.7	Very high	38 Å²	38	37.7 Å²	37.7	18%	0.178	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	127.4	172.6	-173.3	64.9	-1.3	0	0	110.5	V497 L509 I573 A575	Q495-V497 HydrophobicContact CG-CG2 4.28Å; Q495-L509 HydrophobicContact CB-CB 4.43Å; Q495-L509 PolarHBondContact N-O 3.4Å; Q495-L509 PolarHBondContact O-N 3.46Å; Q495-I573 HydrophobicContact CB-CB 4.01Å; Q495-I573 HydrophobicContact CB-CG2 3.6Å; Q495-I573 HydrophobicContact CG-CG2 4.04Å; Q495-A575 HydrophobicContact CG-CB 4.07Å
496	T	94.9	Very high	92.7	Very high	16 Å²	16	37 Å²	37	10%	0.098	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	138.6	171.1	48.2	0	0	0	0	109.6	Q441 S442 A443 I452 T505 L507 L508	Q441-T496 HydrophobicContact CG-CG2 3.66Å; Q441-T496 VanDerWaalsContact CG-OG1 3.28Å; Q441-T496 WeakPolarHBondContact CG-OG1 3.27Å; Q441-T496 PolarHBondContact NE2-OG1 2.93Å; S442-T496 PolarHBondContact O-OG1 2.78Å; A443-T496 HydrophobicContact CB-CG2 4.01Å; I452-T496 HydrophobicContact CD1-CG2 3.79Å; T496-T505 HydrophobicContact CG2-CG2 3.9Å; T496-L507 WeakPolarHBondContact CA-O 3.31Å; T496-L508 HydrophobicContact CG2-CD1 3.97Å
497	V	93.5	Very high	92.8	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.012	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	125	-177.5	-167.3	0	0	0	0	108.9	Q495 V499 D506 L507 L509 A575 V587	Q495-V497 HydrophobicContact CG-CG2 4.28Å; V497-V499 HydrophobicContact CB-CG2 4.44Å; V497-V499 HydrophobicContact CG1-CG2 3.92Å; V497-D506 PolarHBondContact O-N 3.1Å; V497-L507 HydrophobicContact CB-CB 4.36Å; V497-L507 PolarHBondContact N-O 3.42Å; V497-L507 PolarHBondContact O-N 3.02Å; V497-L509 HydrophobicContact CG2-CD1 3.87Å; V497-L509 HydrophobicContact CG2-CG 4.3Å; V497-A575 HydrophobicContact CG1-CB 4.35Å; V497-A575 HydrophobicContact CG2-CB 4.09Å; V497-V587 HydrophobicContact CG1-CG2 4.05Å; V497-V587 HydrophobicContact CG2-CG2 3.89Å
498	D	92.6	Very high	93.1	Very high	28 Å²	28	29.9 Å²	29.9	15%	0.15	16%	0.162	C	C	.	.			trans	-90	107.8	162.9	172.4	-5.5	0	0	0	106.1	N500 N501 D502 S503 F504 N585	D498-N500 PolarHBondContact OD1-N 3.39Å; D498-N500 PolarHBondContact OD1-OD1 3.39Å; D498-N501 VanDerWaalsContact OD1-CA 3.23Å; D498-N501 WeakPolarHBondContact OD1-CA 3.23Å; D498-N501 PolarHBondContact OD1-N 2.96Å; D498-N501 WeakPolarHBondContact OD2-CA 3.36Å; D498-D502 PolarHBondContact OD1-N 3.41Å; D498-D502 PolarHBondContact OD2-N 2.7Å; D498-S503 WeakPolarHBondContact OD2-CA 3.37Å; D498-S503 PolarHBondContact OD2-N 3.49Å; D498-F504 WeakPolarHBondContact CA-O 3.05Å; D498-F504 WeakPolarHBondContact CB-O 3.34Å; D498-N585 VanDerWaalsContact O-CB 3.27Å; D498-N585 WeakPolarHBondContact O-CB 3.5Å; D498-N585 PolarHBondContact O-ND2 3.45Å
499	V	90.6	Very high	93.2	Very high	6 Å²	6	29.9 Å²	29.9	4%	0.036	16%	0.162	C	C	.	.	S	Bend	trans	-86.8	-34.5	-171.6	178.2	0	0	0	0	110.7	V497 D506 L507 L584 N585	V497-V499 HydrophobicContact CB-CG2 4.44Å; V497-V499 HydrophobicContact CG1-CG2 3.92Å; V499-D506 HydrophobicContact CB-CB 4.49Å; V499-D506 HydrophobicContact CG2-CB 4.33Å; V499-D506 PolarHBondContact N-OD2 3.44Å; V499-L507 HydrophobicContact CG2-CD1 3.61Å; V499-L507 HydrophobicContact CG2-CG 3.94Å; V499-L584 HydrophobicContact CG1-CB 4.45Å; V499-L584 CarbonylContact O-C 3.57Å; V499-L584 WeakPolarHBondContact O-CA 3.29Å; V499-L584 WeakPolarHBondContact O-CB 3.48Å; V499-N585 PolarHBondContact O-N 3.24Å
500	N	88.7	Confident	93.3	Very high	71 Å²	71	27.9 Å²	27.9	38%	0.38	15%	0.154	S	C	.	.	S	Bend	trans	-93.7	1.7	-176.9	67.8	-6.2	0	0	0	114	D498 D502 D506	D498-N500 PolarHBondContact OD1-N 3.39Å; D498-N500 PolarHBondContact OD1-OD1 3.39Å; N500-D502 VanDerWaalsContact C-N 3.33Å; N500-D502 VanDerWaalsContact ND2-CG 3.34Å; N500-D502 PolarHBondContact ND2-OD2 2.78Å; N500-D502 PolarHBondContact O-N 3.15Å; N500-D502 WeakPolarHBondContact OD1-CB 3.29Å; N500-D502 PolarHBondContact OD1-N 3.21Å; N500-D502 PolarHBondContact OD1-OD1 2.76Å; N500-D502 PolarHBondContact OD1-OD2 2.85Å; N500-D506 PolarHBondContact N-OD2 2.87Å; N500-D506 PolarHBondContact OD1-OD2 2.99Å
501	N	86.7	Confident	93.3	Very high	108 Å²	108	27.9 Å²	27.9	58%	0.578	15%	0.154	S	C	*	.	S	Bend	trans	60.3	37.6	178.9	-161.3	28	0	0	0	113.2	D498	D498-N501 VanDerWaalsContact OD1-CA 3.23Å; D498-N501 WeakPolarHBondContact OD1-CA 3.23Å; D498-N501 PolarHBondContact OD1-N 2.96Å; D498-N501 WeakPolarHBondContact OD2-CA 3.36Å
502	D	88.1	Confident	93.4	Very high	69 Å²	69	27.9 Å²	27.9	37%	0.369	15%	0.154	S	C	.	.	S	Bend	trans	-94.1	7.2	179.6	76.4	8.5	0	0	0	114.3	D498 N500 F504	D498-D502 PolarHBondContact OD1-N 3.41Å; D498-D502 PolarHBondContact OD2-N 2.7Å; N500-D502 VanDerWaalsContact C-N 3.33Å; N500-D502 VanDerWaalsContact ND2-CG 3.34Å; N500-D502 PolarHBondContact ND2-OD2 2.78Å; N500-D502 PolarHBondContact O-N 3.15Å; N500-D502 WeakPolarHBondContact OD1-CB 3.29Å; N500-D502 PolarHBondContact OD1-N 3.21Å; N500-D502 PolarHBondContact OD1-OD1 2.76Å; N500-D502 PolarHBondContact OD1-OD2 2.85Å; D502-F504 PolarHBondContact O-N 2.89Å; D502-F504 WeakPolarHBondContact OD1-CA 3.06Å; D502-F504 VanDerWaalsContact OD1-CB 3.25Å; D502-F504 WeakPolarHBondContact OD1-CB 3.07Å; D502-F504 PolarHBondContact OD1-N 2.97Å
503	S	88.2	Confident	93.3	Very high	92 Å²	92	28 Å²	28	64%	0.643	16%	0.155	S	C	*	.	S	Bend	trans	71.4	4.8	-174.1	-49.9	0	0	0	0	115.3	S444 D498	S444-S503 PolarHBondContact OG-O 2.82Å; D498-S503 WeakPolarHBondContact OD2-CA 3.37Å; D498-S503 PolarHBondContact OD2-N 3.49Å
504	F	90.4	Very high	93.1	Very high	75 Å²	75	29.7 Å²	29.7	33%	0.329	16%	0.162	S	C	.	.	S	Bend	trans	-109.5	149.7	172.2	-59.8	-71.7	0	0	0	111.5	P446 D498 D502 D506	P446-F504 HydrophobicContact CB-CE1 4.34Å; P446-F504 HydrophobicContact CG-CD1 4.13Å; P446-F504 HydrophobicContact CG-CE1 4.01Å; P446-F504 HydrophobicContact CG-CG 4.45Å; P446-F504 HydrophobicContact CG-CZ 4.21Å; D498-F504 WeakPolarHBondContact CA-O 3.05Å; D498-F504 WeakPolarHBondContact CB-O 3.34Å; D502-F504 PolarHBondContact O-N 2.89Å; D502-F504 WeakPolarHBondContact OD1-CA 3.06Å; D502-F504 VanDerWaalsContact OD1-CB 3.25Å; D502-F504 WeakPolarHBondContact OD1-CB 3.07Å; D502-F504 PolarHBondContact OD1-N 2.97Å; F504-D506 PolarHBondContact O-N 3.19Å
505	T	91.9	Very high	92.9	Very high	14 Å²	14	32 Å²	32	9%	0.086	17%	0.171	C	C	.	.			trans	-80.7	118.6	-179.8	-57.6	0	0	0	0	110.7	A443 S444 T496 L507 L531	A443-T505 WeakPolarHBondContact CA-OG1 3.41Å; A443-T505 HydrophobicContact CB-CG2 3.83Å; S444-T505 PolarHBondContact N-OG1 3.29Å; S444-T505 PolarHBondContact O-N 2.86Å; T496-T505 HydrophobicContact CG2-CG2 3.9Å; T505-L507 WeakPolarHBondContact CG2-O 3.46Å; T505-L531 WeakPolarHBondContact O-CD2 3.35Å
506	D	90.9	Very high	92.6	Very high	33 Å²	33	34.3 Å²	34.3	18%	0.176	18%	0.183	C	C	.	.			trans	-85.2	-47	176.1	-73.6	-46.8	0	0	0	112.5	V497 V499 N500 F504 L531	V497-D506 PolarHBondContact O-N 3.1Å; V499-D506 HydrophobicContact CB-CB 4.49Å; V499-D506 HydrophobicContact CG2-CB 4.33Å; V499-D506 PolarHBondContact N-OD2 3.44Å; N500-D506 PolarHBondContact N-OD2 2.87Å; N500-D506 PolarHBondContact OD1-OD2 2.99Å; F504-D506 PolarHBondContact O-N 3.19Å; D506-L531 PolarHBondContact O-N 3.49Å
507	L	93.8	Very high	91.9	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	146.9	-169.5	-58.7	-177.9	0	0	0	112	T496 V497 V499 T505 V528 Y529 K530 L613	T496-L507 WeakPolarHBondContact CA-O 3.31Å; V497-L507 HydrophobicContact CB-CB 4.36Å; V497-L507 PolarHBondContact N-O 3.42Å; V497-L507 PolarHBondContact O-N 3.02Å; V499-L507 HydrophobicContact CG2-CD1 3.61Å; V499-L507 HydrophobicContact CG2-CG 3.94Å; T505-L507 WeakPolarHBondContact CG2-O 3.46Å; L507-V528 HydrophobicContact CD1-CG1 4.17Å; L507-V528 HydrophobicContact CD2-CG1 4.17Å; L507-Y529 CarbonylContact C-O 3.47Å; L507-Y529 VanDerWaalsContact CA-O 3.31Å; L507-Y529 WeakPolarHBondContact CA-O 3.17Å; L507-K530 HydrophobicContact CD2-CB 3.96Å; L507-K530 HydrophobicContact CD2-CG 4.15Å; L507-L613 HydrophobicContact CD1-CD1 4.39Å; L507-L613 HydrophobicContact CD1-CG 4.41Å
508	L	96.3	Very high	91.1	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	119.9	164.5	172	66.8	0	0	0	108.2	I452 L481 T496 V510 Y529 F537	I452-L508 HydrophobicContact CD1-CD1 3.88Å; I452-L508 HydrophobicContact CD1-CD2 4.12Å; I452-L508 HydrophobicContact CG2-CD1 4.38Å; I452-L508 HydrophobicContact CG2-CD2 4.27Å; L481-L508 HydrophobicContact CD1-CD2 4.08Å; T496-L508 HydrophobicContact CG2-CD1 3.97Å; L508-V510 HydrophobicContact CD2-CG2 4.16Å; L508-V510 HydrophobicContact CG-CG2 3.98Å; L508-Y529 PolarHBondContact N-O 3.31Å; L508-Y529 PolarHBondContact O-N 2.87Å; L508-F537 HydrophobicContact CB-CD1 3.64Å; L508-F537 HydrophobicContact CB-CE1 3.46Å; L508-F537 VanDerWaalsContact CB-CE1 3.46Å; L508-F537 HydrophobicContact CB-CG 4.31Å; L508-F537 HydrophobicContact CB-CZ 4Å; L508-F537 HydrophobicContact CD2-CD1 4.31Å; L508-F537 HydrophobicContact CD2-CD2 4.14Å; L508-F537 HydrophobicContact CD2-CE1 4.47Å; L508-F537 HydrophobicContact CD2-CE2 4.29Å; L508-F537 HydrophobicContact CD2-CG 4.14Å; L508-F537 HydrophobicContact CD2-CZ 4.45Å
509	L	96.9	Very high	90.1	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	128.7	173.7	-57.8	175.6	0	0	0	108.9	L494 Q495 V497 V526 Y527 V528 I573 V587 L613	L494-L509 WeakPolarHBondContact CA-O 2.79Å; Q495-L509 HydrophobicContact CB-CB 4.43Å; Q495-L509 PolarHBondContact N-O 3.4Å; Q495-L509 PolarHBondContact O-N 3.46Å; V497-L509 HydrophobicContact CG2-CD1 3.87Å; V497-L509 HydrophobicContact CG2-CG 4.3Å; L509-V526 HydrophobicContact CB-CG1 4.11Å; L509-V526 HydrophobicContact CD2-CG1 4.41Å; L509-Y527 WeakPolarHBondContact CA-O 3.41Å; L509-V528 HydrophobicContact CD2-CB 4.08Å; L509-V528 HydrophobicContact CD2-CG1 3.84Å; L509-V528 HydrophobicContact CD2-CG2 3.57Å; L509-I573 HydrophobicContact CB-CD1 4.2Å; L509-I573 HydrophobicContact CB-CG2 4.22Å; L509-I573 HydrophobicContact CD1-CG2 3.62Å; L509-V587 HydrophobicContact CD1-CB 4.37Å; L509-V587 HydrophobicContact CD1-CG1 3.48Å; L509-V587 VanDerWaalsContact CD1-CG1 3.48Å; L509-V587 HydrophobicContact CD1-CG2 3.99Å; L509-L613 HydrophobicContact CD2-CD1 4.2Å
510	V	98	Very high	89.3	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	114.4	179.4	-175.8	0	0	0	0	109.6	V464 F490 L494 L508 V526 Y527 Y529	V464-V510 HydrophobicContact CG2-CG1 3.75Å; V464-V510 HydrophobicContact CG2-CG2 4.31Å; F490-V510 HydrophobicContact CD1-CG1 4.37Å; F490-V510 HydrophobicContact CD2-CG1 3.88Å; F490-V510 HydrophobicContact CE1-CG1 4.06Å; F490-V510 HydrophobicContact CE2-CB 4.05Å; F490-V510 HydrophobicContact CE2-CG1 3.52Å; F490-V510 HydrophobicContact CG-CG1 4.3Å; F490-V510 HydrophobicContact CZ-CB 4.23Å; F490-V510 HydrophobicContact CZ-CG1 3.62Å; L494-V510 HydrophobicContact CD2-CB 4.32Å; L494-V510 HydrophobicContact CD2-CG1 3.96Å; L494-V510 HydrophobicContact CD2-CG2 3.91Å; L508-V510 HydrophobicContact CD2-CG2 4.16Å; L508-V510 HydrophobicContact CG-CG2 3.98Å; V510-V526 WeakPolarHBondContact O-CA 3.19Å; V510-Y527 PolarHBondContact N-O 2.99Å; V510-Y527 PolarHBondContact O-N 2.9Å; V510-Y529 HydrophobicContact CB-CE2 4.13Å; V510-Y529 HydrophobicContact CG2-CD2 3.85Å; V510-Y529 HydrophobicContact CG2-CE2 3.76Å
511	G	96.9	Very high	88.7	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	138.1	176.8	0	0	0	0	0	112.9	G491 V493	G491-G511 PolarHBondContact N-O 2.91Å; V493-G511 PolarHBondContact O-N 3.25Å
512	A	96.6	Very high	88.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	71.9	167.8	0	0	0	0	0	108.2	S488 F490 M514 Y515 G524 K525 Y527	S488-A512 CarbonylContact O-C 3.49Å; S488-A512 VanDerWaalsContact O-C 3.25Å; S488-A512 WeakPolarHBondContact O-CA 3.25Å; F490-A512 HydrophobicContact CB-CB 4.23Å; F490-A512 HydrophobicContact CD2-CB 4.37Å; A512-M514 PolarHBondContact O-N 3.2Å; A512-Y515 WeakPolarHBondContact O-CB 3.48Å; A512-Y515 PolarHBondContact O-N 3.18Å; A512-Y515 VanDerWaalsContact O-N 3.07Å; A512-G524 WeakPolarHBondContact O-CA 3.34Å; A512-K525 WeakPolarHBondContact CA-O 3.25Å; A512-K525 PolarHBondContact N-O 3.34Å; A512-K525 PolarHBondContact O-N 3.39Å; A512-Y527 HydrophobicContact CB-CD2 4.37Å; A512-Y527 HydrophobicContact CB-CE2 3.93Å
513	P	94.4	Very high	88.5	Confident	9 Å²	9	49.3 Å²	49.3	6%	0.058	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-22.7	-169.4	25.2	-34	0	0	0	113.6	S492 Y515 G524 R568 T571	S492-P513 WeakPolarHBondContact OG-CD 3.43Å; P513-Y515 VanDerWaalsContact C-N 3.34Å; P513-G524 VanDerWaalsContact O-CA 3.27Å; P513-G524 WeakPolarHBondContact O-CA 3.26Å; P513-R568 HydrophobicContact CB-CB 4.32Å; P513-R568 VanDerWaalsContact O-CA 3.27Å; P513-R568 WeakPolarHBondContact O-CA 3.33Å; P513-T571 WeakPolarHBondContact CB-OG1 3.06Å
514	M	92.9	Very high	88.6	Confident	59 Å²	59	45 Å²	45	29%	0.291	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	14.8	178	-62	-180	-174.7	0	0	112.4	G487 S488 Y489 A512 M516	G487-M514 VanDerWaalsContact O-CB 3.22Å; G487-M514 WeakPolarHBondContact O-CB 3.46Å; S488-M514 PolarHBondContact O-N 3.08Å; Y489-M514 HydrophobicContact CG-SD 4.25Å; A512-M514 PolarHBondContact O-N 3.2Å; M514-M516 PolarHBondContact O-N 3.41Å
515	Y	92.9	Very high	88.8	Confident	51 Å²	51	42.1 Å²	42.1	20%	0.2	20%	0.204	C	C	.	.			trans	-61	123.6	175.1	-174.8	-87.9	0	0	0	110.4	Q485 A512 P513 Q523 G524 K525	Q485-Y515 HydrophobicContact CB-CD2 4.16Å; Q485-Y515 HydrophobicContact CB-CE2 4.02Å; A512-Y515 WeakPolarHBondContact O-CB 3.48Å; A512-Y515 PolarHBondContact O-N 3.18Å; A512-Y515 VanDerWaalsContact O-N 3.07Å; P513-Y515 VanDerWaalsContact C-N 3.34Å; Y515-Q523 PolarHBondContact O-N 3.21Å; Y515-G524 PolarHBondContact O-N 2.73Å; Y515-K525 HydrophobicContact CD1-CB 3.89Å; Y515-K525 HydrophobicContact CD1-CD 4.06Å; Y515-K525 HydrophobicContact CD2-CB 4.29Å; Y515-K525 HydrophobicContact CD2-CD 4.1Å; Y515-K525 HydrophobicContact CE1-CD 3.93Å; Y515-K525 HydrophobicContact CE2-CD 3.96Å; Y515-K525 HydrophobicContact CG-CB 3.73Å; Y515-K525 HydrophobicContact CG-CD 4.15Å
516	M	88.9	Confident	89	Confident	88 Å²	88	41.5 Å²	41.5	43%	0.433	20%	0.2	S	C	.	.			trans	-80.7	123.2	177	-70.9	-177.4	-120.4	0	0	110.7	Q485 M514 D521	Q485-M516 PolarHBondContact NE2-O 2.75Å; M514-M516 PolarHBondContact O-N 3.41Å; M516-D521 WeakPolarHBondContact CA-O 3.45Å
517	G	81.3	Confident	89.2	Confident	10 Å²	10	40 Å²	40	10%	0.103	19%	0.192	C	C	.	.			trans	-73.1	177.9	175.2	0	0	0	0	0	113.4	E519 R520 D521	G517-E519 PolarHBondContact O-N 3.29Å; G517-R520 PolarHBondContact O-N 2.71Å; G517-D521 PolarHBondContact N-O 3.07Å
518	P	75.9	Confident	89.3	Confident	123 Å²	123	40 Å²	40	80%	0.799	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-25.1	179.6	25.1	-33.5	0	0	0	113.4	R520	P518-R520 VanDerWaalsContact C-N 3.31Å
519	E	71.1	Confident	89.2	Confident	138 Å²	138	40.9 Å²	40.9	65%	0.645	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.8	7.2	178.2	-57.9	-169.3	176.6	0	0	113.4	G517 D521	G517-E519 PolarHBondContact O-N 3.29Å; E519-D521 PolarHBondContact O-N 3.47Å
520	R	74.1	Confident	89	Confident	224 Å²	224	43.7 Å²	43.7	85%	0.845	21%	0.207	S	C	*	.	S	Bend	trans	63.2	26.2	-176.7	-53.5	-178.4	174.5	-177.3	-1.8	114.4	G517 P518	G517-R520 PolarHBondContact O-N 2.71Å; P518-R520 VanDerWaalsContact C-N 3.31Å
521	D	77.1	Confident	88.6	Confident	11 Å²	11	44.9 Å²	44.9	6%	0.059	21%	0.214	C	C	.	.	S	Bend	trans	-96.5	150.4	171.4	56.3	-30.8	0	0	0	110.8	M516 G517 E519 Q523 C565	M516-D521 WeakPolarHBondContact CA-O 3.45Å; G517-D521 PolarHBondContact N-O 3.07Å; E519-D521 PolarHBondContact O-N 3.47Å; D521-Q523 HydrophobicContact CB-CG 4.46Å; D521-Q523 VanDerWaalsContact CG-NE2 3.34Å; D521-Q523 PolarHBondContact O-N 3.41Å; D521-Q523 WeakPolarHBondContact OD1-CG 3.32Å; D521-Q523 PolarHBondContact OD1-NE2 3.26Å; D521-Q523 VanDerWaalsContact OD1-NE2 3.08Å; D521-Q523 WeakPolarHBondContact OD2-CG 3.36Å; D521-Q523 PolarHBondContact OD2-NE2 3.21Å; D521-C565 HydrophobicContact CB-CB 4.08Å
522	E	84.1	Confident	88.1	Confident	73 Å²	73	47.7 Å²	47.7	34%	0.341	23%	0.228	S	C	.	.			trans	-77	68.8	177.8	-67	-175.8	174.8	0	0	110.5	G524 G566 A567 R568	E522-G524 VanDerWaalsContact C-N 3.34Å; E522-G524 PolarHBondContact O-N 3.19Å; E522-G566 CarbonylContact O-C 3.53Å; E522-G566 WeakPolarHBondContact O-CA 3.05Å; E522-A567 PolarHBondContact O-N 3.1Å; E522-R568 HydrophobicContact CB-CG 4.42Å; E522-R568 PolarHBondContact O-N 3.43Å; E522-R568 IonicContact OE1-NH2 3.34Å; E522-R568 IonicContact OE2-CZ 3.95Å; E522-R568 IonicContact OE2-NE 3.32Å; E522-R568 PolarHBondContact OE2-NE 2.91Å; E522-R568 IonicContact OE2-NH2 3.9Å; E522-R568 PolarHBondContact OE2-NH2 2.96Å
523	Q	85.9	Confident	87.1	Confident	36 Å²	36	57.3 Å²	57.3	17%	0.168	27%	0.273	C	S	.	.			trans	-64.5	-40.3	-178.6	-65.9	-172.3	-11.4	0	0	111.7	Y515 D521 P545 A567 R568 F569	Y515-Q523 PolarHBondContact O-N 3.21Å; D521-Q523 HydrophobicContact CB-CG 4.46Å; D521-Q523 VanDerWaalsContact CG-NE2 3.34Å; D521-Q523 PolarHBondContact O-N 3.41Å; D521-Q523 WeakPolarHBondContact OD1-CG 3.32Å; D521-Q523 PolarHBondContact OD1-NE2 3.26Å; D521-Q523 VanDerWaalsContact OD1-NE2 3.08Å; D521-Q523 WeakPolarHBondContact OD2-CG 3.36Å; D521-Q523 PolarHBondContact OD2-NE2 3.21Å; Q523-P545 HydrophobicContact CB-CG 4.15Å; Q523-A567 WeakPolarHBondContact O-CB 2.97Å; Q523-R568 PolarHBondContact O-N 2.89Å; Q523-F569 VanDerWaalsContact O-CB 3.29Å; Q523-F569 WeakPolarHBondContact O-CB 3.25Å; Q523-F569 PolarHBondContact O-N 3.06Å
524	G	91.3	Very high	86.3	Confident	1 Å²	1	67 Å²	67	1%	0.01	31%	0.309	C	S	.	.			trans	78.2	155.5	-169.6	0	0	0	0	0	112.4	A512 P513 Y515 E522 P545 F569	A512-G524 WeakPolarHBondContact O-CA 3.34Å; P513-G524 VanDerWaalsContact O-CA 3.27Å; P513-G524 WeakPolarHBondContact O-CA 3.26Å; Y515-G524 PolarHBondContact O-N 2.73Å; E522-G524 VanDerWaalsContact C-N 3.34Å; E522-G524 PolarHBondContact O-N 3.19Å; G524-P545 WeakPolarHBondContact O-CD 3.47Å; G524-F569 CarbonylContact C-O 3.59Å; G524-F569 WeakPolarHBondContact CA-O 3.26Å
525	K	93.4	Very high	85.8	Confident	15 Å²	15	64.6 Å²	64.6	7%	0.065	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	144	-174.1	-173.1	171.9	-178.8	-172.7	0	110.3	A512 Y515 Y527 D542 F569	A512-K525 WeakPolarHBondContact CA-O 3.25Å; A512-K525 PolarHBondContact N-O 3.34Å; A512-K525 PolarHBondContact O-N 3.39Å; Y515-K525 HydrophobicContact CD1-CB 3.89Å; Y515-K525 HydrophobicContact CD1-CD 4.06Å; Y515-K525 HydrophobicContact CD2-CB 4.29Å; Y515-K525 HydrophobicContact CD2-CD 4.1Å; Y515-K525 HydrophobicContact CE1-CD 3.93Å; Y515-K525 HydrophobicContact CE2-CD 3.96Å; Y515-K525 HydrophobicContact CG-CB 3.73Å; Y515-K525 HydrophobicContact CG-CD 4.15Å; K525-Y527 HydrophobicContact CB-CE2 4.47Å; K525-Y527 HydrophobicContact CD-CE1 4.36Å; K525-Y527 HydrophobicContact CD-CE2 4.01Å; K525-Y527 HydrophobicContact CG-CD2 4.46Å; K525-Y527 HydrophobicContact CG-CE2 4.12Å; K525-D542 WeakPolarHBondContact CE-OD2 3.31Å; K525-D542 HydrophobicContact CG-CB 4.49Å; K525-D542 VanDerWaalsContact NZ-CG 3.29Å; K525-D542 IonicContact NZ-OD1 2.83Å; K525-D542 IonicContact NZ-OD2 2.71Å; K525-D542 PolarHBondContact NZ-OD2 2.96Å; K525-F569 PolarHBondContact N-O 3.23Å
526	V	96.5	Very high	85.6	Confident	0 Å²	0	67 Å²	67	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	122.8	173.1	177.4	0	0	0	0	109.6	L509 V510 L543 F569 G570 I573 I589	L509-V526 HydrophobicContact CB-CG1 4.11Å; L509-V526 HydrophobicContact CD2-CG1 4.41Å; V510-V526 WeakPolarHBondContact O-CA 3.19Å; V526-L543 HydrophobicContact CB-CB 4.22Å; V526-L543 PolarHBondContact N-O 3.47Å; V526-L543 PolarHBondContact O-N 2.83Å; V526-F569 HydrophobicContact CB-CE1 3.98Å; V526-F569 HydrophobicContact CG2-CD1 3.9Å; V526-F569 HydrophobicContact CG2-CE1 3.61Å; V526-F569 HydrophobicContact CG2-CZ 4.47Å; V526-G570 VanDerWaalsContact CG2-CA 3.46Å; V526-I573 HydrophobicContact CG1-CD1 3.77Å; V526-I573 HydrophobicContact CG2-CD1 3.91Å; V526-I573 HydrophobicContact CG2-CG1 4.47Å; V526-I589 HydrophobicContact CB-CD1 4.45Å; V526-I589 HydrophobicContact CG1-CD1 4.37Å; V526-I589 HydrophobicContact CG2-CD1 4.31Å; V526-I589 HydrophobicContact CG2-CG2 4.14Å
527	Y	95.8	Very high	85.8	Confident	3 Å²	3	63 Å²	63	1%	0.012	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	131.6	179.5	-67	-96.9	0	0	0	110	E484 F490 L509 V510 A512 K525 H539 D542	E484-Y527 PolarHBondContact OE2-OH 3.21Å; F490-Y527 AromaticContact CD2-CD2 3.66Å; F490-Y527 HydrophobicContact CD2-CD2 3.66Å; F490-Y527 AromaticContact CD2-CE2 3.71Å; F490-Y527 HydrophobicContact CD2-CE2 3.71Å; F490-Y527 HydrophobicContact CD2-CG 4.4Å; F490-Y527 AromaticContact CE2-CD2 3.58Å; F490-Y527 HydrophobicContact CE2-CD2 3.58Å; F490-Y527 AromaticContact CE2-CE2 3.99Å; F490-Y527 HydrophobicContact CE2-CE2 3.99Å; F490-Y527 AromaticContact CE2-CG 3.87Å; F490-Y527 HydrophobicContact CE2-CG 3.87Å; L509-Y527 WeakPolarHBondContact CA-O 3.41Å; V510-Y527 PolarHBondContact N-O 2.99Å; V510-Y527 PolarHBondContact O-N 2.9Å; A512-Y527 HydrophobicContact CB-CD2 4.37Å; A512-Y527 HydrophobicContact CB-CE2 3.93Å; K525-Y527 HydrophobicContact CB-CE2 4.47Å; K525-Y527 HydrophobicContact CD-CE1 4.36Å; K525-Y527 HydrophobicContact CD-CE2 4.01Å; K525-Y527 HydrophobicContact CG-CD2 4.46Å; K525-Y527 HydrophobicContact CG-CE2 4.12Å; Y527-H539 AromaticContact CD1-NE2 3.83Å; Y527-D542 WeakPolarHBondContact CD1-OD1 3.09Å
528	V	95.3	Very high	86.4	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	117.6	179.9	-171.9	0	0	0	0	110.3	L507 L509 K540 F541 L543	L507-V528 HydrophobicContact CD1-CG1 4.17Å; L507-V528 HydrophobicContact CD2-CG1 4.17Å; L509-V528 HydrophobicContact CD2-CB 4.08Å; L509-V528 HydrophobicContact CD2-CG1 3.84Å; L509-V528 HydrophobicContact CD2-CG2 3.57Å; V528-K540 PolarHBondContact O-N 2.85Å; V528-F541 HydrophobicContact CB-CD2 4.25Å; V528-F541 HydrophobicContact CB-CE1 4.27Å; V528-F541 HydrophobicContact CB-CE2 3.92Å; V528-F541 HydrophobicContact CB-CZ 3.9Å; V528-F541 WeakPolarHBondContact CB-O 3.41Å; V528-F541 HydrophobicContact CG1-CE1 4.05Å; V528-F541 HydrophobicContact CG1-CE2 4.24Å; V528-F541 HydrophobicContact CG1-CZ 3.73Å; V528-F541 HydrophobicContact CG2-CD2 3.97Å; V528-F541 HydrophobicContact CG2-CE2 3.49Å; V528-F541 VanDerWaalsContact CG2-CE2 3.49Å; V528-F541 HydrophobicContact CG2-CZ 3.88Å; V528-F541 PolarHBondContact N-O 2.68Å; V528-L543 HydrophobicContact CG2-CD1 4.02Å; V528-L543 HydrophobicContact CG2-CG 3.92Å
529	Y	94.4	Very high	87.2	Confident	18 Å²	18	63.4 Å²	63.4	7%	0.071	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	132.1	175.9	-62.6	-96.2	0	0	0	110.7	L481 F490 L507 L508 V510 F537 V538 H539	L481-Y529 HydrophobicContact CD1-CD1 3.95Å; L481-Y529 HydrophobicContact CD1-CD2 4.12Å; L481-Y529 HydrophobicContact CD1-CE1 3.89Å; L481-Y529 HydrophobicContact CD1-CE2 4.04Å; L481-Y529 HydrophobicContact CD1-CG 4.09Å; L481-Y529 HydrophobicContact CD2-CD1 4.15Å; L481-Y529 HydrophobicContact CD2-CE1 3.87Å; L481-Y529 HydrophobicContact CG-CE1 4.36Å; F490-Y529 HydrophobicContact CE2-CE2 4.5Å; F490-Y529 HydrophobicContact CZ-CE2 4.31Å; F490-Y529 WeakPolarHBondContact CZ-OH 3.43Å; L507-Y529 CarbonylContact C-O 3.47Å; L507-Y529 VanDerWaalsContact CA-O 3.31Å; L507-Y529 WeakPolarHBondContact CA-O 3.17Å; L508-Y529 PolarHBondContact N-O 3.31Å; L508-Y529 PolarHBondContact O-N 2.87Å; V510-Y529 HydrophobicContact CB-CE2 4.13Å; V510-Y529 HydrophobicContact CG2-CD2 3.85Å; V510-Y529 HydrophobicContact CG2-CE2 3.76Å; Y529-F537 HydrophobicContact CD1-CB 4.5Å; Y529-V538 CarbonylContact C-O 3.56Å; Y529-V538 WeakPolarHBondContact CA-O 3.34Å; Y529-H539 HydrophobicContact CD1-CB 3.9Å; Y529-H539 HydrophobicContact CE1-CB 3.67Å
530	K	91.9	Very high	88.1	Confident	59 Å²	59	62.1 Å²	62.1	26%	0.257	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	136.1	174.5	-175.2	-177.9	-179.9	-173.8	0	110.9	L507 F537 V538 K540 Y612	L507-K530 HydrophobicContact CD2-CB 3.96Å; L507-K530 HydrophobicContact CD2-CG 4.15Å; K530-F537 WeakPolarHBondContact O-CA 3.42Å; K530-V538 PolarHBondContact N-O 3.43Å; K530-V538 PolarHBondContact O-N 2.85Å; K530-K540 HydrophobicContact CB-CD 4.35Å; K530-K540 HydrophobicContact CB-CG 3.65Å; K530-Y612 HydrophobicContact CD-CE2 3.98Å; K530-Y612 PolarHBondContact NZ-OH 3.02Å
531	L	89.8	Confident	88.9	Confident	25 Å²	25	53.6 Å²	53.6	13%	0.131	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	128.9	171.2	-166.5	68.6	0	0	0	110.6	T445 L450 T505 D506 F537	T445-L531 HydrophobicContact CG2-CD2 3.59Å; L450-L531 HydrophobicContact CD1-CD1 4.34Å; T505-L531 WeakPolarHBondContact O-CD2 3.35Å; D506-L531 PolarHBondContact O-N 3.49Å; L531-F537 HydrophobicContact CB-CD1 4.28Å; L531-F537 HydrophobicContact CB-CE1 3.99Å; L531-F537 HydrophobicContact CD1-CD1 4.16Å; L531-F537 HydrophobicContact CD1-CD2 4.25Å; L531-F537 HydrophobicContact CD1-CE1 3.93Å; L531-F537 HydrophobicContact CD1-CE2 4.03Å; L531-F537 HydrophobicContact CD1-CG 4.32Å; L531-F537 HydrophobicContact CD1-CZ 3.86Å
532	N	85.9	Confident	89.5	Confident	58 Å²	58	55.4 Å²	55.4	31%	0.31	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-94.1	169.4	174.8	72.6	16.5	0	0	0	112	R534 G535 K536 V538	N532-R534 PolarHBondContact O-N 3.39Å; N532-R534 WeakPolarHBondContact OD1-CA 3.44Å; N532-R534 WeakPolarHBondContact OD1-CB 3.42Å; N532-R534 PolarHBondContact OD1-N 3.01Å; N532-G535 PolarHBondContact O-N 3.19Å; N532-G535 PolarHBondContact OD1-N 2.7Å; N532-K536 PolarHBondContact N-O 3.04Å; N532-K536 PolarHBondContact OD1-N 3.2Å; N532-K536 PolarHBondContact OD1-O 3.05Å; N532-V538 HydrophobicContact CB-CG2 4.27Å
533	E	77.3	Confident	89.9	Confident	202 Å²	202	52.6 Å²	52.6	94%	0.944	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-15.4	178.9	-63.2	176.8	178.9	0	0	114.3
534	R	77.9	Confident	90	Very high	213 Å²	213	55.2 Å²	55.2	80%	0.804	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	12.1	178	-57.9	-176.6	-177.2	178.5	1.7	112.7	N532 K536	N532-R534 PolarHBondContact O-N 3.39Å; N532-R534 WeakPolarHBondContact OD1-CA 3.44Å; N532-R534 WeakPolarHBondContact OD1-CB 3.42Å; N532-R534 PolarHBondContact OD1-N 3.01Å; R534-K536 VanDerWaalsContact C-N 3.33Å; R534-K536 PolarHBondContact O-N 3.12Å
535	G	81.3	Confident	89.7	Confident	9 Å²	9	55.8 Å²	55.8	9%	0.093	26%	0.261	C	S	.	.	S	Bend	trans	69.5	24.4	-179.9	0	0	0	0	0	114.5	N532	N532-G535 PolarHBondContact O-N 3.19Å; N532-G535 PolarHBondContact OD1-N 2.7Å
536	K	89.7	Confident	88.9	Confident	101 Å²	101	59.9 Å²	59.9	44%	0.439	28%	0.281	S	S	.	.			trans	-114.1	141.4	177.3	-65.9	-169.7	176.5	-168.5	0	111.9	N532 R534	N532-K536 PolarHBondContact N-O 3.04Å; N532-K536 PolarHBondContact OD1-N 3.2Å; N532-K536 PolarHBondContact OD1-O 3.05Å; R534-K536 VanDerWaalsContact C-N 3.33Å; R534-K536 PolarHBondContact O-N 3.12Å
537	F	93	Very high	87.4	Confident	3 Å²	3	67.7 Å²	67.7	1%	0.013	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	123.5	176.8	-74.5	-71.8	0	0	0	110.7	A443 L450 I452 I466 Q479 L508 Y529 K530 L531	A443-F537 HydrophobicContact CB-CZ 4.03Å; L450-F537 HydrophobicContact CD1-CE2 4.27Å; I452-F537 HydrophobicContact CD1-CE2 3.98Å; I452-F537 HydrophobicContact CD1-CZ 4.15Å; I466-F537 HydrophobicContact CD1-CD2 3.99Å; I466-F537 HydrophobicContact CG1-CD2 4.11Å; I466-F537 HydrophobicContact CG1-CE2 4.41Å; I466-F537 HydrophobicContact CG2-CE2 4.42Å; Q479-F537 PolarHBondContact NE2-O 2.83Å; L508-F537 HydrophobicContact CB-CD1 3.64Å; L508-F537 HydrophobicContact CB-CE1 3.46Å; L508-F537 VanDerWaalsContact CB-CE1 3.46Å; L508-F537 HydrophobicContact CB-CG 4.31Å; L508-F537 HydrophobicContact CB-CZ 4Å; L508-F537 HydrophobicContact CD2-CD1 4.31Å; L508-F537 HydrophobicContact CD2-CD2 4.14Å; L508-F537 HydrophobicContact CD2-CE1 4.47Å; L508-F537 HydrophobicContact CD2-CE2 4.29Å; L508-F537 HydrophobicContact CD2-CG 4.14Å; L508-F537 HydrophobicContact CD2-CZ 4.45Å; Y529-F537 HydrophobicContact CD1-CB 4.5Å; K530-F537 WeakPolarHBondContact O-CA 3.42Å; L531-F537 HydrophobicContact CB-CD1 4.28Å; L531-F537 HydrophobicContact CB-CE1 3.99Å; L531-F537 HydrophobicContact CD1-CD1 4.16Å; L531-F537 HydrophobicContact CD1-CD2 4.25Å; L531-F537 HydrophobicContact CD1-CE1 3.93Å; L531-F537 HydrophobicContact CD1-CE2 4.03Å; L531-F537 HydrophobicContact CD1-CG 4.32Å; L531-F537 HydrophobicContact CD1-CZ 3.86Å
538	V	92.6	Very high	85.8	Confident	63 Å²	63	69.4 Å²	69.4	38%	0.382	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	126.5	179.6	-177.1	0	0	0	0	108.7	Y529 K530 N532	Y529-V538 CarbonylContact C-O 3.56Å; Y529-V538 WeakPolarHBondContact CA-O 3.34Å; K530-V538 PolarHBondContact N-O 3.43Å; K530-V538 PolarHBondContact O-N 2.85Å; N532-V538 HydrophobicContact CB-CG2 4.27Å
539	H	93.1	Very high	83.8	Confident	79 Å²	79	75.2 Å²	75.2	37%	0.366	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	136.5	176.4	178.6	-98.2	0	0	0	110.7	Y527 Y529 D542	Y527-H539 AromaticContact CD1-NE2 3.83Å; Y529-H539 HydrophobicContact CD1-CB 3.9Å; Y529-H539 HydrophobicContact CE1-CB 3.67Å; H539-D542 IonicContact CD2-OD1 3.82Å; H539-D542 IonicContact CE1-OD1 2.79Å; H539-D542 IonicContact NE2-OD1 2.67Å; H539-D542 PolarHBondContact NE2-OD1 2.85Å
540	K	90.5	Very high	81.9	Confident	111 Å²	111	75.9 Å²	75.9	48%	0.483	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	-53.8	-179.5	-68.4	-60.1	-175.4	-179.9	0	112.7	V528 K530	V528-K540 PolarHBondContact O-N 2.85Å; K530-K540 HydrophobicContact CB-CD 4.35Å; K530-K540 HydrophobicContact CB-CG 3.65Å
541	F	89.5	Confident	80	Confident	45 Å²	45	75 Å²	75	20%	0.197	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	174.6	-179	59.4	-90	0	0	0	109.6	V528 L543 R611 Y612	V528-F541 HydrophobicContact CB-CD2 4.25Å; V528-F541 HydrophobicContact CB-CE1 4.27Å; V528-F541 HydrophobicContact CB-CE2 3.92Å; V528-F541 HydrophobicContact CB-CZ 3.9Å; V528-F541 WeakPolarHBondContact CB-O 3.41Å; V528-F541 HydrophobicContact CG1-CE1 4.05Å; V528-F541 HydrophobicContact CG1-CE2 4.24Å; V528-F541 HydrophobicContact CG1-CZ 3.73Å; V528-F541 HydrophobicContact CG2-CD2 3.97Å; V528-F541 HydrophobicContact CG2-CE2 3.49Å; V528-F541 VanDerWaalsContact CG2-CE2 3.49Å; V528-F541 HydrophobicContact CG2-CZ 3.88Å; V528-F541 PolarHBondContact N-O 2.68Å; F541-L543 HydrophobicContact CD2-CD2 4.21Å; F541-L543 HydrophobicContact CE2-CD2 3.79Å; F541-L543 HydrophobicContact CE2-CG 4.16Å; F541-R611 WeakPolarHBondContact CE1-O 3.36Å; F541-R611 WeakPolarHBondContact CZ-O 3.16Å; F541-Y612 HydrophobicContact CE1-CD2 4.5Å
542	D	91.3	Very high	78.2	Confident	50 Å²	50	77.9 Å²	77.9	27%	0.267	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	144.5	-179.6	-56.5	-41.5	0	0	0	110.6	K525 Y527 H539	K525-D542 WeakPolarHBondContact CE-OD2 3.31Å; K525-D542 HydrophobicContact CG-CB 4.49Å; K525-D542 VanDerWaalsContact NZ-CG 3.29Å; K525-D542 IonicContact NZ-OD1 2.83Å; K525-D542 IonicContact NZ-OD2 2.71Å; K525-D542 PolarHBondContact NZ-OD2 2.96Å; Y527-D542 WeakPolarHBondContact CD1-OD1 3.09Å; H539-D542 IonicContact CD2-OD1 3.82Å; H539-D542 IonicContact CE1-OD1 2.79Å; H539-D542 IonicContact NE2-OD1 2.67Å; H539-D542 PolarHBondContact NE2-OD1 2.85Å
543	L	91.2	Very high	76.3	Confident	14 Å²	14	79.6 Å²	79.6	7%	0.073	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	128.7	170.5	-61.1	176.3	0	0	0	108.8	V526 V528 F541 F569 I589 Y604 L613	V526-L543 HydrophobicContact CB-CB 4.22Å; V526-L543 PolarHBondContact N-O 3.47Å; V526-L543 PolarHBondContact O-N 2.83Å; V528-L543 HydrophobicContact CG2-CD1 4.02Å; V528-L543 HydrophobicContact CG2-CG 3.92Å; F541-L543 HydrophobicContact CD2-CD2 4.21Å; F541-L543 HydrophobicContact CE2-CD2 3.79Å; F541-L543 HydrophobicContact CE2-CG 4.16Å; L543-F569 HydrophobicContact CB-CE1 3.96Å; L543-F569 HydrophobicContact CB-CZ 4.21Å; L543-F569 WeakPolarHBondContact O-CE1 3.46Å; L543-I589 HydrophobicContact CD1-CD1 3.64Å; L543-Y604 HydrophobicContact CD1-CD1 4.46Å; L543-Y604 HydrophobicContact CD1-CE1 4.27Å; L543-Y604 HydrophobicContact CD2-CD1 4.26Å; L543-Y604 HydrophobicContact CD2-CE1 3.77Å; L543-L613 HydrophobicContact CD1-CD1 4.15Å
544	N	88.6	Confident	75	Confident	90 Å²	90	77.1 Å²	77.1	48%	0.481	41%	0.407	S	S	.	.			trans	-121.5	150.9	178.6	-56.2	-45.5	0	0	0	109
545	P	83.9	Confident	73.6	Confident	13 Å²	13	69.1 Å²	69.1	8%	0.084	38%	0.384	C	S	.	.			trans	-64.8	165.2	172.9	28.3	-33.9	0	0	0	111.5	Q523 G524 A567 F569	Q523-P545 HydrophobicContact CB-CG 4.15Å; G524-P545 WeakPolarHBondContact O-CD 3.47Å; P545-A567 HydrophobicContact CB-CB 4.3Å; P545-A567 HydrophobicContact CG-CB 4.37Å; P545-F569 HydrophobicContact CB-CB 3.89Å; P545-F569 HydrophobicContact CB-CD2 4.03Å; P545-F569 HydrophobicContact CB-CG 4.01Å; P545-F569 HydrophobicContact CG-CB 3.84Å; P545-F569 HydrophobicContact CG-CG 4.24Å
546	M	77.3	Confident	71.8	Confident	101 Å²	101	76.5 Å²	76.5	50%	0.498	42%	0.421	S	S	.	.			trans	-65.5	148.8	172.4	-74	176	71.9	0	0	110.4	Q548 Y602 L615 H618	M546-Q548 PolarHBondContact O-N 3.31Å; M546-Y602 HydrophobicContact CB-CE1 4.3Å; M546-Y602 HydrophobicContact CG-CE1 3.94Å; M546-Y602 PolarHBondContact N-OH 2.62Å; M546-Y602 HydrophobicContact SD-CE1 4.26Å; M546-L615 HydrophobicContact CG-CD2 4.28Å; M546-L615 HydrophobicContact SD-CD2 4.26Å; M546-H618 HydrophobicContact SD-CB 4.4Å
547	N	66.2	Low	69.9	Low	164 Å²	164	75.3 Å²	75.3	88%	0.877	44%	0.438	S	S	*	.			trans	-60.5	114	-179.7	-74.4	-5.2	0	0	0	110.4
548	Q	61.4	Low	67.9	Low	40 Å²	40	76.9 Å²	76.9	19%	0.187	45%	0.449	C	S	.	.			trans	-84.3	135.3	177.1	-67.5	176.3	2.9	0	0	109.5	M546 C550 E594	M546-Q548 PolarHBondContact O-N 3.31Å; Q548-C550 PolarHBondContact O-N 3.13Å; Q548-E594 PolarHBondContact NE2-OE1 3.03Å; Q548-E594 PolarHBondContact NE2-OE2 2.93Å
549	S	52.6	Low	65.9	Low	122 Å²	122	80.6 Å²	80.6	85%	0.853	47%	0.472	S	S	*	.			trans	-83.1	76.9	171	42.5	0	0	0	0	108.8	C551	S549-C551 PolarHBondContact O-N 3.34Å
550	C	54.3	Low	63.9	Low	31 Å²	31	82.2 Å²	82.2	21%	0.209	48%	0.481	C	S	.	.			trans	-69.4	126.4	178.4	-72.3	0	0	0	0	110.3	Q548 S552 C565	Q548-C550 PolarHBondContact O-N 3.13Å; C550-S552 VanDerWaalsContact C-N 3.28Å; C550-S552 PolarHBondContact O-N 3.22Å; C550-C565 HydrophobicContact CB-CB 3.96Å; C550-C565 VanDerWaalsContact CB-SG 3.54Å
551	C	53.3	Low	61.7	Low	41 Å²	41	83 Å²	83	28%	0.277	49%	0.485	S	S	.	.			trans	-73.9	79.7	177.2	-66.8	0	0	0	0	110.6	S549 C558	S549-C551 PolarHBondContact O-N 3.34Å; C551-C558 HydrophobicContact CB-CB 3.57Å; C551-C558 WeakPolarHBondContact CB-SG 3.01Å; C551-C558 WeakPolarHBondContact SG-CB 3.29Å; C551-C558 CovalentContact SG-SG 2.03Å; C551-C558 PolarHBondContact SG-SG 2.82Å
552	S	50.4	Low	59.7	Low	86 Å²	86	87.5 Å²	87.5	60%	0.601	51%	0.511	S	S	*	.			trans	-66.3	153.2	170.3	-156.5	0	0	0	0	110.5	C550 N554 S555	C550-S552 VanDerWaalsContact C-N 3.28Å; C550-S552 PolarHBondContact O-N 3.22Å; S552-N554 PolarHBondContact O-N 3.14Å; S552-S555 WeakPolarHBondContact O-CB 3.34Å; S552-S555 PolarHBondContact O-N 2.96Å
553	V	47.1	Very low	57.7	Low	94 Å²	94	88.8 Å²	88.8	57%	0.57	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-20.1	-174.3	-179.9	0	0	0	0	113.6
554	N	49.6	Very low	55.8	Low	149 Å²	149	92 Å²	92	80%	0.797	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	11.1	-178.7	-63.7	-13.1	0	0	0	114.7	S552 D556	S552-N554 PolarHBondContact O-N 3.14Å; N554-D556 PolarHBondContact O-N 2.83Å
555	S	49.6	Very low	54.5	Low	46 Å²	46	90.1 Å²	90.1	32%	0.322	53%	0.53	S	S	.	.			trans	-83.1	101.9	174.8	171.3	0	0	0	0	110.4	S552 G557	S552-S555 WeakPolarHBondContact O-CB 3.34Å; S552-S555 PolarHBondContact O-N 2.96Å; S555-G557 PolarHBondContact O-N 3.04Å
556	D	43.5	Very low	54.1	Low	163 Å²	163	89.9 Å²	89.9	87%	0.872	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	92.1	173.3	-80.3	-28.3	0	0	0	109.8	N554	N554-D556 PolarHBondContact O-N 2.83Å
557	G	49.4	Very low	54.4	Low	77 Å²	77	85.1 Å²	85.1	79%	0.794	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	154.9	-15.4	177.8	0	0	0	0	0	115.3	S555	S555-G557 PolarHBondContact O-N 3.04Å
558	C	51.7	Low	55.5	Low	35 Å²	35	80.2 Å²	80.2	24%	0.236	48%	0.476	C	S	.	.			trans	-84.9	128.6	178.5	-78.7	0	0	0	0	112.9	C551	C551-C558 HydrophobicContact CB-CB 3.57Å; C551-C558 WeakPolarHBondContact CB-SG 3.01Å; C551-C558 WeakPolarHBondContact SG-CB 3.29Å; C551-C558 CovalentContact SG-SG 2.03Å; C551-C558 PolarHBondContact SG-SG 2.82Å
559	T	50.1	Low	57.1	Low	141 Å²	141	78.3 Å²	78.3	87%	0.865	47%	0.467	S	S	*	.	S	Bend	trans	-75.7	-20.4	173.1	36.7	0	0	0	0	113.7
560	M	50.4	Low	59.1	Low	113 Å²	113	72.5 Å²	72.5	56%	0.557	43%	0.426	S	S	*	.			trans	-112	96.4	-179.4	-68.4	-73.6	172	0	0	109.8
561	K	45	Very low	61	Low	128 Å²	128	73 Å²	73	56%	0.557	43%	0.428	S	S	*	.			trans	-94.1	129.2	175.1	-67.7	-176.9	176.6	-172	0	108.7
562	N	45.8	Very low	63	Low	140 Å²	140	71.5 Å²	71.5	75%	0.749	42%	0.419	S	S	*	.	S	Bend	trans	96.3	24.9	176.6	-52.8	-31.7	0	0	0	118.8
563	E	51.1	Low	65.2	Low	76 Å²	76	68.1 Å²	68.1	36%	0.355	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-86.4	140.3	171.5	-77.9	169.4	-165.6	0	0	112.3	C565	E563-C565 PolarHBondContact O-N 2.81Å; E563-C565 PolarHBondContact O-SG 2.97Å
564	P	50.7	Low	67.5	Low	81 Å²	81	64 Å²	64	53%	0.526	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-63.9	131.1	176.2	25	-30.2	0	0	0	110.7	H597	P564-H597 WeakPolarHBondContact CG-CE1 3.5Å
565	C	61.7	Low	69.6	Low	52 Å²	52	58 Å²	58	35%	0.351	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-101	131.2	-178.4	-60.9	0	0	0	0	110.1	D521 C550 E563	D521-C565 HydrophobicContact CB-CB 4.08Å; C550-C565 HydrophobicContact CB-CB 3.96Å; C550-C565 VanDerWaalsContact CB-SG 3.54Å; E563-C565 PolarHBondContact O-N 2.81Å; E563-C565 PolarHBondContact O-SG 2.97Å
566	G	74.8	Confident	71.6	Confident	8 Å²	8	55.9 Å²	55.9	8%	0.082	33%	0.326	C	S	.	.			trans	150.3	127.8	175.9	0	0	0	0	0	112.9	E522 F593	E522-G566 CarbonylContact O-C 3.53Å; E522-G566 WeakPolarHBondContact O-CA 3.05Å; G566-F593 CarbonylContact O-C 3.47Å; G566-F593 WeakPolarHBondContact O-CB 3.44Å
567	A	82.9	Confident	73.7	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	30%	0.299	C	S	.	.			trans	-79.4	-26.6	-178.3	0	0	0	0	0	113.1	E522 Q523 P545 F569 A591 F593 E594	E522-A567 PolarHBondContact O-N 3.1Å; Q523-A567 WeakPolarHBondContact O-CB 2.97Å; P545-A567 HydrophobicContact CB-CB 4.3Å; P545-A567 HydrophobicContact CG-CB 4.37Å; A567-F569 HydrophobicContact CB-CB 4.43Å; A567-F569 PolarHBondContact O-N 3.21Å; A567-A591 HydrophobicContact CB-CB 4.09Å; A567-A591 CarbonylContact O-C 3.59Å; A567-A591 VanDerWaalsContact O-C 3.24Å; A567-A591 WeakPolarHBondContact O-CA 3.44Å; A567-F593 PolarHBondContact O-N 3.05Å; A567-F593 VanDerWaalsContact O-N 3.13Å; A567-E594 HydrophobicContact CB-CB 4.29Å
568	R	90.9	Very high	75.6	Confident	61 Å²	61	47.8 Å²	47.8	23%	0.23	27%	0.268	C	S	.	.			trans	45.9	47.1	-162.2	-61.4	-168.6	174.9	176.3	-4	113.1	P513 E522 Q523 G570 T571 F593	P513-R568 HydrophobicContact CB-CB 4.32Å; P513-R568 VanDerWaalsContact O-CA 3.27Å; P513-R568 WeakPolarHBondContact O-CA 3.33Å; E522-R568 HydrophobicContact CB-CG 4.42Å; E522-R568 PolarHBondContact O-N 3.43Å; E522-R568 IonicContact OE1-NH2 3.34Å; E522-R568 IonicContact OE2-CZ 3.95Å; E522-R568 IonicContact OE2-NE 3.32Å; E522-R568 PolarHBondContact OE2-NE 2.91Å; E522-R568 IonicContact OE2-NH2 3.9Å; E522-R568 PolarHBondContact OE2-NH2 2.96Å; Q523-R568 PolarHBondContact O-N 2.89Å; R568-G570 PolarHBondContact O-N 2.83Å; R568-T571 WeakPolarHBondContact CB-OG1 3.15Å; R568-T571 PolarHBondContact O-N 3.45Å; R568-T571 PolarHBondContact O-OG1 2.02Å; R568-F593 HydrophobicContact CB-CB 4.39Å; R568-F593 HydrophobicContact CB-CD2 3.87Å; R568-F593 HydrophobicContact CB-CG 4.35Å; R568-F593 HydrophobicContact CG-CB 4.24Å; R568-F593 HydrophobicContact CG-CD2 3.93Å; R568-F593 HydrophobicContact CG-CG 4.07Å
569	F	93.8	Very high	77.4	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	131.2	177.3	178.5	-96.9	0	0	0	111.1	Q523 G524 K525 V526 L543 P545 A567 I589 A591 Y602 Y604	Q523-F569 VanDerWaalsContact O-CB 3.29Å; Q523-F569 WeakPolarHBondContact O-CB 3.25Å; Q523-F569 PolarHBondContact O-N 3.06Å; G524-F569 CarbonylContact C-O 3.59Å; G524-F569 WeakPolarHBondContact CA-O 3.26Å; K525-F569 PolarHBondContact N-O 3.23Å; V526-F569 HydrophobicContact CB-CE1 3.98Å; V526-F569 HydrophobicContact CG2-CD1 3.9Å; V526-F569 HydrophobicContact CG2-CE1 3.61Å; V526-F569 HydrophobicContact CG2-CZ 4.47Å; L543-F569 HydrophobicContact CB-CE1 3.96Å; L543-F569 HydrophobicContact CB-CZ 4.21Å; L543-F569 WeakPolarHBondContact O-CE1 3.46Å; P545-F569 HydrophobicContact CB-CB 3.89Å; P545-F569 HydrophobicContact CB-CD2 4.03Å; P545-F569 HydrophobicContact CB-CG 4.01Å; P545-F569 HydrophobicContact CG-CB 3.84Å; P545-F569 HydrophobicContact CG-CG 4.24Å; A567-F569 HydrophobicContact CB-CB 4.43Å; A567-F569 PolarHBondContact O-N 3.21Å; F569-I589 HydrophobicContact CD1-CG2 4.39Å; F569-I589 HydrophobicContact CD2-CG2 3.93Å; F569-I589 HydrophobicContact CE1-CD1 4.31Å; F569-I589 HydrophobicContact CE1-CG2 3.99Å; F569-I589 HydrophobicContact CE2-CB 3.89Å; F569-I589 HydrophobicContact CE2-CG2 3.48Å; F569-I589 VanDerWaalsContact CE2-CG2 3.48Å; F569-I589 HydrophobicContact CG-CG2 4.37Å; F569-I589 HydrophobicContact CZ-CB 3.95Å; F569-I589 HydrophobicContact CZ-CD1 3.75Å; F569-I589 HydrophobicContact CZ-CG1 4.43Å; F569-I589 HydrophobicContact CZ-CG2 3.52Å; F569-A591 HydrophobicContact CB-CB 4.4Å; F569-A591 HydrophobicContact CD2-CB 4.31Å; F569-Y602 AromaticContact CD2-CD2 3.78Å; F569-Y602 HydrophobicContact CD2-CD2 3.78Å; F569-Y602 AromaticContact CD2-CE2 3.87Å; F569-Y602 HydrophobicContact CD2-CE2 3.87Å; F569-Y602 HydrophobicContact CD2-CG 4.4Å; F569-Y602 HydrophobicContact CE2-CD1 4.45Å; F569-Y602 AromaticContact CE2-CD2 3.62Å; F569-Y602 HydrophobicContact CE2-CD2 3.62Å; F569-Y602 HydrophobicContact CE2-CE2 4.12Å; F569-Y602 AromaticContact CE2-CG 3.82Å; F569-Y602 HydrophobicContact CE2-CG 3.82Å; F569-Y604 HydrophobicContact CE2-CE2 4.48Å; F569-Y604 HydrophobicContact CZ-CE2 4.19Å; F569-Y604 WeakPolarHBondContact CZ-OH 3.37Å
570	G	94.3	Very high	79	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.7	17	-175	0	0	0	0	0	114.4	V493 V526 R568 A572 G590	V493-G570 WeakPolarHBondContact CG2-O 3.37Å; V526-G570 VanDerWaalsContact CG2-CA 3.46Å; R568-G570 PolarHBondContact O-N 2.83Å; G570-A572 VanDerWaalsContact C-N 3.28Å; G570-G590 PolarHBondContact N-O 2.89Å
571	T	95	Very high	80.6	Confident	42 Å²	42	37 Å²	37	26%	0.258	21%	0.205	S	C	.	.	S	Bend	trans	-69.7	-28.3	171.5	-62.5	0	0	0	0	112	V493 P513 R568 G590 P592	V493-T571 WeakPolarHBondContact CG2-O 3.03Å; P513-T571 WeakPolarHBondContact CB-OG1 3.06Å; R568-T571 WeakPolarHBondContact CB-OG1 3.15Å; R568-T571 PolarHBondContact O-N 3.45Å; R568-T571 PolarHBondContact O-OG1 2.02Å; T571-G590 PolarHBondContact N-O 3.45Å; T571-P592 HydrophobicContact CG2-CG 3.7Å
572	A	95.9	Very high	82.5	Confident	9 Å²	9	34.1 Å²	34.1	7%	0.074	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	139.5	170.7	0	0	0	0	0	109	G570 I589 G590 I635	G570-A572 VanDerWaalsContact C-N 3.28Å; A572-I589 WeakPolarHBondContact O-CA 3.43Å; A572-G590 PolarHBondContact O-N 3.46Å; A572-I635 HydrophobicContact CB-CD1 4.08Å; A572-I635 HydrophobicContact CB-CG1 4.11Å
573	I	96.8	Very high	84.4	Confident	15 Å²	15	29.5 Å²	29.5	8%	0.077	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	123.2	176.2	-54.9	172.2	0	0	0	106.6	V493 Q495 L509 V526 V587 V588 I589	V493-I573 HydrophobicContact CG1-CB 4.11Å; V493-I573 HydrophobicContact CG1-CD1 4.04Å; V493-I573 HydrophobicContact CG1-CG1 3.92Å; Q495-I573 HydrophobicContact CB-CB 4.01Å; Q495-I573 HydrophobicContact CB-CG2 3.6Å; Q495-I573 HydrophobicContact CG-CG2 4.04Å; L509-I573 HydrophobicContact CB-CD1 4.2Å; L509-I573 HydrophobicContact CB-CG2 4.22Å; L509-I573 HydrophobicContact CD1-CG2 3.62Å; V526-I573 HydrophobicContact CG1-CD1 3.77Å; V526-I573 HydrophobicContact CG2-CD1 3.91Å; V526-I573 HydrophobicContact CG2-CG1 4.47Å; I573-V587 HydrophobicContact CG2-CG1 4.01Å; I573-V588 WeakPolarHBondContact CA-O 3.27Å; I573-I589 HydrophobicContact CG1-CG2 4.37Å; I573-I589 HydrophobicContact CG2-CG1 4.35Å
574	A	95.1	Very high	86.2	Confident	8 Å²	8	26.8 Å²	26.8	7%	0.066	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	130.1	176	0	0	0	0	0	109.6	V576 V587 V588 I635	A574-V576 HydrophobicContact CB-CG2 4.28Å; A574-V587 WeakPolarHBondContact O-CA 3.4Å; A574-V588 PolarHBondContact N-O 3.47Å; A574-V588 PolarHBondContact O-N 3.36Å; A574-I635 HydrophobicContact CB-CB 3.97Å; A574-I635 HydrophobicContact CB-CG2 3.71Å
575	A	93.1	Very high	88.1	Confident	24 Å²	24	24 Å²	24	20%	0.198	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	124.1	162.1	0	0	0	0	0	107	Q495 V497	Q495-A575 HydrophobicContact CG-CB 4.07Å; V497-A575 HydrophobicContact CG1-CB 4.35Å; V497-A575 HydrophobicContact CG2-CB 4.09Å
576	V	91.8	Very high	89.6	Confident	1 Å²	1	21.5 Å²	21.5	1%	0.006	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	137.8	-179.9	179	0	0	0	0	106.9	A574 L579 D586 V588 G637 V647 V649	A574-V576 HydrophobicContact CB-CG2 4.28Å; V576-L579 HydrophobicContact CG1-CD1 3.97Å; V576-L579 HydrophobicContact CG1-CD2 3.69Å; V576-L579 HydrophobicContact CG1-CG 3.74Å; V576-D586 PolarHBondContact N-O 3.31Å; V576-D586 CarbonylContact O-C 3.5Å; V576-D586 PolarHBondContact O-N 3.18Å; V576-V588 HydrophobicContact CB-CG2 4.2Å; V576-V588 HydrophobicContact CG2-CB 4.09Å; V576-V588 HydrophobicContact CG2-CG2 3.51Å; V576-G637 VanDerWaalsContact CA-O 3.25Å; V576-G637 WeakPolarHBondContact CA-O 3.06Å; V576-G637 VanDerWaalsContact CG1-O 3.29Å; V576-G637 WeakPolarHBondContact CG1-O 3.45Å; V576-V647 HydrophobicContact CG1-CG2 3.85Å; V576-V649 HydrophobicContact CG1-CG2 4.19Å
577	S	88.3	Confident	90.6	Very high	43 Å²	43	21.1 Å²	21.1	30%	0.301	13%	0.129	S	C	.	.			trans	-61.8	161.8	174.5	-56.3	0	0	0	0	110.1	L579 N585 V647	S577-L579 PolarHBondContact O-N 3.36Å; S577-N585 WeakPolarHBondContact CA-OD1 3.37Å; S577-V647 VanDerWaalsContact O-CG2 3.27Å; S577-V647 WeakPolarHBondContact O-CG2 3.2Å
578	D	88.8	Confident	91.2	Very high	26 Å²	26	21.1 Å²	21.1	14%	0.139	13%	0.129	C	C	.	.			trans	-39.6	105.3	179.1	-175.5	-2.6	0	0	0	114.2	N580 L581 D582 G583 L584 N585	D578-N580 PolarHBondContact OD1-N 3.07Å; D578-N580 PolarHBondContact OD1-OD1 3.16Å; D578-L581 VanDerWaalsContact CG-CA 3.45Å; D578-L581 WeakPolarHBondContact OD1-CA 3.27Å; D578-L581 PolarHBondContact OD1-N 3.23Å; D578-L581 WeakPolarHBondContact OD2-CA 3.14Å; D578-D582 PolarHBondContact OD1-N 3.05Å; D578-D582 VanDerWaalsContact OD1-N 3.15Å; D578-D582 PolarHBondContact OD2-N 3.26Å; D578-G583 WeakPolarHBondContact OD2-CA 3.5Å; D578-G583 PolarHBondContact OD2-N 3.27Å; D578-L584 VanDerWaalsContact CA-O 3.29Å; D578-L584 WeakPolarHBondContact CA-O 3.46Å; D578-L584 WeakPolarHBondContact CB-O 3.41Å; D578-L584 VanDerWaalsContact CG-O 3.32Å; D578-N585 PolarHBondContact N-OD1 3.32Å
579	L	88.6	Confident	91.5	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	12%	0.118	C	C	.	.	S	Bend	trans	-83.4	-23.1	-178.5	-67	163.9	0	0	0	112	N26 V27 V576 S577 D586 I603 V647 V649 S662	N26-L579 VanDerWaalsContact ND2-CB 3.34Å; N26-L579 WeakPolarHBondContact ND2-CB 3.44Å; N26-L579 PolarHBondContact ND2-O 2.79Å; V27-L579 HydrophobicContact CG2-CD1 4.43Å; V576-L579 HydrophobicContact CG1-CD1 3.97Å; V576-L579 HydrophobicContact CG1-CD2 3.69Å; V576-L579 HydrophobicContact CG1-CG 3.74Å; S577-L579 PolarHBondContact O-N 3.36Å; L579-D586 WeakPolarHBondContact CB-OD2 3.21Å; L579-D586 HydrophobicContact CD1-CB 4.11Å; L579-D586 HydrophobicContact CG-CB 4.38Å; L579-D586 PolarHBondContact N-OD2 3.03Å; L579-I603 HydrophobicContact CD1-CG2 3.86Å; L579-V647 HydrophobicContact CD2-CG2 3.69Å; L579-V647 WeakPolarHBondContact CD2-O 3.41Å; L579-V647 HydrophobicContact CG-CG2 4.35Å; L579-V649 HydrophobicContact CD1-CG2 4.48Å; L579-V649 HydrophobicContact CD2-CG2 3.9Å; L579-S662 VanDerWaalsContact CD2-OG 3.3Å; L579-S662 WeakPolarHBondContact CD2-OG 3.42Å
580	N	84.6	Confident	91.5	Very high	11 Å²	11	18.2 Å²	18.2	6%	0.059	12%	0.118	C	C	.	.	S	Bend	trans	-110.5	4.2	-173.6	72.2	-13.2	0	0	0	113.6	F25 D578 D582 H605 V665 K709	F25-N580 HydrophobicContact CE1-CB 4.14Å; D578-N580 PolarHBondContact OD1-N 3.07Å; D578-N580 PolarHBondContact OD1-OD1 3.16Å; N580-D582 VanDerWaalsContact C-N 3.29Å; N580-D582 VanDerWaalsContact ND2-CG 3.34Å; N580-D582 PolarHBondContact ND2-OD2 3.39Å; N580-D582 PolarHBondContact O-N 3.13Å; N580-D582 WeakPolarHBondContact OD1-CB 3.47Å; N580-D582 PolarHBondContact OD1-N 2.79Å; N580-D582 PolarHBondContact OD1-OD1 2.88Å; N580-D582 PolarHBondContact OD1-OD2 3.45Å; N580-H605 PolarHBondContact ND2-CD2 2.89Å; N580-V665 HydrophobicContact CB-CG2 4.16Å; N580-K709 WeakPolarHBondContact O-CD 3.5Å
581	L	84.9	Confident	91.5	Very high	53 Å²	53	18.2 Å²	18.2	28%	0.277	12%	0.118	S	C	.	.	S	Bend	trans	56.6	37.2	-179.9	-56.5	178.4	0	0	0	113	D578 I646 K709	D578-L581 VanDerWaalsContact CG-CA 3.45Å; D578-L581 WeakPolarHBondContact OD1-CA 3.27Å; D578-L581 PolarHBondContact OD1-N 3.23Å; D578-L581 WeakPolarHBondContact OD2-CA 3.14Å; L581-I646 HydrophobicContact CD1-CD1 4.37Å; L581-I646 HydrophobicContact CD1-CG1 4.17Å; L581-K709 HydrophobicContact CB-CB 4.13Å; L581-K709 HydrophobicContact CD1-CB 4.47Å
582	D	83.6	Confident	91.3	Very high	67 Å²	67	16.3 Å²	16.3	36%	0.358	11%	0.106	S	C	.	.	S	Bend	trans	-93.8	-1.4	178.2	78	10.6	0	0	0	114.7	D578 N580 L584	D578-D582 PolarHBondContact OD1-N 3.05Å; D578-D582 VanDerWaalsContact OD1-N 3.15Å; D578-D582 PolarHBondContact OD2-N 3.26Å; N580-D582 VanDerWaalsContact C-N 3.29Å; N580-D582 VanDerWaalsContact ND2-CG 3.34Å; N580-D582 PolarHBondContact ND2-OD2 3.39Å; N580-D582 PolarHBondContact O-N 3.13Å; N580-D582 WeakPolarHBondContact OD1-CB 3.47Å; N580-D582 PolarHBondContact OD1-N 2.79Å; N580-D582 PolarHBondContact OD1-OD1 2.88Å; N580-D582 PolarHBondContact OD1-OD2 3.45Å; D582-L584 VanDerWaalsContact OD1-CB 3.26Å; D582-L584 WeakPolarHBondContact OD1-CB 3.33Å; D582-L584 PolarHBondContact OD1-N 3.02Å
583	G	85.6	Confident	90.9	Very high	42 Å²	42	17.8 Å²	17.8	43%	0.433	11%	0.11	S	C	.	.	S	Bend	trans	89	4.8	-178.5	0	0	0	0	0	114.2	D578	D578-G583 WeakPolarHBondContact OD2-CA 3.5Å; D578-G583 PolarHBondContact OD2-N 3.27Å
584	L	89.4	Confident	90.3	Very high	19 Å²	19	17.5 Å²	17.5	10%	0.099	11%	0.109	C	C	.	.	S	Bend	trans	-116.1	142.3	177.7	-53	174.3	0	0	0	111.2	V499 D578 D582 Q608	V499-L584 HydrophobicContact CG1-CB 4.45Å; V499-L584 CarbonylContact O-C 3.57Å; V499-L584 WeakPolarHBondContact O-CA 3.29Å; V499-L584 WeakPolarHBondContact O-CB 3.48Å; D578-L584 VanDerWaalsContact CA-O 3.29Å; D578-L584 WeakPolarHBondContact CA-O 3.46Å; D578-L584 WeakPolarHBondContact CB-O 3.41Å; D578-L584 VanDerWaalsContact CG-O 3.32Å; D582-L584 VanDerWaalsContact OD1-CB 3.26Å; D582-L584 WeakPolarHBondContact OD1-CB 3.33Å; D582-L584 PolarHBondContact OD1-N 3.02Å; L584-Q608 HydrophobicContact CD1-CG 4.05Å
585	N	91.4	Very high	89.5	Confident	23 Å²	23	20.2 Å²	20.2	12%	0.123	12%	0.122	C	C	.	.			trans	-80.3	152.7	175.4	-67.4	-41.6	0	0	0	111.9	D498 V499 S577 D578	D498-N585 VanDerWaalsContact O-CB 3.27Å; D498-N585 WeakPolarHBondContact O-CB 3.5Å; D498-N585 PolarHBondContact O-ND2 3.45Å; V499-N585 PolarHBondContact O-N 3.24Å; S577-N585 WeakPolarHBondContact CA-OD1 3.37Å; D578-N585 PolarHBondContact N-OD1 3.32Å
586	D	92.8	Very high	88.7	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	169.8	-171.6	-67.6	-26	0	0	0	112.3	V576 L579 Y604 H605 G606	V576-D586 PolarHBondContact N-O 3.31Å; V576-D586 CarbonylContact O-C 3.5Å; V576-D586 PolarHBondContact O-N 3.18Å; L579-D586 WeakPolarHBondContact CB-OD2 3.21Å; L579-D586 HydrophobicContact CD1-CB 4.11Å; L579-D586 HydrophobicContact CG-CB 4.38Å; L579-D586 PolarHBondContact N-OD2 3.03Å; D586-Y604 WeakPolarHBondContact CB-O 3.42Å; D586-H605 WeakPolarHBondContact OD1-CA 3.36Å; D586-H605 IonicContact OD1-CG 2.76Å; D586-H605 IonicContact OD1-ND1 3.89Å; D586-H605 PolarHBondContact OD1-ND1 2.87Å; D586-H605 IonicContact OD2-CE1 3.19Å; D586-H605 PolarHBondContact OD2-CE1 3.21Å; D586-H605 IonicContact OD2-CG 3.98Å; D586-H605 IonicContact OD2-ND1 3.47Å; D586-H605 PolarHBondContact OD2-ND1 3.19Å; D586-G606 PolarHBondContact OD1-N 3.01Å
587	V	94.7	Very high	88.1	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	135.9	-178.5	179.3	0	0	0	0	110.2	V497 L509 I573 A574 I589 Y604 L613	V497-V587 HydrophobicContact CG1-CG2 4.05Å; V497-V587 HydrophobicContact CG2-CG2 3.89Å; L509-V587 HydrophobicContact CD1-CB 4.37Å; L509-V587 HydrophobicContact CD1-CG1 3.48Å; L509-V587 VanDerWaalsContact CD1-CG1 3.48Å; L509-V587 HydrophobicContact CD1-CG2 3.99Å; I573-V587 HydrophobicContact CG2-CG1 4.01Å; A574-V587 WeakPolarHBondContact O-CA 3.4Å; V587-I589 HydrophobicContact CG1-CD1 4.29Å; V587-I589 HydrophobicContact CG1-CG1 3.91Å; V587-Y604 PolarHBondContact N-O 3.19Å; V587-Y604 PolarHBondContact O-N 2.97Å; V587-L613 HydrophobicContact CB-CD2 4.29Å; V587-L613 HydrophobicContact CG2-CD1 4.2Å; V587-L613 HydrophobicContact CG2-CD2 3.8Å
588	V	95.5	Very high	87.9	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	127.9	176.7	-174.2	0	0	0	0	109.5	I573 A574 V576 V601 Y602 I603 I635	I573-V588 WeakPolarHBondContact CA-O 3.27Å; A574-V588 PolarHBondContact N-O 3.47Å; A574-V588 PolarHBondContact O-N 3.36Å; V576-V588 HydrophobicContact CB-CG2 4.2Å; V576-V588 HydrophobicContact CG2-CB 4.09Å; V576-V588 HydrophobicContact CG2-CG2 3.51Å; V588-V601 HydrophobicContact CG1-CG1 3.09Å; V588-Y602 CarbonylContact C-O 3.56Å; V588-Y602 WeakPolarHBondContact CA-O 3.43Å; V588-I603 HydrophobicContact CG1-CG1 4.36Å; V588-I603 HydrophobicContact CG2-CG1 4.23Å; V588-I603 HydrophobicContact CG2-CG2 4.44Å; V588-I635 HydrophobicContact CB-CG2 4.13Å; V588-I635 HydrophobicContact CG1-CD1 4.06Å; V588-I635 HydrophobicContact CG1-CG2 3.86Å
589	I	96.8	Very high	87.9	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	129.6	-174.6	-54.7	-179.8	0	0	0	110.3	V526 L543 F569 A572 I573 V587 V601 Y602 Y604	V526-I589 HydrophobicContact CB-CD1 4.45Å; V526-I589 HydrophobicContact CG1-CD1 4.37Å; V526-I589 HydrophobicContact CG2-CD1 4.31Å; V526-I589 HydrophobicContact CG2-CG2 4.14Å; L543-I589 HydrophobicContact CD1-CD1 3.64Å; F569-I589 HydrophobicContact CD1-CG2 4.39Å; F569-I589 HydrophobicContact CD2-CG2 3.93Å; F569-I589 HydrophobicContact CE1-CD1 4.31Å; F569-I589 HydrophobicContact CE1-CG2 3.99Å; F569-I589 HydrophobicContact CE2-CB 3.89Å; F569-I589 HydrophobicContact CE2-CG2 3.48Å; F569-I589 VanDerWaalsContact CE2-CG2 3.48Å; F569-I589 HydrophobicContact CG-CG2 4.37Å; F569-I589 HydrophobicContact CZ-CB 3.95Å; F569-I589 HydrophobicContact CZ-CD1 3.75Å; F569-I589 HydrophobicContact CZ-CG1 4.43Å; F569-I589 HydrophobicContact CZ-CG2 3.52Å; A572-I589 WeakPolarHBondContact O-CA 3.43Å; I573-I589 HydrophobicContact CG1-CG2 4.37Å; I573-I589 HydrophobicContact CG2-CG1 4.35Å; V587-I589 HydrophobicContact CG1-CD1 4.29Å; V587-I589 HydrophobicContact CG1-CG1 3.91Å; I589-V601 WeakPolarHBondContact O-CA 3.02Å; I589-Y602 PolarHBondContact N-O 3.28Å; I589-Y602 PolarHBondContact O-N 3.29Å; I589-Y604 HydrophobicContact CB-CE2 4.29Å; I589-Y604 HydrophobicContact CD1-CD2 3.98Å; I589-Y604 HydrophobicContact CD1-CE2 3.71Å; I589-Y604 HydrophobicContact CG1-CD2 4.18Å; I589-Y604 HydrophobicContact CG1-CE2 4.08Å
590	G	94.9	Very high	88	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	141.2	179.8	0	0	0	0	0	114.2	G570 T571 A572 G632	G570-G590 PolarHBondContact N-O 2.89Å; T571-G590 PolarHBondContact N-O 3.45Å; A572-G590 PolarHBondContact O-N 3.46Å; G590-G632 WeakPolarHBondContact CA-O 2.99Å
591	A	93.8	Very high	88.4	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	73.5	171.8	0	0	0	0	0	109.8	A567 F569 F593 E594 G599 A600 Y602	A567-A591 HydrophobicContact CB-CB 4.09Å; A567-A591 CarbonylContact O-C 3.59Å; A567-A591 VanDerWaalsContact O-C 3.24Å; A567-A591 WeakPolarHBondContact O-CA 3.44Å; F569-A591 HydrophobicContact CB-CB 4.4Å; F569-A591 HydrophobicContact CD2-CB 4.31Å; A591-F593 PolarHBondContact O-N 2.72Å; A591-F593 VanDerWaalsContact O-N 3.11Å; A591-E594 HydrophobicContact CB-CB 4.2Å; A591-E594 WeakPolarHBondContact O-CB 3.37Å; A591-E594 PolarHBondContact O-N 2.94Å; A591-G599 WeakPolarHBondContact O-CA 3.37Å; A591-A600 CarbonylContact C-O 3.53Å; A591-A600 PolarHBondContact N-O 2.89Å; A591-A600 PolarHBondContact O-N 3.33Å; A591-Y602 HydrophobicContact CB-CD2 4.29Å; A591-Y602 HydrophobicContact CB-CE2 3.71Å
592	P	91.6	Very high	88.8	Confident	1 Å²	1	23.4 Å²	23.4	1%	0.006	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-19.9	-170.1	16.3	-24.4	0	0	0	114.9	T571 G599 F630 F631 Q633	T571-P592 HydrophobicContact CG2-CG 3.7Å; P592-G599 WeakPolarHBondContact O-CA 3.14Å; P592-G599 PolarHBondContact O-N 3.2Å; P592-F630 HydrophobicContact CB-CB 3.77Å; P592-F630 WeakPolarHBondContact O-CA 3.43Å; P592-F631 WeakPolarHBondContact CA-O 3.35Å; P592-Q633 HydrophobicContact CB-CB 4.17Å; P592-Q633 HydrophobicContact CG-CB 4.36Å
593	F	87.6	Confident	89.2	Confident	40 Å²	40	20.3 Å²	20.3	18%	0.175	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-3.8	-175.6	-69.7	-107.9	0	0	0	112.9	G566 A567 R568 A591 H597 F630	G566-F593 CarbonylContact O-C 3.47Å; G566-F593 WeakPolarHBondContact O-CB 3.44Å; A567-F593 PolarHBondContact O-N 3.05Å; A567-F593 VanDerWaalsContact O-N 3.13Å; R568-F593 HydrophobicContact CB-CB 4.39Å; R568-F593 HydrophobicContact CB-CD2 3.87Å; R568-F593 HydrophobicContact CB-CG 4.35Å; R568-F593 HydrophobicContact CG-CB 4.24Å; R568-F593 HydrophobicContact CG-CD2 3.93Å; R568-F593 HydrophobicContact CG-CG 4.07Å; A591-F593 PolarHBondContact O-N 2.72Å; A591-F593 VanDerWaalsContact O-N 3.11Å; F593-H597 AromaticContact CD1-CD2 3.26Å; F593-H597 WeakPolarHBondContact CD1-CD2 3.45Å; F593-H597 AromaticContact CD1-NE2 3.53Å; F593-H597 AromaticContact CG-CD2 3.98Å; F593-H597 PolarHBondContact O-N 3.49Å; F593-H597 VanDerWaalsContact O-N 3.16Å; F593-F630 HydrophobicContact CD1-CD1 4.36Å; F593-F630 AromaticContact CD1-CE1 3.89Å; F593-F630 HydrophobicContact CD1-CE1 3.89Å; F593-F630 HydrophobicContact CD2-CD1 4.38Å; F593-F630 HydrophobicContact CE1-CD1 4.08Å; F593-F630 AromaticContact CE1-CE1 3.43Å; F593-F630 HydrophobicContact CE1-CE1 3.43Å; F593-F630 VanDerWaalsContact CE1-CE1 3.43Å; F593-F630 AromaticContact CE1-CZ 3.9Å; F593-F630 HydrophobicContact CE1-CZ 3.9Å; F593-F630 HydrophobicContact CE2-CD1 4.12Å; F593-F630 HydrophobicContact CE2-CE1 4.27Å; F593-F630 HydrophobicContact CG-CD1 4.47Å; F593-F630 HydrophobicContact CG-CE1 4.45Å; F593-F630 AromaticContact CZ-CD1 3.93Å; F593-F630 HydrophobicContact CZ-CD1 3.93Å; F593-F630 AromaticContact CZ-CE1 3.63Å; F593-F630 HydrophobicContact CZ-CE1 3.63Å; F593-F630 HydrophobicContact CZ-CE2 4.49Å; F593-F630 HydrophobicContact CZ-CG 4.48Å; F593-F630 AromaticContact CZ-CZ 3.97Å; F593-F630 HydrophobicContact CZ-CZ 3.97Å
594	E	84.1	Confident	89.5	Confident	9 Å²	9	18.7 Å²	18.7	4%	0.042	9%	0.088	C	C	.	.	H	α-helix	trans	-61.1	149.5	176.6	-179.4	150.3	-157.7	0	0	112.7	Q548 A567 A591 R598 G599 A600 Y602 H618	Q548-E594 PolarHBondContact NE2-OE1 3.03Å; Q548-E594 PolarHBondContact NE2-OE2 2.93Å; A567-E594 HydrophobicContact CB-CB 4.29Å; A591-E594 HydrophobicContact CB-CB 4.2Å; A591-E594 WeakPolarHBondContact O-CB 3.37Å; A591-E594 PolarHBondContact O-N 2.94Å; E594-R598 PolarHBondContact O-N 3.31Å; E594-G599 WeakPolarHBondContact O-CA 3.5Å; E594-G599 PolarHBondContact O-N 3.48Å; E594-A600 HydrophobicContact CB-CB 4.04Å; E594-A600 HydrophobicContact CG-CB 3.92Å; E594-Y602 PolarHBondContact OE1-OH 3.12Å; E594-Y602 VanDerWaalsContact OE2-CE2 3.23Å; E594-Y602 WeakPolarHBondContact OE2-CE2 3.43Å; E594-Y602 VanDerWaalsContact OE2-CZ 3.3Å; E594-Y602 PolarHBondContact OE2-OH 3.48Å; E594-H618 IonicContact OE1-NE2 2.63Å; E594-H618 IonicContact OE2-NE2 3.63Å
595	N	77.9	Confident	89.6	Confident	66 Å²	66	18.3 Å²	18.3	35%	0.353	9%	0.085	S	C	.	.	H	α-helix	trans	56.6	48.1	177.9	-61.6	-40.5	0	0	0	114.4	R598	N595-R598 HydrophobicContact CB-CB 4.44Å; N595-R598 PolarHBondContact O-NE 3.45Å; N595-R598 PolarHBondContact O-NH2 2.66Å; N595-R598 VanDerWaalsContact O-NH2 3.13Å
596	D	75.6	Confident	89.3	Confident	68 Å²	68	17.4 Å²	17.4	36%	0.364	8%	0.081	S	C	.	.	H	α-helix	trans	60.8	58.3	-176.5	-175.2	39.3	0	0	0	112.2	R598	D596-R598 PolarHBondContact O-N 3.21Å
597	H	80.4	Confident	88.6	Confident	55 Å²	55	21.2 Å²	21.2	26%	0.255	10%	0.099	S	C	.	.	H	α-helix	trans	61.2	9.2	177	-53.9	146.6	0	0	0	116.1	P564 F593 F630	P564-H597 WeakPolarHBondContact CG-CE1 3.5Å; F593-H597 AromaticContact CD1-CD2 3.26Å; F593-H597 WeakPolarHBondContact CD1-CD2 3.45Å; F593-H597 AromaticContact CD1-NE2 3.53Å; F593-H597 AromaticContact CG-CD2 3.98Å; F593-H597 PolarHBondContact O-N 3.49Å; F593-H597 VanDerWaalsContact O-N 3.16Å; H597-F630 HydrophobicContact CB-CD1 4.07Å; H597-F630 HydrophobicContact CB-CE1 3.65Å; H597-F630 AromaticContact CG-CE1 3.87Å; H597-F630 PolarHBondContact O-N 3.11Å
598	R	84.3	Confident	87.3	Confident	102 Å²	102	29.5 Å²	29.5	39%	0.385	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-39.9	171.2	-73.1	-174.9	-73.1	-140.5	-8.4	110.6	E594 N595 D596 A621 F631	E594-R598 PolarHBondContact O-N 3.31Å; N595-R598 HydrophobicContact CB-CB 4.44Å; N595-R598 PolarHBondContact O-NE 3.45Å; N595-R598 PolarHBondContact O-NH2 2.66Å; N595-R598 VanDerWaalsContact O-NH2 3.13Å; D596-R598 PolarHBondContact O-N 3.21Å; R598-A621 HydrophobicContact CB-CB 4.08Å; R598-A621 WeakPolarHBondContact O-CB 3.4Å; R598-F631 WeakPolarHBondContact O-CB 3.46Å; R598-F631 PolarHBondContact O-N 3.27Å
599	G	88.6	Confident	85.6	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	91.7	163.6	176.2	0	0	0	0	0	114	A591 P592 E594 A621 F631	A591-G599 WeakPolarHBondContact O-CA 3.37Å; P592-G599 WeakPolarHBondContact O-CA 3.14Å; P592-G599 PolarHBondContact O-N 3.2Å; E594-G599 WeakPolarHBondContact O-CA 3.5Å; E594-G599 PolarHBondContact O-N 3.48Å; G599-A621 VanDerWaalsContact O-CB 3.22Å; G599-A621 WeakPolarHBondContact O-CB 3.48Å; G599-A621 PolarHBondContact O-N 2.74Å; G599-F631 CarbonylContact C-O 3.56Å; G599-F631 VanDerWaalsContact CA-O 3.29Å; G599-F631 WeakPolarHBondContact CA-O 3.48Å
600	A	90.1	Very high	83.7	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	165.8	179.4	0	0	0	0	0	111.4	A591 E594 H618 I619 F631	A591-A600 CarbonylContact C-O 3.53Å; A591-A600 PolarHBondContact N-O 2.89Å; A591-A600 PolarHBondContact O-N 3.33Å; E594-A600 HydrophobicContact CB-CB 4.04Å; E594-A600 HydrophobicContact CG-CB 3.92Å; A600-H618 WeakPolarHBondContact CB-NE2 3.5Å; A600-I619 WeakPolarHBondContact CA-O 3.41Å; A600-F631 PolarHBondContact N-O 2.98Å
601	V	93.4	Very high	82	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	143	177.5	174.9	0	0	0	0	110.6	V588 I589 I619 F631 I635 I651	V588-V601 HydrophobicContact CG1-CG1 3.09Å; I589-V601 WeakPolarHBondContact O-CA 3.02Å; V601-I619 PolarHBondContact N-O 3.21Å; V601-I619 PolarHBondContact O-N 3.26Å; V601-F631 HydrophobicContact CB-CE1 4.48Å; V601-F631 HydrophobicContact CG2-CD1 4.25Å; V601-F631 HydrophobicContact CG2-CE1 3.96Å; V601-I635 HydrophobicContact CG1-CD1 4.04Å; V601-I635 HydrophobicContact CG2-CD1 4.02Å; V601-I651 HydrophobicContact CB-CD1 4Å; V601-I651 HydrophobicContact CG1-CD1 4.04Å; V601-I651 HydrophobicContact CG2-CD1 3.82Å; V601-I651 HydrophobicContact CG2-CG1 4.31Å; V601-I651 HydrophobicContact CG2-CG2 3.75Å
602	Y	93.1	Very high	80.9	Confident	0 Å²	0	51 Å²	51	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	131.1	-178.8	-64.7	-100.9	0	0	0	110	M546 F569 V588 I589 A591 E594 L615 H618	M546-Y602 HydrophobicContact CB-CE1 4.3Å; M546-Y602 HydrophobicContact CG-CE1 3.94Å; M546-Y602 PolarHBondContact N-OH 2.62Å; M546-Y602 HydrophobicContact SD-CE1 4.26Å; F569-Y602 AromaticContact CD2-CD2 3.78Å; F569-Y602 HydrophobicContact CD2-CD2 3.78Å; F569-Y602 AromaticContact CD2-CE2 3.87Å; F569-Y602 HydrophobicContact CD2-CE2 3.87Å; F569-Y602 HydrophobicContact CD2-CG 4.4Å; F569-Y602 HydrophobicContact CE2-CD1 4.45Å; F569-Y602 AromaticContact CE2-CD2 3.62Å; F569-Y602 HydrophobicContact CE2-CD2 3.62Å; F569-Y602 HydrophobicContact CE2-CE2 4.12Å; F569-Y602 AromaticContact CE2-CG 3.82Å; F569-Y602 HydrophobicContact CE2-CG 3.82Å; V588-Y602 CarbonylContact C-O 3.56Å; V588-Y602 WeakPolarHBondContact CA-O 3.43Å; I589-Y602 PolarHBondContact N-O 3.28Å; I589-Y602 PolarHBondContact O-N 3.29Å; A591-Y602 HydrophobicContact CB-CD2 4.29Å; A591-Y602 HydrophobicContact CB-CE2 3.71Å; E594-Y602 PolarHBondContact OE1-OH 3.12Å; E594-Y602 VanDerWaalsContact OE2-CE2 3.23Å; E594-Y602 WeakPolarHBondContact OE2-CE2 3.43Å; E594-Y602 VanDerWaalsContact OE2-CZ 3.3Å; E594-Y602 PolarHBondContact OE2-OH 3.48Å; Y602-L615 HydrophobicContact CD1-CD1 3.86Å; Y602-L615 HydrophobicContact CD1-CD2 4.34Å; Y602-L615 HydrophobicContact CG-CD1 4.47Å; Y602-H618 AromaticContact CD1-CD2 3.98Å; Y602-H618 AromaticContact CE1-CD2 3.64Å; Y602-H618 AromaticContact CE2-CD2 3.99Å; Y602-H618 AromaticContact CZ-CD2 3.65Å; Y602-H618 AromaticContact CZ-NE2 3.99Å
603	I	92.4	Very high	80.5	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	124.9	179.1	-55.7	-179.8	0	0	0	109	V27 L579 V588 V616 Q617 I619	V27-I603 HydrophobicContact CB-CD1 3.88Å; V27-I603 HydrophobicContact CG1-CD1 4.41Å; V27-I603 HydrophobicContact CG2-CD1 3.51Å; L579-I603 HydrophobicContact CD1-CG2 3.86Å; V588-I603 HydrophobicContact CG1-CG1 4.36Å; V588-I603 HydrophobicContact CG2-CG1 4.23Å; V588-I603 HydrophobicContact CG2-CG2 4.44Å; I603-V616 HydrophobicContact CB-CG2 4.26Å; I603-V616 HydrophobicContact CG2-CG2 3.93Å; I603-V616 VanDerWaalsContact O-CG2 3.29Å; I603-V616 WeakPolarHBondContact O-CG2 3.44Å; I603-V616 PolarHBondContact O-N 2.73Å; I603-Q617 HydrophobicContact CB-CB 4.18Å; I603-Q617 HydrophobicContact CD1-CB 4.26Å; I603-Q617 HydrophobicContact CD1-CG 4.2Å; I603-Q617 PolarHBondContact N-O 2.77Å; I603-Q617 PolarHBondContact O-N 2.97Å; I603-I619 HydrophobicContact CD1-CD1 3.82Å; I603-I619 HydrophobicContact CD1-CG1 4.46Å
604	Y	91.7	Very high	80.4	Confident	9 Å²	9	55.3 Å²	55.3	4%	0.035	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	123.1	178.5	-65.1	-95.8	0	0	0	109.8	L543 F569 D586 V587 I589 L613 K614 L615	L543-Y604 HydrophobicContact CD1-CD1 4.46Å; L543-Y604 HydrophobicContact CD1-CE1 4.27Å; L543-Y604 HydrophobicContact CD2-CD1 4.26Å; L543-Y604 HydrophobicContact CD2-CE1 3.77Å; F569-Y604 HydrophobicContact CE2-CE2 4.48Å; F569-Y604 HydrophobicContact CZ-CE2 4.19Å; F569-Y604 WeakPolarHBondContact CZ-OH 3.37Å; D586-Y604 WeakPolarHBondContact CB-O 3.42Å; V587-Y604 PolarHBondContact N-O 3.19Å; V587-Y604 PolarHBondContact O-N 2.97Å; I589-Y604 HydrophobicContact CB-CE2 4.29Å; I589-Y604 HydrophobicContact CD1-CD2 3.98Å; I589-Y604 HydrophobicContact CD1-CE2 3.71Å; I589-Y604 HydrophobicContact CG1-CD2 4.18Å; I589-Y604 HydrophobicContact CG1-CE2 4.08Å; Y604-L613 HydrophobicContact CD1-CB 4.45Å; Y604-K614 CarbonylContact C-O 3.53Å; Y604-K614 VanDerWaalsContact CA-O 3.27Å; Y604-K614 WeakPolarHBondContact CA-O 3.26Å; Y604-L615 HydrophobicContact CD1-CB 3.96Å; Y604-L615 HydrophobicContact CE1-CB 3.67Å; Y604-L615 HydrophobicContact CE1-CD1 4.11Å; Y604-L615 HydrophobicContact CE1-CG 4.42Å; Y604-L615 HydrophobicContact CE2-CD1 4.22Å
605	H	90.1	Very high	80.6	Confident	11 Å²	11	58 Å²	58	5%	0.051	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	144.7	172.9	-70.5	-13.6	0	0	0	112.3	F25 N580 D586 L613 K614 V616	F25-H605 AromaticContact CD1-NE2 3.27Å; F25-H605 VanDerWaalsContact CD1-NE2 3.27Å; F25-H605 WeakPolarHBondContact CD1-NE2 3.24Å; F25-H605 AromaticContact CE1-NE2 3.38Å; F25-H605 WeakPolarHBondContact CE1-NE2 3.38Å; N580-H605 PolarHBondContact ND2-CD2 2.89Å; D586-H605 WeakPolarHBondContact OD1-CA 3.36Å; D586-H605 IonicContact OD1-CG 2.76Å; D586-H605 IonicContact OD1-ND1 3.89Å; D586-H605 PolarHBondContact OD1-ND1 2.87Å; D586-H605 IonicContact OD2-CE1 3.19Å; D586-H605 PolarHBondContact OD2-CE1 3.21Å; D586-H605 IonicContact OD2-CG 3.98Å; D586-H605 IonicContact OD2-ND1 3.47Å; D586-H605 PolarHBondContact OD2-ND1 3.19Å; H605-L613 CarbonylContact O-C 3.52Å; H605-L613 VanDerWaalsContact O-CA 3.3Å; H605-L613 WeakPolarHBondContact O-CA 3.41Å; H605-K614 PolarHBondContact N-O 2.89Å; H605-K614 PolarHBondContact O-N 3.22Å; H605-V616 HydrophobicContact CB-CG1 4.1Å
606	G	85.3	Confident	81	Confident	3 Å²	3	56.3 Å²	56.3	3%	0.031	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	142.7	167.3	0	0	0	0	0	111.6	D586	D586-G606 PolarHBondContact OD1-N 3.01Å
607	H	79.1	Confident	81.6	Confident	81 Å²	81	53.1 Å²	53.1	38%	0.375	25%	0.247	S	C	.	.			trans	-146.3	134.6	-180	-167	-95.6	0	0	0	112.5	S609 Y612	H607-S609 VanDerWaalsContact C-N 3.26Å; H607-S609 WeakPolarHBondContact CE1-CB 3.39Å; H607-S609 PolarHBondContact CE1-OG 3.09Å; H607-S609 VanDerWaalsContact ND1-CB 3.25Å; H607-S609 WeakPolarHBondContact ND1-CB 3.36Å; H607-S609 PolarHBondContact ND1-N 3.36Å; H607-S609 VanDerWaalsContact ND1-N 3.13Å; H607-S609 PolarHBondContact ND1-OG 3.12Å; H607-S609 PolarHBondContact O-N 2.96Å; H607-Y612 PolarHBondContact N-O 2.94Å; H607-Y612 WeakPolarHBondContact O-CA 3.27Å
608	Q	67.5	Low	82	Confident	174 Å²	174	52.5 Å²	52.5	81%	0.813	24%	0.244	S	C	*	.	S	Bend	trans	-70.3	-12.7	-176.7	-67.9	-176	-6.9	0	0	115	L584	L584-Q608 HydrophobicContact CD1-CG 4.05Å
609	S	60	Low	82.2	Confident	55 Å²	55	47.7 Å²	47.7	39%	0.385	23%	0.226	S	C	.	.	S	Bend	trans	-80.7	174.5	179.4	82.5	0	0	0	0	113.8	H607 R611 Y612	H607-S609 VanDerWaalsContact C-N 3.26Å; H607-S609 WeakPolarHBondContact CE1-CB 3.39Å; H607-S609 PolarHBondContact CE1-OG 3.09Å; H607-S609 VanDerWaalsContact ND1-CB 3.25Å; H607-S609 WeakPolarHBondContact ND1-CB 3.36Å; H607-S609 PolarHBondContact ND1-N 3.36Å; H607-S609 VanDerWaalsContact ND1-N 3.13Å; H607-S609 PolarHBondContact ND1-OG 3.12Å; H607-S609 PolarHBondContact O-N 2.96Å; S609-R611 PolarHBondContact O-N 3.12Å; S609-Y612 PolarHBondContact O-N 2.89Å
610	N	55.9	Low	82	Confident	152 Å²	152	49.3 Å²	49.3	81%	0.813	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.3	-16.4	179.7	-79.9	-11.9	0	0	0	116.2
611	R	58.8	Low	81.6	Confident	192 Å²	192	50.3 Å²	50.3	73%	0.725	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-14.2	178.9	-69	-169	-174.5	-170.5	2.5	114.7	F541 S609 L613	F541-R611 WeakPolarHBondContact CE1-O 3.36Å; F541-R611 WeakPolarHBondContact CZ-O 3.16Å; S609-R611 PolarHBondContact O-N 3.12Å; R611-L613 PolarHBondContact O-N 3.18Å
612	Y	72.4	Confident	80	Confident	51 Å²	51	54.3 Å²	54.3	20%	0.2	29%	0.287	C	S	.	.			trans	55.4	-30.8	179	-69.2	-79	0	0	0	118.6	K530 F541 H607 S609	K530-Y612 HydrophobicContact CD-CE2 3.98Å; K530-Y612 PolarHBondContact NZ-OH 3.02Å; F541-Y612 HydrophobicContact CE1-CD2 4.5Å; H607-Y612 PolarHBondContact N-O 2.94Å; H607-Y612 WeakPolarHBondContact O-CA 3.27Å; S609-Y612 PolarHBondContact O-N 2.89Å
613	L	83.1	Confident	78.5	Confident	9 Å²	9	56.2 Å²	56.2	5%	0.047	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	135.8	-178.3	-67.2	175.3	0	0	0	109.4	L507 L509 L543 V587 Y604 H605 R611	L507-L613 HydrophobicContact CD1-CD1 4.39Å; L507-L613 HydrophobicContact CD1-CG 4.41Å; L509-L613 HydrophobicContact CD2-CD1 4.2Å; L543-L613 HydrophobicContact CD1-CD1 4.15Å; V587-L613 HydrophobicContact CB-CD2 4.29Å; V587-L613 HydrophobicContact CG2-CD1 4.2Å; V587-L613 HydrophobicContact CG2-CD2 3.8Å; Y604-L613 HydrophobicContact CD1-CB 4.45Å; H605-L613 CarbonylContact O-C 3.52Å; H605-L613 VanDerWaalsContact O-CA 3.3Å; H605-L613 WeakPolarHBondContact O-CA 3.41Å; R611-L613 PolarHBondContact O-N 3.18Å
614	K	85.3	Confident	76.9	Confident	123 Å²	123	60.3 Å²	60.3	54%	0.535	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	124.4	177.7	-177.4	-176	175.4	-170.2	0	110	Y604 H605 V616	Y604-K614 CarbonylContact C-O 3.53Å; Y604-K614 VanDerWaalsContact CA-O 3.27Å; Y604-K614 WeakPolarHBondContact CA-O 3.26Å; H605-K614 PolarHBondContact N-O 2.89Å; H605-K614 PolarHBondContact O-N 3.22Å; K614-V616 PolarHBondContact O-N 2.77Å
615	L	87.3	Confident	75.5	Confident	65 Å²	65	60.6 Å²	60.6	34%	0.34	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	124	173.2	179.3	63.8	0	0	0	109.6	M546 Y602 Y604	M546-L615 HydrophobicContact CG-CD2 4.28Å; M546-L615 HydrophobicContact SD-CD2 4.26Å; Y602-L615 HydrophobicContact CD1-CD1 3.86Å; Y602-L615 HydrophobicContact CD1-CD2 4.34Å; Y602-L615 HydrophobicContact CG-CD1 4.47Å; Y604-L615 HydrophobicContact CD1-CB 3.96Å; Y604-L615 HydrophobicContact CE1-CB 3.67Å; Y604-L615 HydrophobicContact CE1-CD1 4.11Å; Y604-L615 HydrophobicContact CE1-CG 4.42Å; Y604-L615 HydrophobicContact CE2-CD1 4.22Å
616	V	86.7	Confident	74.5	Confident	31 Å²	31	67.5 Å²	67.5	19%	0.188	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	-32.1	-178.1	-69.8	0	0	0	0	113.5	I603 H605 K614	I603-V616 HydrophobicContact CB-CG2 4.26Å; I603-V616 HydrophobicContact CG2-CG2 3.93Å; I603-V616 VanDerWaalsContact O-CG2 3.29Å; I603-V616 WeakPolarHBondContact O-CG2 3.44Å; I603-V616 PolarHBondContact O-N 2.73Å; H605-V616 HydrophobicContact CB-CG1 4.1Å; K614-V616 PolarHBondContact O-N 2.77Å
617	Q	87.9	Confident	74	Confident	2 Å²	2	74.6 Å²	74.6	1%	0.009	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	143.4	-175.2	176.5	167.2	0.5	0	0	110.7	L23 F25 V27 I603 I619	L23-Q617 WeakPolarHBondContact O-CG 3.4Å; F25-Q617 VanDerWaalsContact N-OE1 3.1Å; V27-Q617 PolarHBondContact O-NE2 2.87Å; I603-Q617 HydrophobicContact CB-CB 4.18Å; I603-Q617 HydrophobicContact CD1-CB 4.26Å; I603-Q617 HydrophobicContact CD1-CG 4.2Å; I603-Q617 PolarHBondContact N-O 2.77Å; I603-Q617 PolarHBondContact O-N 2.97Å; Q617-I619 HydrophobicContact CG-CD1 4.5Å; Q617-I619 HydrophobicContact CG-CG1 3.95Å
618	H	89.3	Confident	74.1	Confident	41 Å²	41	72.7 Å²	72.7	19%	0.19	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	120.8	174.9	167.3	-112.6	0	0	0	108.2	M546 E594 A600 Y602 P620	M546-H618 HydrophobicContact SD-CB 4.4Å; E594-H618 IonicContact OE1-NE2 2.63Å; E594-H618 IonicContact OE2-NE2 3.63Å; A600-H618 WeakPolarHBondContact CB-NE2 3.5Å; Y602-H618 AromaticContact CD1-CD2 3.98Å; Y602-H618 AromaticContact CE1-CD2 3.64Å; Y602-H618 AromaticContact CE2-CD2 3.99Å; Y602-H618 AromaticContact CZ-CD2 3.65Å; Y602-H618 AromaticContact CZ-NE2 3.99Å; H618-P620 WeakPolarHBondContact O-CD 3.17Å
619	I	87.9	Confident	75	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.005	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	98	-177.4	-54.8	-179.1	0	0	0	108.1	V27 Q29 A600 V601 I603 Q617 F631 F660	V27-I619 HydrophobicContact CB-CD1 4.22Å; V27-I619 HydrophobicContact CG1-CD1 3.8Å; Q29-I619 HydrophobicContact CG-CG2 4.43Å; A600-I619 WeakPolarHBondContact CA-O 3.41Å; V601-I619 PolarHBondContact N-O 3.21Å; V601-I619 PolarHBondContact O-N 3.26Å; I603-I619 HydrophobicContact CD1-CD1 3.82Å; I603-I619 HydrophobicContact CD1-CG1 4.46Å; Q617-I619 HydrophobicContact CG-CD1 4.5Å; Q617-I619 HydrophobicContact CG-CG1 3.95Å; I619-F631 HydrophobicContact CG2-CE1 4.29Å; I619-F660 HydrophobicContact CG2-CE1 4.21Å; I619-F660 HydrophobicContact CG2-CZ 4.22Å
620	P	85	Confident	76.5	Confident	34 Å²	34	68.1 Å²	68.1	22%	0.221	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	151.6	169.6	31	-34.4	0	0	0	110.1	H618 G622	H618-P620 WeakPolarHBondContact O-CD 3.17Å; P620-G622 PolarHBondContact O-N 3.25Å
621	A	80.4	Confident	78.2	Confident	21 Å²	21	61.4 Å²	61.4	17%	0.174	32%	0.324	C	S	.	.			trans	-59.1	128.3	172.9	0	0	0	0	0	111.4	R598 G599 G623 F631	R598-A621 HydrophobicContact CB-CB 4.08Å; R598-A621 WeakPolarHBondContact O-CB 3.4Å; G599-A621 VanDerWaalsContact O-CB 3.22Å; G599-A621 WeakPolarHBondContact O-CB 3.48Å; G599-A621 PolarHBondContact O-N 2.74Å; A621-G623 VanDerWaalsContact C-N 3.33Å; A621-F631 HydrophobicContact CB-CB 3.68Å; A621-F631 HydrophobicContact CB-CD1 4Å; A621-F631 HydrophobicContact CB-CG 3.9Å
622	G	61.4	Low	79.8	Confident	85 Å²	85	52.2 Å²	52.2	88%	0.876	29%	0.29	S	S	*	.			trans	-85.1	3.9	178.9	0	0	0	0	0	115.4	P620	P620-G622 PolarHBondContact O-N 3.25Å
623	G	60.8	Low	80.8	Confident	40 Å²	40	51.2 Å²	51.2	41%	0.412	29%	0.287	S	S	.	.	S	Bend	trans	-87.3	169.1	-175.3	0	0	0	0	0	114.8	A621 G625	A621-G623 VanDerWaalsContact C-N 3.33Å; G623-G625 PolarHBondContact O-N 3.1Å
624	D	59.2	Low	81.4	Confident	86 Å²	86	51.4 Å²	51.4	46%	0.46	29%	0.289	S	S	.	.			trans	-67.1	-10.8	175	54.4	14	0	0	0	113.9	E626 K627	D624-E626 PolarHBondContact O-N 3.03Å; D624-E626 PolarHBondContact OD1-N 2.89Å; D624-K627 PolarHBondContact OD1-N 3.46Å
625	G	62.4	Low	81.9	Confident	16 Å²	16	46.5 Å²	46.5	17%	0.165	27%	0.268	C	S	.	.	S	Bend	trans	74.7	0.5	-172.5	0	0	0	0	0	113.8	G623 K629	G623-G625 PolarHBondContact O-N 3.1Å; G625-K629 WeakPolarHBondContact O-CE 3.31Å; G625-K629 WeakPolarHBondContact O-CG 3.39Å
626	E	67.8	Low	82.2	Confident	156 Å²	156	44.4 Å²	44.4	73%	0.729	26%	0.257	S	S	*	.	S	Bend	trans	-98.7	-43.2	177.6	-64	-166.4	160.4	0	0	111.3	D624	D624-E626 PolarHBondContact O-N 3.03Å; D624-E626 PolarHBondContact OD1-N 2.89Å
627	K	75	Confident	82.4	Confident	152 Å²	152	43 Å²	43	66%	0.661	25%	0.248	S	C	*	.	S	Bend	trans	-89.1	-32.2	-177.1	-65.5	178.5	-173.5	172.9	0	113.9	D624	D624-K627 PolarHBondContact OD1-N 3.46Å
628	V	81.6	Confident	82.3	Confident	41 Å²	41	47.6 Å²	47.6	25%	0.248	27%	0.272	C	S	.	.			trans	-128.8	125.6	178.3	-177.4	0	0	0	0	108.7	L654	V628-L654 VanDerWaalsContact CA-O 3.29Å; V628-L654 WeakPolarHBondContact CA-O 3.22Å
629	K	87.6	Confident	82.3	Confident	86 Å²	86	47.4 Å²	47.4	37%	0.374	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	159.4	176.3	-66.6	-171.7	174.9	-174.2	0	110.1	L39 G625 F631 G653 L654	L39-K629 HydrophobicContact CD1-CG 4.43Å; G625-K629 WeakPolarHBondContact O-CE 3.31Å; G625-K629 WeakPolarHBondContact O-CG 3.39Å; K629-F631 VanDerWaalsContact C-N 3.29Å; K629-F631 PolarHBondContact O-N 3.01Å; K629-G653 CarbonylContact O-C 3.54Å; K629-G653 WeakPolarHBondContact O-CA 3.19Å; K629-L654 PolarHBondContact N-O 2.88Å; K629-L654 PolarHBondContact O-N 3.02Å
630	F	89.9	Confident	82.3	Confident	47 Å²	47	48.8 Å²	48.8	21%	0.206	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	57	40.2	176.1	-49.9	-37.6	0	0	0	113.9	P592 F593 H597 G632 Q633 G653 L654	P592-F630 HydrophobicContact CB-CB 3.77Å; P592-F630 WeakPolarHBondContact O-CA 3.43Å; F593-F630 HydrophobicContact CD1-CD1 4.36Å; F593-F630 AromaticContact CD1-CE1 3.89Å; F593-F630 HydrophobicContact CD1-CE1 3.89Å; F593-F630 HydrophobicContact CD2-CD1 4.38Å; F593-F630 HydrophobicContact CE1-CD1 4.08Å; F593-F630 AromaticContact CE1-CE1 3.43Å; F593-F630 HydrophobicContact CE1-CE1 3.43Å; F593-F630 VanDerWaalsContact CE1-CE1 3.43Å; F593-F630 AromaticContact CE1-CZ 3.9Å; F593-F630 HydrophobicContact CE1-CZ 3.9Å; F593-F630 HydrophobicContact CE2-CD1 4.12Å; F593-F630 HydrophobicContact CE2-CE1 4.27Å; F593-F630 HydrophobicContact CG-CD1 4.47Å; F593-F630 HydrophobicContact CG-CE1 4.45Å; F593-F630 AromaticContact CZ-CD1 3.93Å; F593-F630 HydrophobicContact CZ-CD1 3.93Å; F593-F630 AromaticContact CZ-CE1 3.63Å; F593-F630 HydrophobicContact CZ-CE1 3.63Å; F593-F630 HydrophobicContact CZ-CE2 4.49Å; F593-F630 HydrophobicContact CZ-CG 4.48Å; F593-F630 AromaticContact CZ-CZ 3.97Å; F593-F630 HydrophobicContact CZ-CZ 3.97Å; H597-F630 HydrophobicContact CB-CD1 4.07Å; H597-F630 HydrophobicContact CB-CE1 3.65Å; H597-F630 AromaticContact CG-CE1 3.87Å; H597-F630 PolarHBondContact O-N 3.11Å; F630-G632 PolarHBondContact O-N 3.02Å; F630-Q633 HydrophobicContact CB-CB 4.4Å; F630-Q633 WeakPolarHBondContact O-CB 3.34Å; F630-Q633 WeakPolarHBondContact O-CG 3.07Å; F630-Q633 PolarHBondContact O-N 2.94Å; F630-Q633 VanDerWaalsContact O-N 3.1Å; F630-G653 WeakPolarHBondContact O-CA 3.26Å; F630-L654 HydrophobicContact CD2-CD1 3.35Å; F630-L654 HydrophobicContact CD2-CG 3.79Å; F630-L654 HydrophobicContact CE2-CD1 3.61Å
631	F	91.9	Very high	82.5	Confident	10 Å²	10	47.6 Å²	47.6	4%	0.044	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	127.6	174.4	-179.3	-99.6	0	0	0	110.7	P592 R598 G599 A600 V601 I619 A621 K629 I651 F660	P592-F631 WeakPolarHBondContact CA-O 3.35Å; R598-F631 WeakPolarHBondContact O-CB 3.46Å; R598-F631 PolarHBondContact O-N 3.27Å; G599-F631 CarbonylContact C-O 3.56Å; G599-F631 VanDerWaalsContact CA-O 3.29Å; G599-F631 WeakPolarHBondContact CA-O 3.48Å; A600-F631 PolarHBondContact N-O 2.98Å; V601-F631 HydrophobicContact CB-CE1 4.48Å; V601-F631 HydrophobicContact CG2-CD1 4.25Å; V601-F631 HydrophobicContact CG2-CE1 3.96Å; I619-F631 HydrophobicContact CG2-CE1 4.29Å; A621-F631 HydrophobicContact CB-CB 3.68Å; A621-F631 HydrophobicContact CB-CD1 4Å; A621-F631 HydrophobicContact CB-CG 3.9Å; K629-F631 VanDerWaalsContact C-N 3.29Å; K629-F631 PolarHBondContact O-N 3.01Å; F631-I651 HydrophobicContact CD1-CG2 4.14Å; F631-I651 HydrophobicContact CD2-CG2 3.83Å; F631-I651 HydrophobicContact CE1-CB 4.48Å; F631-I651 HydrophobicContact CE1-CD1 4.05Å; F631-I651 HydrophobicContact CE1-CG2 3.81Å; F631-I651 HydrophobicContact CE2-CB 3.77Å; F631-I651 HydrophobicContact CE2-CG2 3.46Å; F631-I651 VanDerWaalsContact CE2-CG2 3.46Å; F631-I651 HydrophobicContact CG-CG2 4.16Å; F631-I651 HydrophobicContact CZ-CB 3.73Å; F631-I651 HydrophobicContact CZ-CD1 3.65Å; F631-I651 HydrophobicContact CZ-CG1 4.27Å; F631-I651 HydrophobicContact CZ-CG2 3.45Å; F631-I651 VanDerWaalsContact CZ-CG2 3.45Å; F631-F660 HydrophobicContact CE2-CE2 4.08Å; F631-F660 HydrophobicContact CE2-CZ 4.25Å; F631-F660 AromaticContact CZ-CE2 3.63Å; F631-F660 HydrophobicContact CZ-CE2 3.63Å; F631-F660 AromaticContact CZ-CZ 3.72Å; F631-F660 HydrophobicContact CZ-CZ 3.72Å
632	G	92.4	Very high	82.7	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	94.4	11.4	-172.7	0	0	0	0	0	113.9	G590 F630 S634 G652	G590-G632 WeakPolarHBondContact CA-O 2.99Å; F630-G632 PolarHBondContact O-N 3.02Å; G632-S634 VanDerWaalsContact C-N 3.3Å; G632-G652 PolarHBondContact N-O 2.74Å
633	Q	93.8	Very high	83.6	Confident	30 Å²	30	47.2 Å²	47.2	14%	0.14	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	-24.2	172.3	71.2	-177.2	-4.7	0	0	113.4	G44 P592 F630 G652 G653 L654	G44-Q633 VanDerWaalsContact C-NE2 3.28Å; G44-Q633 PolarHBondContact O-NE2 2.91Å; P592-Q633 HydrophobicContact CB-CB 4.17Å; P592-Q633 HydrophobicContact CG-CB 4.36Å; F630-Q633 HydrophobicContact CB-CB 4.4Å; F630-Q633 WeakPolarHBondContact O-CB 3.34Å; F630-Q633 WeakPolarHBondContact O-CG 3.07Å; F630-Q633 PolarHBondContact O-N 2.94Å; F630-Q633 VanDerWaalsContact O-N 3.1Å; Q633-G652 PolarHBondContact N-O 3.11Å; Q633-G653 PolarHBondContact NE2-O 2.85Å; Q633-L654 VanDerWaalsContact NE2-N 3.12Å
634	S	95.1	Very high	84.5	Confident	12 Å²	12	47.4 Å²	47.4	8%	0.084	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	142.8	173.9	55.8	0	0	0	0	109.9	G44 Y45 G632 G652	G44-S634 PolarHBondContact O-OG 2.64Å; Y45-S634 WeakPolarHBondContact O-CB 3.05Å; Y45-S634 PolarHBondContact O-OG 2.95Å; G632-S634 VanDerWaalsContact C-N 3.3Å; S634-G652 PolarHBondContact O-N 2.86Å
635	I	95.4	Very high	85.4	Confident	20 Å²	20	45.5 Å²	45.5	10%	0.103	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	136.9	-170.8	-54.2	174	0	0	0	108.1	A572 A574 V588 V601 V649 T650	A572-I635 HydrophobicContact CB-CD1 4.08Å; A572-I635 HydrophobicContact CB-CG1 4.11Å; A574-I635 HydrophobicContact CB-CB 3.97Å; A574-I635 HydrophobicContact CB-CG2 3.71Å; V588-I635 HydrophobicContact CB-CG2 4.13Å; V588-I635 HydrophobicContact CG1-CD1 4.06Å; V588-I635 HydrophobicContact CG1-CG2 3.86Å; V601-I635 HydrophobicContact CG1-CD1 4.04Å; V601-I635 HydrophobicContact CG2-CD1 4.02Å; I635-V649 HydrophobicContact CG2-CG1 4.18Å; I635-T650 WeakPolarHBondContact CA-O 3.47Å
636	H	94.3	Very high	86.6	Confident	22 Å²	22	45 Å²	45	10%	0.102	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	134.8	173.4	-167.2	-88.8	0	0	0	110.7	V47 Q48 Q49 I638 T650	V47-H636 HydrophobicContact CG2-CB 4.3Å; Q48-H636 PolarHBondContact NE2-CD2 3.42Å; Q48-H636 PolarHBondContact NE2-CE1 2.97Å; Q48-H636 PolarHBondContact NE2-NE2 2.8Å; Q48-H636 PolarHBondContact OE1-CD2 2.69Å; Q48-H636 VanDerWaalsContact OE1-CD2 3.29Å; Q49-H636 WeakPolarHBondContact CB-ND1 3.43Å; Q49-H636 WeakPolarHBondContact CG-ND1 3.42Å; Q49-H636 PolarHBondContact N-ND1 2.85Å; Q49-H636 PolarHBondContact OE1-ND1 2.81Å; H636-I638 WeakPolarHBondContact NE2-CD1 3.27Å; H636-T650 PolarHBondContact N-O 2.79Å; H636-T650 WeakPolarHBondContact O-CB 3.49Å; H636-T650 PolarHBondContact O-N 2.97Å
637	G	90.9	Very high	87.6	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.01	21%	0.209	C	C	.	.			trans	-160.1	81.8	-178.9	0	0	0	0	0	112.3	V576 D648	V576-G637 VanDerWaalsContact CA-O 3.25Å; V576-G637 WeakPolarHBondContact CA-O 3.06Å; V576-G637 VanDerWaalsContact CG1-O 3.29Å; V576-G637 WeakPolarHBondContact CG1-O 3.45Å; G637-D648 VanDerWaalsContact CA-O 3.28Å; G637-D648 WeakPolarHBondContact CA-O 3.35Å
638	I	87.1	Confident	88.4	Confident	99 Å²	99	31.2 Å²	31.2	51%	0.508	18%	0.177	S	C	.	.			trans	-122.6	-17.3	-179.2	-59.3	178.5	0	0	0	110.9	H636	H636-I638 WeakPolarHBondContact NE2-CD1 3.27Å
639	M	87.5	Confident	89	Confident	36 Å²	36	29.3 Å²	29.3	18%	0.177	17%	0.166	C	C	.	.	S	Bend	trans	-126.4	142	-169.4	-175.6	170.8	61	0	0	111.3	Q49 E51 L641 D648	Q49-M639 HydrophobicContact CB-CE 4Å; E51-M639 HydrophobicContact CB-CE 3.87Å; E51-M639 HydrophobicContact CB-SD 3.46Å; E51-M639 WeakPolarHBondContact CB-SD 3.44Å; E51-M639 HydrophobicContact CG-SD 4.46Å; M639-L641 HydrophobicContact CE-CD2 3.38Å; M639-L641 HydrophobicContact CE-CG 4.27Å; M639-D648 PolarHBondContact O-N 3.35Å; M639-D648 VanDerWaalsContact O-N 3.1Å
640	D	89.4	Confident	89.3	Confident	31 Å²	31	25.2 Å²	25.2	17%	0.166	15%	0.148	C	C	.	.			trans	-72.4	117.3	164.3	170.3	2.8	0	0	0	109	K56 N642 G643 D644 G645 I646	K56-D640 PolarHBondContact NZ-O 3.38Å; D640-N642 PolarHBondContact OD1-N 3.03Å; D640-N642 PolarHBondContact OD1-OD1 2.76Å; D640-G643 VanDerWaalsContact OD1-CA 3.23Å; D640-G643 WeakPolarHBondContact OD1-CA 3.47Å; D640-G643 PolarHBondContact OD1-N 2.84Å; D640-G643 WeakPolarHBondContact OD2-CA 3.42Å; D640-D644 PolarHBondContact OD1-N 3.33Å; D640-D644 PolarHBondContact OD2-N 2.63Å; D640-D644 VanDerWaalsContact OD2-N 3.08Å; D640-G645 WeakPolarHBondContact OD2-CA 3.31Å; D640-G645 PolarHBondContact OD2-N 2.68Å; D640-I646 WeakPolarHBondContact CA-O 3.35Å; D640-I646 WeakPolarHBondContact CB-O 3.12Å
641	L	87.6	Confident	89.5	Confident	8 Å²	8	23 Å²	23	4%	0.042	14%	0.139	C	C	.	.	S	Bend	trans	-99.5	-24.4	-177.4	-74.4	171.3	0	0	0	113.7	Q49 K56 V58 V80 M639 D648 L659 W661	Q49-L641 HydrophobicContact CG-CD1 3.92Å; K56-L641 HydrophobicContact CB-CD2 3.75Å; K56-L641 HydrophobicContact CD-CD2 4.15Å; K56-L641 VanDerWaalsContact CD-O 3.31Å; K56-L641 WeakPolarHBondContact CD-O 3.12Å; K56-L641 HydrophobicContact CG-CD2 4.44Å; V58-L641 HydrophobicContact CG2-CD1 4.2Å; V80-L641 HydrophobicContact CG1-CB 4.24Å; V80-L641 HydrophobicContact CG2-CD2 4.42Å; M639-L641 HydrophobicContact CE-CD2 3.38Å; M639-L641 HydrophobicContact CE-CG 4.27Å; L641-D648 WeakPolarHBondContact CA-OD2 3.22Å; L641-D648 HydrophobicContact CB-CB 4.39Å; L641-D648 WeakPolarHBondContact CB-OD2 3.48Å; L641-D648 PolarHBondContact N-OD2 3.46Å; L641-L659 HydrophobicContact CB-CD2 4.38Å; L641-L659 HydrophobicContact CD1-CD1 3.47Å; L641-L659 VanDerWaalsContact CD1-CD1 3.47Å; L641-L659 HydrophobicContact CD1-CD2 3.73Å; L641-L659 HydrophobicContact CD1-CG 4.27Å; L641-W661 HydrophobicContact CB-CZ3 3.95Å
642	N	85.3	Confident	89.6	Confident	69 Å²	69	22.6 Å²	22.6	37%	0.369	14%	0.137	S	C	.	.	S	Bend	trans	-93	-9	176.6	65.4	15.2	0	0	0	113.2	D640 D644 D648 W661	D640-N642 PolarHBondContact OD1-N 3.03Å; D640-N642 PolarHBondContact OD1-OD1 2.76Å; N642-D644 PolarHBondContact ND2-OD2 3.36Å; N642-D644 VanDerWaalsContact OD1-CB 3.25Å; N642-D644 WeakPolarHBondContact OD1-CB 3.21Å; N642-D644 PolarHBondContact OD1-N 3.26Å; N642-D644 PolarHBondContact OD1-OD1 2.95Å; N642-D644 PolarHBondContact OD1-OD2 3.43Å; N642-D648 PolarHBondContact N-OD2 3.05Å; N642-W661 HydrophobicContact CB-CD2 4.49Å; N642-W661 HydrophobicContact CB-CE3 3.71Å; N642-W661 HydrophobicContact CB-CH2 4.21Å; N642-W661 HydrophobicContact CB-CZ3 3.56Å
643	G	81.2	Confident	89.6	Confident	29 Å²	29	22.6 Å²	22.6	30%	0.299	14%	0.137	S	C	.	.	S	Bend	trans	78.2	18.6	-178.2	0	0	0	0	0	114.1	D640 K712	D640-G643 VanDerWaalsContact OD1-CA 3.23Å; D640-G643 WeakPolarHBondContact OD1-CA 3.47Å; D640-G643 PolarHBondContact OD1-N 2.84Å; D640-G643 WeakPolarHBondContact OD2-CA 3.42Å; G643-K712 PolarHBondContact O-NZ 3.44Å
644	D	78	Confident	89.4	Confident	44 Å²	44	22 Å²	22	24%	0.235	14%	0.135	C	C	.	.	S	Bend	trans	-81.4	-8.9	-177.7	71.1	13.1	0	0	0	114.9	D640 N642 I646 K712	D640-D644 PolarHBondContact OD1-N 3.33Å; D640-D644 PolarHBondContact OD2-N 2.63Å; D640-D644 VanDerWaalsContact OD2-N 3.08Å; N642-D644 PolarHBondContact ND2-OD2 3.36Å; N642-D644 VanDerWaalsContact OD1-CB 3.25Å; N642-D644 WeakPolarHBondContact OD1-CB 3.21Å; N642-D644 PolarHBondContact OD1-N 3.26Å; N642-D644 PolarHBondContact OD1-OD1 2.95Å; N642-D644 PolarHBondContact OD1-OD2 3.43Å; D644-I646 WeakPolarHBondContact OD1-CB 3.27Å; D644-I646 PolarHBondContact OD1-N 2.99Å; D644-K712 WeakPolarHBondContact O-CD 3.47Å
645	G	80	Confident	89	Confident	47 Å²	47	21.5 Å²	21.5	49%	0.485	13%	0.132	S	C	.	.	S	Bend	trans	96.1	3.8	-179.1	0	0	0	0	0	114.4	D640	D640-G645 WeakPolarHBondContact OD2-CA 3.31Å; D640-G645 PolarHBondContact OD2-N 2.68Å
646	I	86.2	Confident	88.7	Confident	4 Å²	4	20.7 Å²	20.7	2%	0.021	13%	0.128	C	C	.	.	S	Bend	trans	-119.2	143.3	178.5	-48.5	176.9	0	0	0	108.8	L581 D640 D644 S662 D664	L581-I646 HydrophobicContact CD1-CD1 4.37Å; L581-I646 HydrophobicContact CD1-CG1 4.17Å; D640-I646 WeakPolarHBondContact CA-O 3.35Å; D640-I646 WeakPolarHBondContact CB-O 3.12Å; D644-I646 WeakPolarHBondContact OD1-CB 3.27Å; D644-I646 PolarHBondContact OD1-N 2.99Å; I646-S662 VanDerWaalsContact CG2-CB 3.41Å; I646-D664 HydrophobicContact CD1-CB 3.76Å
647	V	89.9	Confident	88.6	Confident	19 Å²	19	19.7 Å²	19.7	12%	0.115	12%	0.124	C	C	.	.			trans	-73.1	140.5	179.6	-62.2	0	0	0	0	111.7	V576 S577 L579 S662	V576-V647 HydrophobicContact CG1-CG2 3.85Å; S577-V647 VanDerWaalsContact O-CG2 3.27Å; S577-V647 WeakPolarHBondContact O-CG2 3.2Å; L579-V647 HydrophobicContact CD2-CG2 3.69Å; L579-V647 WeakPolarHBondContact CD2-O 3.41Å; L579-V647 HydrophobicContact CG-CG2 4.35Å; V647-S662 WeakPolarHBondContact O-CB 3.38Å; V647-S662 PolarHBondContact O-OG 3.46Å
648	D	91.5	Very high	88.6	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	13%	0.132	C	C	.	.			trans	-100.5	154.6	179.7	-65.1	-49.3	0	0	0	111.3	Q49 G637 M639 L641 N642 L659 W661 S662	Q49-D648 PolarHBondContact NE2-O 2.77Å; G637-D648 VanDerWaalsContact CA-O 3.28Å; G637-D648 WeakPolarHBondContact CA-O 3.35Å; M639-D648 PolarHBondContact O-N 3.35Å; M639-D648 VanDerWaalsContact O-N 3.1Å; L641-D648 WeakPolarHBondContact CA-OD2 3.22Å; L641-D648 HydrophobicContact CB-CB 4.39Å; L641-D648 WeakPolarHBondContact CB-OD2 3.48Å; L641-D648 PolarHBondContact N-OD2 3.46Å; N642-D648 PolarHBondContact N-OD2 3.05Å; D648-L659 HydrophobicContact CB-CD1 3.88Å; D648-W661 HydrophobicContact CB-CE3 4.44Å; D648-W661 WeakPolarHBondContact OD1-CA 3.24Å; D648-W661 WeakPolarHBondContact OD2-CZ3 3.4Å; D648-S662 PolarHBondContact OD1-N 2.84Å; D648-S662 VanDerWaalsContact OD1-N 3.12Å
649	V	93.8	Very high	88.8	Confident	2 Å²	2	16.1 Å²	16.1	1%	0.012	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	122.9	-177.2	-173.7	0	0	0	0	110.6	V576 L579 I635 I651 F660	V576-V649 HydrophobicContact CG1-CG2 4.19Å; L579-V649 HydrophobicContact CD1-CG2 4.48Å; L579-V649 HydrophobicContact CD2-CG2 3.9Å; I635-V649 HydrophobicContact CG2-CG1 4.18Å; V649-I651 HydrophobicContact CG1-CD1 4.37Å; V649-I651 HydrophobicContact CG1-CG1 4.05Å; V649-F660 PolarHBondContact N-O 3.33Å; V649-F660 VanDerWaalsContact N-O 3.12Å; V649-F660 PolarHBondContact O-N 2.74Å
650	T	93.8	Very high	88.9	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	129.5	174.2	-48.1	0	0	0	0	110	V47 Q49 V58 I635 H636 L659	V47-T650 HydrophobicContact CB-CG2 4.04Å; V47-T650 HydrophobicContact CG1-CG2 4.4Å; V47-T650 HydrophobicContact CG2-CG2 4.17Å; Q49-T650 WeakPolarHBondContact CG-OG1 3.1Å; Q49-T650 PolarHBondContact NE2-OG1 2.77Å; V58-T650 HydrophobicContact CG1-CG2 3.72Å; V58-T650 HydrophobicContact CG2-CG2 4.45Å; I635-T650 WeakPolarHBondContact CA-O 3.47Å; H636-T650 PolarHBondContact N-O 2.79Å; H636-T650 WeakPolarHBondContact O-CB 3.49Å; H636-T650 PolarHBondContact O-N 2.97Å; T650-L659 WeakPolarHBondContact OG1-CD1 3.42Å
651	I	94.4	Very high	88.9	Confident	1 Å²	1	15.9 Å²	15.9	1%	0.005	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	123.9	-178.3	-57	170.1	0	0	0	109.3	V601 F631 V649 A657 S658 F660	V601-I651 HydrophobicContact CB-CD1 4Å; V601-I651 HydrophobicContact CG1-CD1 4.04Å; V601-I651 HydrophobicContact CG2-CD1 3.82Å; V601-I651 HydrophobicContact CG2-CG1 4.31Å; V601-I651 HydrophobicContact CG2-CG2 3.75Å; F631-I651 HydrophobicContact CD1-CG2 4.14Å; F631-I651 HydrophobicContact CD2-CG2 3.83Å; F631-I651 HydrophobicContact CE1-CB 4.48Å; F631-I651 HydrophobicContact CE1-CD1 4.05Å; F631-I651 HydrophobicContact CE1-CG2 3.81Å; F631-I651 HydrophobicContact CE2-CB 3.77Å; F631-I651 HydrophobicContact CE2-CG2 3.46Å; F631-I651 VanDerWaalsContact CE2-CG2 3.46Å; F631-I651 HydrophobicContact CG-CG2 4.16Å; F631-I651 HydrophobicContact CZ-CB 3.73Å; F631-I651 HydrophobicContact CZ-CD1 3.65Å; F631-I651 HydrophobicContact CZ-CG1 4.27Å; F631-I651 HydrophobicContact CZ-CG2 3.45Å; F631-I651 VanDerWaalsContact CZ-CG2 3.45Å; V649-I651 HydrophobicContact CG1-CD1 4.37Å; V649-I651 HydrophobicContact CG1-CG1 4.05Å; I651-A657 CarbonylContact O-C 3.6Å; I651-A657 WeakPolarHBondContact O-CA 3.48Å; I651-S658 PolarHBondContact N-O 2.92Å; I651-S658 PolarHBondContact O-N 2.75Å; I651-F660 HydrophobicContact CB-CE2 4.3Å; I651-F660 HydrophobicContact CD1-CD2 3.83Å; I651-F660 HydrophobicContact CD1-CE2 3.7Å; I651-F660 HydrophobicContact CG1-CD2 4.29Å; I651-F660 HydrophobicContact CG1-CE2 4.26Å
652	G	93.4	Very high	89	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	151.3	175	0	0	0	0	0	113.3	G632 Q633 S634	G632-G652 PolarHBondContact N-O 2.74Å; Q633-G652 PolarHBondContact N-O 3.11Å; S634-G652 PolarHBondContact O-N 2.86Å
653	G	92.1	Very high	89	Confident	0 Å²	0	14 Å²	14	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	167.3	168.4	0	0	0	0	0	109.4	G44 K629 F630 Q633 G655 G656	G44-G653 CarbonylContact C-O 2.99Å; G44-G653 VanDerWaalsContact CA-O 3.29Å; G44-G653 WeakPolarHBondContact CA-O 3.09Å; K629-G653 CarbonylContact O-C 3.54Å; K629-G653 WeakPolarHBondContact O-CA 3.19Å; F630-G653 WeakPolarHBondContact O-CA 3.26Å; Q633-G653 PolarHBondContact NE2-O 2.85Å; G653-G655 PolarHBondContact O-N 3.2Å; G653-G656 CarbonylContact C-O 3.57Å; G653-G656 PolarHBondContact N-O 2.95Å; G653-G656 PolarHBondContact O-N 2.74Å
654	L	90	Very high	89.1	Confident	18 Å²	18	14.2 Å²	14.2	9%	0.094	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	125.4	174	-63.3	-174.2	0	0	0	110.1	M42 V628 K629 F630 Q633	M42-L654 HydrophobicContact CB-CD2 3.79Å; M42-L654 HydrophobicContact CE-CD1 4.4Å; M42-L654 HydrophobicContact CE-CD2 3.65Å; M42-L654 HydrophobicContact CG-CD2 3.9Å; V628-L654 VanDerWaalsContact CA-O 3.29Å; V628-L654 WeakPolarHBondContact CA-O 3.22Å; K629-L654 PolarHBondContact N-O 2.88Å; K629-L654 PolarHBondContact O-N 3.02Å; F630-L654 HydrophobicContact CD2-CD1 3.35Å; F630-L654 HydrophobicContact CD2-CG 3.79Å; F630-L654 HydrophobicContact CE2-CD1 3.61Å; Q633-L654 VanDerWaalsContact NE2-N 3.12Å
655	G	87.9	Confident	89.5	Confident	2 Å²	2	12.1 Å²	12.1	2%	0.021	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.3	-4.9	-178.2	0	0	0	0	0	114.1	G37 F43 G653	G37-G655 PolarHBondContact N-O 3.35Å; G37-G655 VanDerWaalsContact O-O 3.12Å; F43-G655 PolarHBondContact O-N 2.75Å; G653-G655 PolarHBondContact O-N 3.2Å
656	G	89.3	Confident	89.7	Confident	3 Å²	3	9.9 Å²	9.9	3%	0.031	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.3	163.7	177.5	0	0	0	0	0	116	F35 F43 G653	F35-G656 CarbonylContact O-C 3.52Å; F35-G656 WeakPolarHBondContact O-CA 3.37Å; F43-G656 PolarHBondContact O-N 3.15Å; G653-G656 CarbonylContact C-O 3.57Å; G653-G656 PolarHBondContact N-O 2.95Å; G653-G656 PolarHBondContact O-N 2.74Å
657	A	91.3	Very high	89.8	Confident	1 Å²	1	12.9 Å²	12.9	1%	0.008	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	146.6	171.3	0	0	0	0	0	109.5	F35 V47 I60 I651	F35-A657 HydrophobicContact CD2-CB 4.46Å; F35-A657 PolarHBondContact N-O 3.2Å; F35-A657 PolarHBondContact O-N 3.2Å; V47-A657 HydrophobicContact CG1-CB 3.92Å; I60-A657 HydrophobicContact CD1-CB 3.59Å; I60-A657 HydrophobicContact CG1-CB 4.35Å; I651-A657 CarbonylContact O-C 3.6Å; I651-A657 WeakPolarHBondContact O-CA 3.48Å
658	S	90.8	Very high	89.8	Confident	25 Å²	25	12.3 Å²	12.3	18%	0.175	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	133.2	178	-61.8	0	0	0	0	110.5	L33 S34 I651	L33-S658 CarbonylContact O-C 3.39Å; L33-S658 WeakPolarHBondContact O-CA 3.48Å; S34-S658 PolarHBondContact OG-OG 2.73Å; I651-S658 PolarHBondContact N-O 2.92Å; I651-S658 PolarHBondContact O-N 2.75Å
659	L	90.9	Very high	89.8	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	123.5	173.1	172.8	62.7	0	0	0	108.5	G32 L33 F35 V80 L641 D648 T650 W661	G32-L659 CarbonylContact C-O 3.57Å; G32-L659 VanDerWaalsContact CA-O 3.25Å; G32-L659 WeakPolarHBondContact CA-O 3.25Å; L33-L659 HydrophobicContact CB-CB 4.26Å; L33-L659 PolarHBondContact N-O 2.82Å; L33-L659 PolarHBondContact O-N 2.79Å; F35-L659 HydrophobicContact CE2-CB 4.44Å; V80-L659 HydrophobicContact CG1-CD2 3.88Å; V80-L659 HydrophobicContact CG2-CD2 4.14Å; L641-L659 HydrophobicContact CB-CD2 4.38Å; L641-L659 HydrophobicContact CD1-CD1 3.47Å; L641-L659 VanDerWaalsContact CD1-CD1 3.47Å; L641-L659 HydrophobicContact CD1-CD2 3.73Å; L641-L659 HydrophobicContact CD1-CG 4.27Å; D648-L659 HydrophobicContact CB-CD1 3.88Å; T650-L659 WeakPolarHBondContact OG1-CD1 3.42Å; L659-W661 HydrophobicContact CD2-CE3 4.47Å; L659-W661 HydrophobicContact CD2-CH2 3.43Å; L659-W661 VanDerWaalsContact CD2-CH2 3.43Å; L659-W661 HydrophobicContact CD2-CZ2 4.01Å; L659-W661 HydrophobicContact CD2-CZ3 3.68Å; L659-W661 HydrophobicContact CG-CH2 4.2Å; L659-W661 HydrophobicContact CG-CZ3 4.17Å
660	F	90.7	Very high	89.7	Confident	16 Å²	16	16.1 Å²	16.1	7%	0.07	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	130.2	178.1	-63.3	-94.3	0	0	0	109.7	V27 D28 Q29 I619 F631 V649 I651	V27-F660 HydrophobicContact CG1-CB 3.39Å; V27-F660 HydrophobicContact CG1-CD1 4.42Å; V27-F660 HydrophobicContact CG1-CG 4.1Å; D28-F660 WeakPolarHBondContact O-CD1 3.29Å; Q29-F660 HydrophobicContact CG-CE1 4.36Å; I619-F660 HydrophobicContact CG2-CE1 4.21Å; I619-F660 HydrophobicContact CG2-CZ 4.22Å; F631-F660 HydrophobicContact CE2-CE2 4.08Å; F631-F660 HydrophobicContact CE2-CZ 4.25Å; F631-F660 AromaticContact CZ-CE2 3.63Å; F631-F660 HydrophobicContact CZ-CE2 3.63Å; F631-F660 AromaticContact CZ-CZ 3.72Å; F631-F660 HydrophobicContact CZ-CZ 3.72Å; V649-F660 PolarHBondContact N-O 3.33Å; V649-F660 VanDerWaalsContact N-O 3.12Å; V649-F660 PolarHBondContact O-N 2.74Å; I651-F660 HydrophobicContact CB-CE2 4.3Å; I651-F660 HydrophobicContact CD1-CD2 3.83Å; I651-F660 HydrophobicContact CD1-CE2 3.7Å; I651-F660 HydrophobicContact CG1-CD2 4.29Å; I651-F660 HydrophobicContact CG1-CE2 4.26Å
661	W	88.6	Confident	89.7	Confident	45 Å²	45	20.5 Å²	20.5	17%	0.17	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	135.4	176.7	-50	115.5	0	0	0	110.3	D28 N31 L33 V80 L641 N642 D648 L659	D28-W661 WeakPolarHBondContact CB-O 3.15Å; D28-W661 PolarHBondContact N-O 2.93Å; N31-W661 PolarHBondContact O-NE1 2.84Å; L33-W661 HydrophobicContact CB-CZ2 4.19Å; L33-W661 HydrophobicContact CD1-CZ2 4.36Å; V80-W661 HydrophobicContact CG1-CH2 3.61Å; V80-W661 HydrophobicContact CG1-CZ3 4.35Å; L641-W661 HydrophobicContact CB-CZ3 3.95Å; N642-W661 HydrophobicContact CB-CD2 4.49Å; N642-W661 HydrophobicContact CB-CE3 3.71Å; N642-W661 HydrophobicContact CB-CH2 4.21Å; N642-W661 HydrophobicContact CB-CZ3 3.56Å; D648-W661 HydrophobicContact CB-CE3 4.44Å; D648-W661 WeakPolarHBondContact OD1-CA 3.24Å; D648-W661 WeakPolarHBondContact OD2-CZ3 3.4Å; L659-W661 HydrophobicContact CD2-CE3 4.47Å; L659-W661 HydrophobicContact CD2-CH2 3.43Å; L659-W661 VanDerWaalsContact CD2-CH2 3.43Å; L659-W661 HydrophobicContact CD2-CZ2 4.01Å; L659-W661 HydrophobicContact CD2-CZ3 3.68Å; L659-W661 HydrophobicContact CG-CH2 4.2Å; L659-W661 HydrophobicContact CG-CZ3 4.17Å
662	S	89.1	Confident	89.6	Confident	1 Å²	1	20.5 Å²	20.5	1%	0.007	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	130.7	171.5	-64	0	0	0	0	110.2	L579 I646 V647 D648	L579-S662 VanDerWaalsContact CD2-OG 3.3Å; L579-S662 WeakPolarHBondContact CD2-OG 3.42Å; I646-S662 VanDerWaalsContact CG2-CB 3.41Å; V647-S662 WeakPolarHBondContact O-CB 3.38Å; V647-S662 PolarHBondContact O-OG 3.46Å; D648-S662 PolarHBondContact OD1-N 2.84Å; D648-S662 VanDerWaalsContact OD1-N 3.12Å
663	R	85.6	Confident	89.6	Confident	36 Å²	36	23.9 Å²	23.9	14%	0.136	13%	0.129	C	C	.	.	P	Polyproline II helix	trans	-90.9	142.7	176.4	-64.2	171.6	63.5	-175.4	-1.3	109.6	N26 D28 E790 G793 V795	N26-R663 WeakPolarHBondContact O-CB 3.05Å; N26-R663 PolarHBondContact O-N 2.98Å; D28-R663 HydrophobicContact CB-CG 3.98Å; R663-E790 PolarHBondContact NH1-O 3Å; R663-E790 PolarHBondContact NH2-O 3.14Å; R663-G793 VanDerWaalsContact CZ-O 3.29Å; R663-G793 PolarHBondContact NE-O 3.43Å; R663-G793 PolarHBondContact NH2-O 2.78Å; R663-V795 HydrophobicContact CB-CG2 4.11Å
664	D	83.7	Confident	89.4	Confident	34 Å²	34	25 Å²	25	18%	0.182	14%	0.135	C	C	.	.	P	Polyproline II helix	trans	-62.1	152.2	175.3	-161.7	-3.7	0	0	0	112.2	I646 V708 S710 P794 V795	I646-D664 HydrophobicContact CD1-CB 3.76Å; D664-V708 HydrophobicContact CB-CG1 4.42Å; D664-V708 WeakPolarHBondContact OD2-CG1 3.42Å; D664-S710 VanDerWaalsContact CG-CB 3.42Å; D664-S710 WeakPolarHBondContact OD1-CB 3.29Å; D664-S710 PolarHBondContact OD1-N 2.89Å; D664-S710 WeakPolarHBondContact OD2-CB 3.39Å; D664-P794 HydrophobicContact CB-CB 4.12Å; D664-P794 CarbonylContact O-C 3.59Å; D664-P794 WeakPolarHBondContact O-CA 3.12Å; D664-P794 WeakPolarHBondContact O-CB 3.25Å; D664-V795 PolarHBondContact O-N 3.22Å
665	V	85.9	Confident	89.3	Confident	1 Å²	1	30 Å²	30	1%	0.006	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	130.6	-175.7	-178.1	0	0	0	0	109.7	F25 N26 N580 K709 V795 D797	F25-V665 HydrophobicContact CE1-CG2 4.37Å; F25-V665 HydrophobicContact CZ-CG1 4.25Å; F25-V665 HydrophobicContact CZ-CG2 4.41Å; N26-V665 HydrophobicContact CB-CG2 4.15Å; N580-V665 HydrophobicContact CB-CG2 4.16Å; V665-K709 HydrophobicContact CB-CD 4.46Å; V665-K709 HydrophobicContact CG1-CD 4.49Å; V665-K709 PolarHBondContact O-N 3.22Å; V665-V795 CarbonylContact C-O 3.49Å; V665-V795 WeakPolarHBondContact CA-O 3.24Å; V665-D797 HydrophobicContact CG1-CB 3.87Å
666	A	85.7	Confident	88.9	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	132.9	-179.1	0	0	0	0	0	113	Y706 R707 V708 P794 V795 L796 D797	A666-Y706 HydrophobicContact CB-CD2 4.23Å; A666-Y706 HydrophobicContact CB-CE2 3.36Å; A666-R707 CarbonylContact C-O 3.59Å; A666-R707 WeakPolarHBondContact CA-O 3.24Å; A666-V708 HydrophobicContact CB-CG2 4.18Å; A666-P794 HydrophobicContact CB-CB 4Å; A666-P794 HydrophobicContact CB-CG 4.09Å; A666-V795 PolarHBondContact N-O 3.24Å; A666-L796 WeakPolarHBondContact O-CA 3.44Å; A666-D797 PolarHBondContact O-N 2.64Å
667	E	88.1	Confident	88.4	Confident	66 Å²	66	33.5 Å²	33.5	31%	0.308	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	118.1	173.7	-62.5	177	165.9	0	0	109.6	Y706 R707 K709 L800	E667-Y706 WeakPolarHBondContact O-CA 2.96Å; E667-R707 HydrophobicContact CB-CB 4.49Å; E667-R707 PolarHBondContact N-O 3.24Å; E667-R707 PolarHBondContact O-N 3.14Å; E667-K709 HydrophobicContact CG-CG 4.46Å; E667-K709 VanDerWaalsContact OE1-CE 3.24Å; E667-K709 WeakPolarHBondContact OE1-CE 3.47Å; E667-L800 HydrophobicContact CB-CD1 3.92Å; E667-L800 HydrophobicContact CG-CD1 4.27Å
668	L	89.2	Confident	87.8	Confident	7 Å²	7	37.8 Å²	37.8	4%	0.037	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	109.3	174.7	-179.4	55.1	0	0	0	109.5	F704 M720 F785 L796	L668-F704 HydrophobicContact CD1-CB 4.34Å; L668-F704 HydrophobicContact CD1-CD1 4.5Å; L668-M720 HydrophobicContact CD1-CE 3.76Å; L668-M720 HydrophobicContact CD1-SD 3.75Å; L668-M720 HydrophobicContact CD2-CE 3.82Å; L668-M720 HydrophobicContact CD2-SD 3.81Å; L668-M720 HydrophobicContact CG-CE 4.32Å; L668-M720 HydrophobicContact CG-SD 4.45Å; L668-F785 HydrophobicContact CD2-CD2 3.6Å; L668-F785 HydrophobicContact CD2-CE2 4.09Å; L668-F785 HydrophobicContact CG-CD2 3.86Å; L668-F785 HydrophobicContact CG-CE2 3.88Å; L668-L796 HydrophobicContact CB-CD2 3.81Å; L668-L796 HydrophobicContact CD2-CD1 4.14Å; L668-L796 HydrophobicContact CD2-CD2 4.07Å
669	T	91.1	Very high	87.2	Confident	61 Å²	61	36.7 Å²	36.7	37%	0.374	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	142.9	175.5	57.5	0	0	0	0	109.8	F704 Q705 L800	T669-F704 WeakPolarHBondContact O-CA 2.93Å; T669-Q705 PolarHBondContact N-O 2.81Å; T669-Q705 PolarHBondContact O-N 2.87Å; T669-L800 HydrophobicContact CG2-CD1 4.12Å; T669-L800 HydrophobicContact CG2-CD2 4.42Å
670	S	92.1	Very high	86.4	Confident	21 Å²	21	37.6 Å²	37.6	15%	0.147	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	154	176.7	77.3	0	0	0	0	112.4	C703 F785 I804	S670-C703 CarbonylContact C-O 3.55Å; S670-C703 WeakPolarHBondContact CA-O 3.45Å; S670-C703 WeakPolarHBondContact CB-O 3.22Å; S670-F785 WeakPolarHBondContact OG-CE1 3.34Å; S670-F785 WeakPolarHBondContact OG-CZ 3.44Å; S670-I804 WeakPolarHBondContact O-CD1 3.5Å; S670-I804 WeakPolarHBondContact OG-CD1 3.46Å
671	N	93.1	Very high	85.4	Confident	93 Å²	93	39.1 Å²	39.1	50%	0.497	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	137.2	174.3	-172.8	6.5	0	0	0	109.3	V702 C703	N671-V702 WeakPolarHBondContact O-CA 3.45Å; N671-C703 PolarHBondContact N-O 3.33Å; N671-C703 PolarHBondContact O-N 3.25Å
672	M	92.9	Very high	84.2	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	128.7	-179.2	177.7	166	68.1	0	0	110.1	L674 T700 T701 V702 V781 L783 K806	M672-L674 HydrophobicContact CG-CD2 4.45Å; M672-T700 HydrophobicContact CG-CG2 3.9Å; M672-T700 HydrophobicContact SD-CG2 3.96Å; M672-T701 CarbonylContact C-O 3.59Å; M672-T701 WeakPolarHBondContact CA-O 3.37Å; M672-V702 HydrophobicContact CG-CG2 4.2Å; M672-V702 HydrophobicContact SD-CG2 4.44Å; M672-V781 HydrophobicContact CE-CB 4.18Å; M672-V781 HydrophobicContact CE-CG1 3.99Å; M672-V781 WeakPolarHBondContact CE-O 3.15Å; M672-V781 HydrophobicContact SD-CG1 3.8Å; M672-L783 HydrophobicContact CB-CD2 4.47Å; M672-L783 HydrophobicContact CE-CB 4.31Å; M672-L783 HydrophobicContact SD-CB 3.97Å; M672-K806 HydrophobicContact CE-CB 3.75Å; M672-K806 HydrophobicContact CE-CD 4.42Å; M672-K806 HydrophobicContact CE-CG 3.85Å; M672-K806 VanDerWaalsContact O-CD 3.23Å; M672-K806 WeakPolarHBondContact O-CD 3.42Å; M672-K806 WeakPolarHBondContact O-CE 3.45Å; M672-K806 PolarHBondContact O-NZ 3.46Å
673	T	92.4	Very high	82.9	Confident	71 Å²	71	46.6 Å²	46.6	44%	0.436	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	140.9	174.6	58.6	0	0	0	0	110.5	T700 T701	T673-T700 CarbonylContact O-C 3.54Å; T673-T700 WeakPolarHBondContact O-CA 3.38Å; T673-T701 PolarHBondContact N-O 3.35Å; T673-T701 PolarHBondContact O-N 3.28Å; T673-T701 WeakPolarHBondContact OG1-CB 3.29Å; T673-T701 PolarHBondContact OG1-O 3.36Å
674	L	89.6	Confident	81.6	Confident	25 Å²	25	45.7 Å²	45.7	13%	0.131	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	125.7	-174.7	-60.1	169.5	0	0	0	108.7	M672 P676 A677 T700 V781 K806 I808	M672-L674 HydrophobicContact CG-CD2 4.45Å; L674-P676 CarbonylContact O-C 3.6Å; L674-A677 PolarHBondContact O-N 3.17Å; L674-T700 HydrophobicContact CD2-CG2 3.67Å; L674-T700 VanDerWaalsContact CD2-OG1 3.31Å; L674-T700 WeakPolarHBondContact CD2-OG1 3.36Å; L674-V781 HydrophobicContact CD1-CB 4.35Å; L674-V781 HydrophobicContact CD1-CG2 4.18Å; L674-V781 HydrophobicContact CD2-CB 4.47Å; L674-V781 HydrophobicContact CD2-CG1 4.28Å; L674-V781 HydrophobicContact CD2-CG2 4.28Å; L674-K806 HydrophobicContact CD1-CB 3.73Å; L674-I808 HydrophobicContact CB-CD1 4.32Å; L674-I808 HydrophobicContact CB-CG1 4.45Å; L674-I808 HydrophobicContact CD1-CD1 3.94Å; L674-I808 HydrophobicContact CD1-CG1 3.59Å; L674-I808 HydrophobicContact CD2-CD1 4.43Å; L674-I808 HydrophobicContact CG-CD1 4.46Å
675	E	86.3	Confident	80.3	Confident	121 Å²	121	50.7 Å²	50.7	57%	0.565	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.2	115.6	-180	-171.5	179.1	-166.9	0	0	109.9	N699	E675-N699 PolarHBondContact N-O 2.73Å; E675-N699 PolarHBondContact O-N 3.27Å
676	P	81.4	Confident	79.2	Confident	9 Å²	9	55.1 Å²	55.1	6%	0.058	29%	0.287	C	S	.	.	S	Bend	cis	-74	153.4	1.7	32.9	-38.2	0	0	0	113.5	L674 K678 I679 F686	L674-P676 CarbonylContact O-C 3.6Å; P676-K678 VanDerWaalsContact C-N 3.27Å; P676-K678 WeakPolarHBondContact CB-O 3.27Å; P676-K678 PolarHBondContact O-N 3.28Å; P676-I679 HydrophobicContact CG-CG1 4.18Å; P676-F686 HydrophobicContact CB-CD2 3.71Å; P676-F686 HydrophobicContact CB-CE1 4.49Å; P676-F686 HydrophobicContact CB-CE2 3.54Å; P676-F686 HydrophobicContact CB-CG 4.28Å; P676-F686 HydrophobicContact CB-CZ 3.96Å; P676-F686 HydrophobicContact CG-CB 4.36Å; P676-F686 HydrophobicContact CG-CD2 3.58Å; P676-F686 HydrophobicContact CG-CE2 3.98Å; P676-F686 HydrophobicContact CG-CG 3.91Å
677	A	77.9	Confident	78.4	Confident	70 Å²	70	60.2 Å²	60.2	58%	0.579	31%	0.31	S	S	*	.	S	Bend	trans	-73.6	-16.8	176.8	0	0	0	0	0	113.7	L674 P809	L674-A677 PolarHBondContact O-N 3.17Å; A677-P809 WeakPolarHBondContact O-CD 3.4Å
678	K	77.9	Confident	77.7	Confident	91 Å²	91	58.5 Å²	58.5	40%	0.396	31%	0.306	S	S	.	.	S	Bend	trans	-143.8	148.6	178.2	-52.3	-169.4	177.8	177.8	0	109.8	P676 P809 D929	P676-K678 VanDerWaalsContact C-N 3.27Å; P676-K678 WeakPolarHBondContact CB-O 3.27Å; P676-K678 PolarHBondContact O-N 3.28Å; K678-P809 HydrophobicContact CB-CG 4.1Å; K678-P809 HydrophobicContact CD-CG 4.19Å; K678-P809 HydrophobicContact CG-CG 3.7Å; K678-D929 WeakPolarHBondContact CE-O 3.05Å; K678-D929 PolarHBondContact NZ-O 3.09Å
679	I	78.3	Confident	76.7	Confident	3 Å²	3	64.6 Å²	64.6	2%	0.015	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	119	-177	-59.6	176.5	0	0	0	110.8	P676 V696 V698 M769 I808 P809 L810 V811	P676-I679 HydrophobicContact CG-CG1 4.18Å; I679-V696 HydrophobicContact CD1-CG1 4.23Å; I679-V696 HydrophobicContact CG1-CG1 4.43Å; I679-V696 HydrophobicContact CG2-CG1 3.99Å; I679-V696 HydrophobicContact CG2-CG2 4.23Å; I679-V698 HydrophobicContact CD1-CG2 3.71Å; I679-M769 HydrophobicContact CD1-CE 4.37Å; I679-M769 HydrophobicContact CD1-SD 3.31Å; I679-M769 WeakPolarHBondContact CD1-SD 3.43Å; I679-M769 HydrophobicContact CG1-SD 4.49Å; I679-M769 HydrophobicContact CG2-SD 4.03Å; I679-I808 HydrophobicContact CD1-CG2 3.73Å; I679-I808 HydrophobicContact CG1-CG2 3.73Å; I679-P809 PolarHBondContact N-O 3.45Å; I679-L810 HydrophobicContact CB-CD2 3.98Å; I679-L810 HydrophobicContact CD1-CD2 4.48Å; I679-L810 HydrophobicContact CG2-CD2 4.29Å; I679-V811 PolarHBondContact O-N 3.48Å
680	N	74.7	Confident	75.5	Confident	19 Å²	19	65.2 Å²	65.2	10%	0.102	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	124	170.7	-175.3	-23.9	0	0	0	109.8	Q682 H683 S684 V811	N680-Q682 PolarHBondContact OD1-N 3.03Å; N680-Q682 VanDerWaalsContact OD1-N 3.07Å; N680-H683 PolarHBondContact OD1-N 2.79Å; N680-S684 PolarHBondContact O-N 2.73Å; N680-V811 WeakPolarHBondContact CA-O 3.32Å; N680-V811 HydrophobicContact CB-CG2 4.26Å
681	L	70.3	Confident	74.2	Confident	47 Å²	47	71 Å²	71	25%	0.246	36%	0.355	C	S	.	.	S	Bend	trans	-73.3	-31	-174.7	-66	172.8	0	0	0	113.9	L773 F775 V811	L681-L773 HydrophobicContact CD2-CB 4.38Å; L681-L773 HydrophobicContact CD2-CD1 3.45Å; L681-L773 VanDerWaalsContact CD2-CD1 3.45Å; L681-F775 HydrophobicContact CD1-CB 3.7Å; L681-V811 PolarHBondContact N-O 3.36Å; L681-V811 VanDerWaalsContact N-O 3.1Å
682	Q	63.8	Low	72.7	Confident	111 Å²	111	69.5 Å²	69.5	52%	0.519	36%	0.361	S	S	.	.	S	Bend	trans	-87.4	-38.5	-176.2	-61.1	-66.7	-17.7	0	0	112.2	N680 D812	N680-Q682 PolarHBondContact OD1-N 3.03Å; N680-Q682 VanDerWaalsContact OD1-N 3.07Å; Q682-D812 WeakPolarHBondContact CG-OD1 3.45Å; Q682-D812 PolarHBondContact NE2-OD2 3.01Å; Q682-D812 VanDerWaalsContact NE2-OD2 3.14Å
683	H	62.1	Low	71.4	Confident	92 Å²	92	76.3 Å²	76.3	43%	0.426	39%	0.392	S	S	.	.	S	Bend	trans	-127.9	72.6	-179.2	-80.3	-80.2	0	0	0	111	N680 Q685	N680-H683 PolarHBondContact OD1-N 2.79Å; H683-Q685 PolarHBondContact O-N 2.83Å
684	S	57.3	Low	70.3	Confident	18 Å²	18	80.1 Å²	80.1	13%	0.126	40%	0.403	C	S	.	.			trans	-76.5	104.8	173.5	41.7	0	0	0	0	110.5	N680 F686 Q687 V696	N680-S684 PolarHBondContact O-N 2.73Å; S684-F686 PolarHBondContact O-N 2.84Å; S684-Q687 WeakPolarHBondContact O-CG 2.94Å; S684-Q687 VanDerWaalsContact OG-CG 3.23Å; S684-Q687 WeakPolarHBondContact OG-CG 3.2Å; S684-Q687 PolarHBondContact OG-NE2 3.06Å; S684-V696 VanDerWaalsContact CB-CG2 3.48Å
685	Q	56	Low	69.6	Low	139 Å²	139	80 Å²	80	65%	0.65	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-11.1	174.4	-55	-178.3	14.6	0	0	112.9	H683 L817	H683-Q685 PolarHBondContact O-N 2.83Å; Q685-L817 HydrophobicContact CG-CD2 4.48Å
686	F	63.2	Low	69.3	Low	93 Å²	93	74.7 Å²	74.7	41%	0.408	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	36.8	-174.4	-55.8	-83.6	0	0	0	111.9	P676 S684 C697	P676-F686 HydrophobicContact CB-CD2 3.71Å; P676-F686 HydrophobicContact CB-CE1 4.49Å; P676-F686 HydrophobicContact CB-CE2 3.54Å; P676-F686 HydrophobicContact CB-CG 4.28Å; P676-F686 HydrophobicContact CB-CZ 3.96Å; P676-F686 HydrophobicContact CG-CB 4.36Å; P676-F686 HydrophobicContact CG-CD2 3.58Å; P676-F686 HydrophobicContact CG-CE2 3.98Å; P676-F686 HydrophobicContact CG-CG 3.91Å; S684-F686 PolarHBondContact O-N 2.84Å; F686-C697 PolarHBondContact O-N 3.04Å
687	Q	68.9	Low	69.3	Low	107 Å²	107	75 Å²	75	50%	0.5	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	130.2	176.3	-77.2	174.7	15.6	0	0	111	S684 S695	S684-Q687 WeakPolarHBondContact O-CG 2.94Å; S684-Q687 VanDerWaalsContact OG-CG 3.23Å; S684-Q687 WeakPolarHBondContact OG-CG 3.2Å; S684-Q687 PolarHBondContact OG-NE2 3.06Å; Q687-S695 CarbonylContact C-O 3.58Å; Q687-S695 WeakPolarHBondContact CA-O 3.34Å
688	C	72.3	Confident	69.7	Low	31 Å²	31	71.6 Å²	71.6	21%	0.209	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	152.4	169.5	60.5	0	0	0	0	109.3	K694 S695 C697	C688-K694 WeakPolarHBondContact O-CA 3.04Å; C688-S695 PolarHBondContact N-O 2.86Å; C688-S695 PolarHBondContact O-N 2.76Å; C688-S695 VanDerWaalsContact O-O 3.1Å; C688-S695 PolarHBondContact SG-O 3.35Å; C688-C697 HydrophobicContact CB-CB 3.72Å; C688-C697 WeakPolarHBondContact CB-SG 3.45Å; C688-C697 WeakPolarHBondContact SG-CB 3.42Å; C688-C697 CovalentContact SG-SG 2.01Å; C688-C697 PolarHBondContact SG-SG 3.06Å
689	E	68.4	Low	70.2	Confident	135 Å²	135	69.9 Å²	69.9	63%	0.631	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.4	121.5	178.7	-167	170.9	170.4	0	0	109.3
690	H	66.2	Low	70.8	Confident	73 Å²	73	69.8 Å²	69.8	34%	0.338	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	124.8	176.8	-171.9	70.9	0	0	0	109.4	G692 H693 I738 I768	H690-G692 PolarHBondContact O-N 3.01Å; H690-H693 PolarHBondContact N-O 3.5Å; H690-H693 PolarHBondContact O-N 2.97Å; H690-H693 VanDerWaalsContact O-N 3.09Å; H690-I738 VanDerWaalsContact CE1-CG2 3.44Å; H690-I738 WeakPolarHBondContact CE1-CG2 2.91Å; H690-I768 HydrophobicContact CB-CD1 3.69Å
691	K	64.4	Low	71.7	Confident	144 Å²	144	70.2 Å²	70.2	63%	0.626	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	37.5	-174.7	-63.3	-174.4	173.6	-171.6	0	113.8	H693 D743	K691-H693 VanDerWaalsContact C-N 3.27Å; K691-H693 PolarHBondContact O-N 3.23Å; K691-D743 IonicContact NZ-OD1 3.06Å; K691-D743 PolarHBondContact NZ-OD1 3.41Å
692	G	61.9	Low	72.8	Confident	60 Å²	60	68 Å²	68	62%	0.619	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	2.8	179.1	0	0	0	0	0	115.5	H690	H690-G692 PolarHBondContact O-N 3.01Å
693	H	65.1	Low	74.2	Confident	143 Å²	143	64.4 Å²	64.4	66%	0.662	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.8	127.4	172.8	-70.6	-82.9	0	0	0	110.3	H690 K691	H690-H693 PolarHBondContact N-O 3.5Å; H690-H693 PolarHBondContact O-N 2.97Å; H690-H693 VanDerWaalsContact O-N 3.09Å; K691-H693 VanDerWaalsContact C-N 3.27Å; K691-H693 PolarHBondContact O-N 3.23Å
694	K	70.2	Confident	75.7	Confident	151 Å²	151	60 Å²	60	66%	0.657	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	123.3	169.2	-67.7	-175.6	178.8	-177	0	109.3	C688	C688-K694 WeakPolarHBondContact O-CA 3.04Å
695	S	75.4	Confident	77.3	Confident	22 Å²	22	64.2 Å²	64.2	15%	0.154	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	172.3	173.7	-169.5	0	0	0	0	110.7	Q687 C688 M769	Q687-S695 CarbonylContact C-O 3.58Å; Q687-S695 WeakPolarHBondContact CA-O 3.34Å; C688-S695 PolarHBondContact N-O 2.86Å; C688-S695 PolarHBondContact O-N 2.76Å; C688-S695 VanDerWaalsContact O-O 3.1Å; C688-S695 PolarHBondContact SG-O 3.35Å; S695-M769 PolarHBondContact OG-O 3.34Å
696	V	79.4	Confident	78.9	Confident	11 Å²	11	57.8 Å²	57.8	7%	0.067	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	127.5	-179.5	-172.2	0	0	0	0	109.9	I679 S684 M769	I679-V696 HydrophobicContact CD1-CG1 4.23Å; I679-V696 HydrophobicContact CG1-CG1 4.43Å; I679-V696 HydrophobicContact CG2-CG1 3.99Å; I679-V696 HydrophobicContact CG2-CG2 4.23Å; S684-V696 VanDerWaalsContact CB-CG2 3.48Å; V696-M769 HydrophobicContact CB-CB 4.42Å; V696-M769 HydrophobicContact CB-CG 4.26Å; V696-M769 HydrophobicContact CB-SD 3.8Å; V696-M769 HydrophobicContact CG1-SD 4.14Å; V696-M769 HydrophobicContact CG2-SD 4.38Å; V696-M769 PolarHBondContact O-N 3.32Å; V696-M769 VanDerWaalsContact O-N 3.09Å
697	C	82.2	Confident	80	Confident	14 Å²	14	60.6 Å²	60.6	10%	0.095	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	138.6	171.6	-88.7	0	0	0	0	110.9	F686 C688 R766 F767	F686-C697 PolarHBondContact O-N 3.04Å; C688-C697 HydrophobicContact CB-CB 3.72Å; C688-C697 WeakPolarHBondContact CB-SG 3.45Å; C688-C697 WeakPolarHBondContact SG-CB 3.42Å; C688-C697 CovalentContact SG-SG 2.01Å; C688-C697 PolarHBondContact SG-SG 3.06Å; C697-R766 HydrophobicContact CB-CG 4.39Å; C697-F767 WeakPolarHBondContact CA-O 3.21Å
698	V	86.6	Confident	80.8	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	126.1	172	-176.7	0	0	0	0	108.9	I679 R766 F767 I808	I679-V698 HydrophobicContact CD1-CG2 3.71Å; V698-R766 WeakPolarHBondContact O-CA 3.45Å; V698-F767 HydrophobicContact CB-CD1 4.32Å; V698-F767 HydrophobicContact CB-CD2 4.11Å; V698-F767 HydrophobicContact CB-CE1 3.83Å; V698-F767 HydrophobicContact CB-CE2 3.59Å; V698-F767 HydrophobicContact CB-CG 4.47Å; V698-F767 HydrophobicContact CB-CZ 3.44Å; V698-F767 VanDerWaalsContact CB-CZ 3.44Å; V698-F767 HydrophobicContact CG1-CE1 3.86Å; V698-F767 HydrophobicContact CG1-CE2 4.28Å; V698-F767 HydrophobicContact CG1-CZ 3.63Å; V698-F767 HydrophobicContact CG2-CD2 4.35Å; V698-F767 HydrophobicContact CG2-CE2 3.61Å; V698-F767 HydrophobicContact CG2-CZ 3.8Å; V698-F767 PolarHBondContact N-O 3.38Å; V698-F767 PolarHBondContact O-N 3.34Å; V698-F767 VanDerWaalsContact O-N 3.15Å; V698-I808 HydrophobicContact CG1-CD1 3.79Å; V698-I808 HydrophobicContact CG2-CD1 4.21Å
699	N	88.3	Confident	81.2	Confident	55 Å²	55	57.3 Å²	57.3	29%	0.294	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	124.4	169.9	-65.4	-29.2	0	0	0	108.7	E675 R766	E675-N699 PolarHBondContact N-O 2.73Å; E675-N699 PolarHBondContact O-N 3.27Å; N699-R766 PolarHBondContact OD1-NE 3.39Å; N699-R766 PolarHBondContact OD1-NH2 3.22Å; N699-R766 VanDerWaalsContact OD1-NH2 3.12Å
700	T	90.6	Very high	81.5	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	119.2	175.7	-56.5	0	0	0	0	108.4	M672 T673 L674 V702 I724 K764 E765 F767	M672-T700 HydrophobicContact CG-CG2 3.9Å; M672-T700 HydrophobicContact SD-CG2 3.96Å; T673-T700 CarbonylContact O-C 3.54Å; T673-T700 WeakPolarHBondContact O-CA 3.38Å; L674-T700 HydrophobicContact CD2-CG2 3.67Å; L674-T700 VanDerWaalsContact CD2-OG1 3.31Å; L674-T700 WeakPolarHBondContact CD2-OG1 3.36Å; T700-V702 HydrophobicContact CG2-CG2 4Å; T700-I724 HydrophobicContact CG2-CD1 4.26Å; T700-K764 CarbonylContact O-C 3.24Å; T700-K764 WeakPolarHBondContact O-CA 3.42Å; T700-E765 PolarHBondContact N-O 2.97Å; T700-E765 PolarHBondContact O-N 3.33Å; T700-F767 VanDerWaalsContact OG1-CE1 3.29Å; T700-F767 WeakPolarHBondContact OG1-CE1 3.24Å
701	T	93.1	Very high	81.4	Confident	29 Å²	29	57 Å²	57	18%	0.178	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	124.4	172.3	-53.2	0	0	0	0	108.8	M672 T673 C762 K763 K764	M672-T701 CarbonylContact C-O 3.59Å; M672-T701 WeakPolarHBondContact CA-O 3.37Å; T673-T701 PolarHBondContact N-O 3.35Å; T673-T701 PolarHBondContact O-N 3.28Å; T673-T701 WeakPolarHBondContact OG1-CB 3.29Å; T673-T701 PolarHBondContact OG1-O 3.36Å; T701-C762 HydrophobicContact CG2-CB 4.28Å; T701-K763 CarbonylContact C-O 3.47Å; T701-K763 WeakPolarHBondContact CA-O 3.35Å; T701-K764 HydrophobicContact CG2-CG 4.13Å
702	V	93.4	Very high	81.3	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	125.2	177.5	-173.3	0	0	0	0	108.4	N671 M672 T700 F704 I724 C762 K763 L783	N671-V702 WeakPolarHBondContact O-CA 3.45Å; M672-V702 HydrophobicContact CG-CG2 4.2Å; M672-V702 HydrophobicContact SD-CG2 4.44Å; T700-V702 HydrophobicContact CG2-CG2 4Å; V702-F704 HydrophobicContact CB-CE2 4.2Å; V702-F704 HydrophobicContact CB-CZ 4.37Å; V702-F704 HydrophobicContact CG1-CD2 4.28Å; V702-F704 HydrophobicContact CG1-CE1 3.96Å; V702-F704 HydrophobicContact CG1-CE2 3.54Å; V702-F704 HydrophobicContact CG1-CZ 3.35Å; V702-I724 HydrophobicContact CG2-CD1 3.83Å; V702-C762 CarbonylContact O-C 3.56Å; V702-C762 WeakPolarHBondContact O-CA 3.09Å; V702-K763 PolarHBondContact N-O 3.44Å; V702-K763 PolarHBondContact O-N 3.41Å; V702-L783 HydrophobicContact CG1-CD1 3.95Å; V702-L783 HydrophobicContact CG1-CD2 3.35Å; V702-L783 HydrophobicContact CG1-CG 4.3Å; V702-L783 HydrophobicContact CG2-CD1 4.27Å; V702-L783 HydrophobicContact CG2-CD2 4.43Å
703	C	93.8	Very high	80.8	Confident	35 Å²	35	63.8 Å²	63.8	24%	0.236	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	132.5	177.5	-64.3	0	0	0	0	110	S670 N671 I761 C762	S670-C703 CarbonylContact C-O 3.55Å; S670-C703 WeakPolarHBondContact CA-O 3.45Å; S670-C703 WeakPolarHBondContact CB-O 3.22Å; N671-C703 PolarHBondContact N-O 3.33Å; N671-C703 PolarHBondContact O-N 3.25Å; C703-I761 CarbonylContact C-O 3.52Å; C703-I761 WeakPolarHBondContact CA-O 3.22Å; C703-C762 HydrophobicContact CB-CB 4.14Å; C703-C762 WeakPolarHBondContact CB-SG 3.36Å; C703-C762 WeakPolarHBondContact SG-CB 3.19Å; C703-C762 CovalentContact SG-SG 2.05Å; C703-C762 PolarHBondContact SG-SG 3.01Å
704	F	93.1	Very high	80.3	Confident	1 Å²	1	63 Å²	63	0%	0.004	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	136	177.1	-57.5	-83.6	0	0	0	109.4	L668 T669 V702 Y722 F753 I755 T760 I761 L783 F785	L668-F704 HydrophobicContact CD1-CB 4.34Å; L668-F704 HydrophobicContact CD1-CD1 4.5Å; T669-F704 WeakPolarHBondContact O-CA 2.93Å; V702-F704 HydrophobicContact CB-CE2 4.2Å; V702-F704 HydrophobicContact CB-CZ 4.37Å; V702-F704 HydrophobicContact CG1-CD2 4.28Å; V702-F704 HydrophobicContact CG1-CE1 3.96Å; V702-F704 HydrophobicContact CG1-CE2 3.54Å; V702-F704 HydrophobicContact CG1-CZ 3.35Å; F704-Y722 AromaticContact CE2-CD1 3.89Å; F704-Y722 HydrophobicContact CE2-CD1 3.89Å; F704-Y722 HydrophobicContact CE2-CE1 4.25Å; F704-Y722 HydrophobicContact CE2-CG 4.15Å; F704-Y722 AromaticContact CZ-CD1 3.91Å; F704-Y722 HydrophobicContact CZ-CD1 3.91Å; F704-Y722 HydrophobicContact CZ-CD2 4.39Å; F704-Y722 AromaticContact CZ-CG 3.74Å; F704-Y722 HydrophobicContact CZ-CG 3.74Å; F704-F753 HydrophobicContact CB-CE2 4.36Å; F704-F753 HydrophobicContact CB-CZ 3.96Å; F704-F753 HydrophobicContact CD1-CZ 4.25Å; F704-F753 AromaticContact CD2-CE1 3.78Å; F704-F753 HydrophobicContact CD2-CE1 3.78Å; F704-F753 HydrophobicContact CD2-CE2 4.15Å; F704-F753 AromaticContact CD2-CZ 3.38Å; F704-F753 HydrophobicContact CD2-CZ 3.38Å; F704-F753 AromaticContact CE2-CE1 3.74Å; F704-F753 HydrophobicContact CE2-CE1 3.74Å; F704-F753 AromaticContact CE2-CZ 3.85Å; F704-F753 HydrophobicContact CE2-CZ 3.85Å; F704-F753 HydrophobicContact CG-CE1 4.29Å; F704-F753 HydrophobicContact CG-CE2 4.4Å; F704-F753 AromaticContact CG-CZ 3.6Å; F704-F753 HydrophobicContact CG-CZ 3.6Å; F704-F753 HydrophobicContact CZ-CE1 4.24Å; F704-F753 HydrophobicContact CZ-CZ 4.46Å; F704-I755 HydrophobicContact CB-CD1 4.42Å; F704-T760 CarbonylContact O-C 3.59Å; F704-T760 VanDerWaalsContact O-CA 3.27Å; F704-T760 WeakPolarHBondContact O-CA 3.36Å; F704-T760 WeakPolarHBondContact O-CG2 3.41Å; F704-I761 PolarHBondContact N-O 2.84Å; F704-I761 PolarHBondContact O-N 3.26Å; F704-L783 HydrophobicContact CE1-CD2 4.4Å; F704-L783 HydrophobicContact CZ-CD1 4.25Å; F704-L783 HydrophobicContact CZ-CD2 4.5Å; F704-F785 HydrophobicContact CD1-CB 4.46Å; F704-F785 HydrophobicContact CD1-CD2 4.49Å; F704-F785 HydrophobicContact CD1-CG 4.4Å; F704-F785 HydrophobicContact CE1-CB 3.64Å; F704-F785 HydrophobicContact CE1-CD1 4.24Å; F704-F785 HydrophobicContact CE1-CD2 4.34Å; F704-F785 AromaticContact CE1-CG 3.81Å; F704-F785 HydrophobicContact CE1-CG 3.81Å; F704-F785 HydrophobicContact CZ-CB 4.39Å
705	Q	91.3	Very high	79.4	Confident	106 Å²	106	60.4 Å²	60.4	50%	0.495	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	123.9	172.8	176.3	178.5	0.1	0	0	108.1	T669	T669-Q705 PolarHBondContact N-O 2.81Å; T669-Q705 PolarHBondContact O-N 2.87Å
706	Y	89.1	Confident	78.9	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.016	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	130.3	-174.8	177.2	-114.8	0	0	0	110.9	A666 E667 V708 T718 M720 I755 G758 Q759 P794	A666-Y706 HydrophobicContact CB-CD2 4.23Å; A666-Y706 HydrophobicContact CB-CE2 3.36Å; E667-Y706 WeakPolarHBondContact O-CA 2.96Å; Y706-V708 HydrophobicContact CE1-CG2 3.78Å; Y706-T718 PolarHBondContact OH-OG1 2.84Å; Y706-M720 HydrophobicContact CD1-CE 4.3Å; Y706-M720 HydrophobicContact CD2-CE 3.18Å; Y706-M720 HydrophobicContact CE2-CE 3.55Å; Y706-M720 HydrophobicContact CG-CE 3.57Å; Y706-I755 HydrophobicContact CD1-CG2 3.92Å; Y706-I755 HydrophobicContact CG-CG2 4.02Å; Y706-G758 WeakPolarHBondContact O-CA 3.15Å; Y706-G758 PolarHBondContact O-N 3.29Å; Y706-Q759 PolarHBondContact N-O 2.96Å; Y706-P794 WeakPolarHBondContact OH-CG 3.32Å
707	R	86.8	Confident	78.6	Confident	152 Å²	152	69.4 Å²	69.4	57%	0.574	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.5	134.2	177.4	-174.2	-179.2	-178.8	-172.8	-1.7	110.1	A666 E667 N757	A666-R707 CarbonylContact C-O 3.59Å; A666-R707 WeakPolarHBondContact CA-O 3.24Å; E667-R707 HydrophobicContact CB-CB 4.49Å; E667-R707 PolarHBondContact N-O 3.24Å; E667-R707 PolarHBondContact O-N 3.14Å; R707-N757 WeakPolarHBondContact CA-OD1 3.47Å
708	V	85.1	Confident	78.6	Confident	19 Å²	19	69.8 Å²	69.8	12%	0.115	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	138.4	172.6	-175.7	0	0	0	0	108.8	D664 A666 Y706 N757 P794	D664-V708 HydrophobicContact CB-CG1 4.42Å; D664-V708 WeakPolarHBondContact OD2-CG1 3.42Å; A666-V708 HydrophobicContact CB-CG2 4.18Å; Y706-V708 HydrophobicContact CE1-CG2 3.78Å; V708-N757 PolarHBondContact N-OD1 3.2Å; V708-P794 HydrophobicContact CG2-CG 4.43Å
709	K	80.9	Confident	78.6	Confident	49 Å²	49	74.7 Å²	74.7	21%	0.213	37%	0.368	C	S	.	.	S	Bend	trans	-74.5	-35.3	-175.6	-72	-172.4	-177.2	173.8	0	113.1	N580 L581 V665 E667 D797	N580-K709 WeakPolarHBondContact O-CD 3.5Å; L581-K709 HydrophobicContact CB-CB 4.13Å; L581-K709 HydrophobicContact CD1-CB 4.47Å; V665-K709 HydrophobicContact CB-CD 4.46Å; V665-K709 HydrophobicContact CG1-CD 4.49Å; V665-K709 PolarHBondContact O-N 3.22Å; E667-K709 HydrophobicContact CG-CG 4.46Å; E667-K709 VanDerWaalsContact OE1-CE 3.24Å; E667-K709 WeakPolarHBondContact OE1-CE 3.47Å; K709-D797 WeakPolarHBondContact CE-OD2 3.49Å; K709-D797 IonicContact NZ-OD2 2.78Å; K709-D797 PolarHBondContact NZ-OD2 3.11Å
710	S	74.4	Confident	78.7	Confident	15 Å²	15	72.1 Å²	72.1	11%	0.105	35%	0.354	C	S	.	.	S	Bend	trans	-61	145.2	177	-174.3	0	0	0	0	113.3	D664 K712	D664-S710 VanDerWaalsContact CG-CB 3.42Å; D664-S710 WeakPolarHBondContact OD1-CB 3.29Å; D664-S710 PolarHBondContact OD1-N 2.89Å; D664-S710 WeakPolarHBondContact OD2-CB 3.39Å; S710-K712 PolarHBondContact O-N 2.85Å; S710-K712 PolarHBondContact OG-N 2.93Å
711	E	64.8	Low	78.7	Confident	188 Å²	188	77 Å²	77	88%	0.879	37%	0.372	S	S	*	.	S	Bend	trans	-74.5	-12.2	177.7	-64.3	-164.7	151.6	0	0	113.4	R713	E711-R713 PolarHBondContact O-N 2.91Å; E711-R713 VanDerWaalsContact O-N 3.1Å
712	K	61.7	Low	78.7	Confident	111 Å²	111	75.8 Å²	75.8	48%	0.483	37%	0.365	S	S	.	.			trans	-70.8	109.3	178.6	-77.2	-164.9	-179.4	-170	0	111.3	G643 D644 S710 D714	G643-K712 PolarHBondContact O-NZ 3.44Å; D644-K712 WeakPolarHBondContact O-CD 3.47Å; S710-K712 PolarHBondContact O-N 2.85Å; S710-K712 PolarHBondContact OG-N 2.93Å; K712-D714 PolarHBondContact O-N 3.12Å
713	R	52.4	Low	78.7	Confident	234 Å²	234	76.6 Å²	76.6	88%	0.883	37%	0.369	S	S	*	.			trans	-76.3	70.2	174.5	-64.8	-177.7	-176.9	177.9	1.4	111.2	E711 A715	E711-R713 PolarHBondContact O-N 2.91Å; E711-R713 VanDerWaalsContact O-N 3.1Å; R713-A715 PolarHBondContact O-N 3.19Å
714	D	54	Low	78.6	Confident	128 Å²	128	75 Å²	75	68%	0.684	36%	0.358	S	S	*	.			trans	-78.5	122.4	160.1	-90.4	-27.8	0	0	0	109.1	K712 S716	K712-D714 PolarHBondContact O-N 3.12Å; D714-S716 PolarHBondContact O-N 2.04Å
715	A	51.3	Low	78.5	Confident	95 Å²	95	75.1 Å²	75.1	79%	0.785	36%	0.359	S	S	*	.			trans	-71.5	44	174	0	0	0	0	0	111.3	R713	R713-A715 PolarHBondContact O-N 3.19Å
716	S	65.7	Low	78.4	Confident	70 Å²	70	70 Å²	70	49%	0.49	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-80.9	132.1	177	61.2	0	0	0	0	109.3	D714	D714-S716 PolarHBondContact O-N 2.04Å
717	F	72.8	Confident	78.2	Confident	153 Å²	153	70 Å²	70	67%	0.671	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-89.1	126.2	170.2	-66.7	-84	0	0	0	107.7
718	T	81.4	Confident	78	Confident	22 Å²	22	66.2 Å²	66.2	14%	0.135	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	130.2	176.5	-55.3	0	0	0	0	108.9	Y706 S754 I755 L787	Y706-T718 PolarHBondContact OH-OG1 2.84Å; T718-S754 WeakPolarHBondContact O-CA 3.36Å; T718-I755 PolarHBondContact N-O 2.85Å; T718-I755 PolarHBondContact O-N 3.03Å; T718-L787 HydrophobicContact CG2-CD2 3.35Å
719	E	87.9	Confident	77.6	Confident	103 Å²	103	70.1 Å²	70.1	48%	0.481	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	114.5	176.8	-164.3	173.7	-157.1	0	0	110.2	T788	E719-T788 VanDerWaalsContact C-OG1 3.31Å; E719-T788 VanDerWaalsContact O-CB 3.28Å; E719-T788 WeakPolarHBondContact O-CB 3.31Å; E719-T788 PolarHBondContact O-N 2.84Å; E719-T788 PolarHBondContact O-OG1 2.78Å
720	M	88.6	Confident	77.3	Confident	1 Å²	1	70.7 Å²	70.7	1%	0.005	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	149.1	178.6	-69.5	-171	175.6	0	0	111.3	L668 Y706 T752 F753 I755 G786 L787	L668-M720 HydrophobicContact CD1-CE 3.76Å; L668-M720 HydrophobicContact CD1-SD 3.75Å; L668-M720 HydrophobicContact CD2-CE 3.82Å; L668-M720 HydrophobicContact CD2-SD 3.81Å; L668-M720 HydrophobicContact CG-CE 4.32Å; L668-M720 HydrophobicContact CG-SD 4.45Å; Y706-M720 HydrophobicContact CD1-CE 4.3Å; Y706-M720 HydrophobicContact CD2-CE 3.18Å; Y706-M720 HydrophobicContact CE2-CE 3.55Å; Y706-M720 HydrophobicContact CG-CE 3.57Å; M720-T752 CarbonylContact O-C 3.54Å; M720-T752 WeakPolarHBondContact O-CA 3.35Å; M720-F753 HydrophobicContact CB-CD1 4.2Å; M720-F753 HydrophobicContact CB-CE1 3.7Å; M720-F753 HydrophobicContact CB-CE2 4.16Å; M720-F753 HydrophobicContact CB-CZ 3.67Å; M720-F753 HydrophobicContact CG-CZ 4.33Å; M720-F753 PolarHBondContact N-O 2.84Å; M720-F753 PolarHBondContact O-N 2.98Å; M720-F753 HydrophobicContact SD-CE2 4.17Å; M720-F753 HydrophobicContact SD-CZ 3.85Å; M720-I755 HydrophobicContact CE-CG2 3.41Å; M720-I755 VanDerWaalsContact CE-CG2 3.41Å; M720-I755 HydrophobicContact CG-CG2 3.93Å; M720-I755 HydrophobicContact SD-CG2 3.51Å; M720-I755 VanDerWaalsContact SD-CG2 3.51Å; M720-G786 WeakPolarHBondContact CA-O 3.41Å; M720-L787 HydrophobicContact CE-CD2 4.43Å
721	R	92.1	Very high	77.4	Confident	101 Å²	101	75.2 Å²	75.2	38%	0.381	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	135.6	173.4	175	-178.3	163.6	158.8	-4.1	109.2	N723 T750 K751 T752 F785 G786 T788	R721-N723 PolarHBondContact NE-OD1 3.41Å; R721-N723 PolarHBondContact NH2-ND2 2.76Å; R721-N723 PolarHBondContact NH2-OD1 3.15Å; R721-T750 HydrophobicContact CG-CG2 4.07Å; R721-K751 WeakPolarHBondContact CA-O 3.48Å; R721-T752 HydrophobicContact CB-CG2 4.3Å; R721-F785 WeakPolarHBondContact O-CA 3.29Å; R721-G786 PolarHBondContact N-O 2.83Å; R721-G786 PolarHBondContact O-N 2.99Å; R721-T788 PolarHBondContact N-OG1 3.07Å
722	Y	93.2	Very high	77.9	Confident	5 Å²	5	74.9 Å²	74.9	2%	0.02	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	144.4	164.6	71.3	-86.2	0	0	0	111.7	F704 I724 T750 K751 F753 K763 E765 L783 E784	F704-Y722 AromaticContact CE2-CD1 3.89Å; F704-Y722 HydrophobicContact CE2-CD1 3.89Å; F704-Y722 HydrophobicContact CE2-CE1 4.25Å; F704-Y722 HydrophobicContact CE2-CG 4.15Å; F704-Y722 AromaticContact CZ-CD1 3.91Å; F704-Y722 HydrophobicContact CZ-CD1 3.91Å; F704-Y722 HydrophobicContact CZ-CD2 4.39Å; F704-Y722 AromaticContact CZ-CG 3.74Å; F704-Y722 HydrophobicContact CZ-CG 3.74Å; Y722-I724 HydrophobicContact CD2-CD1 4.24Å; Y722-I724 HydrophobicContact CD2-CG1 3.85Å; Y722-I724 HydrophobicContact CE2-CD1 3.96Å; Y722-I724 HydrophobicContact CE2-CG1 4.01Å; Y722-T750 WeakPolarHBondContact O-CA 3.25Å; Y722-K751 HydrophobicContact CD1-CB 4.14Å; Y722-K751 HydrophobicContact CE1-CB 3.51Å; Y722-K751 HydrophobicContact CE1-CG 4.37Å; Y722-K751 HydrophobicContact CE2-CB 4.07Å; Y722-K751 HydrophobicContact CE2-CG 4.23Å; Y722-K751 VanDerWaalsContact CZ-CB 3.46Å; Y722-K751 PolarHBondContact N-O 3.3Å; Y722-K751 PolarHBondContact O-N 3.09Å; Y722-F753 AromaticContact CD1-CD1 3.68Å; Y722-F753 HydrophobicContact CD1-CD1 3.68Å; Y722-F753 AromaticContact CD1-CE1 3.6Å; Y722-F753 HydrophobicContact CD1-CE1 3.6Å; Y722-F753 AromaticContact CE1-CD1 3.83Å; Y722-F753 HydrophobicContact CE1-CD1 3.83Å; Y722-F753 HydrophobicContact CE1-CE1 4.12Å; Y722-K763 HydrophobicContact CE1-CB 4.46Å; Y722-K763 HydrophobicContact CE1-CG 4.18Å; Y722-K763 WeakPolarHBondContact OH-CB 3.35Å; Y722-E765 HydrophobicContact CE2-CG 4.46Å; Y722-E765 PolarHBondContact OH-OE1 3.26Å; Y722-L783 HydrophobicContact CD2-CD1 3.96Å; Y722-L783 HydrophobicContact CG-CD1 4.38Å; Y722-E784 CarbonylContact C-O 3.56Å; Y722-E784 VanDerWaalsContact CA-O 3.24Å; Y722-E784 WeakPolarHBondContact CA-O 3.21Å
723	N	92.3	Very high	78.8	Confident	17 Å²	17	70.4 Å²	70.4	9%	0.091	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	129.9	171.8	-53.5	-33.9	0	0	0	108.3	R721 V749 T750 L783 E784	R721-N723 PolarHBondContact NE-OD1 3.41Å; R721-N723 PolarHBondContact NH2-ND2 2.76Å; R721-N723 PolarHBondContact NH2-OD1 3.15Å; N723-V749 CarbonylContact C-O 3.55Å; N723-V749 VanDerWaalsContact CA-O 3.3Å; N723-V749 WeakPolarHBondContact CA-O 3.21Å; N723-T750 WeakPolarHBondContact OD1-CB 3.15Å; N723-T750 VanDerWaalsContact OD1-CG2 3.25Å; N723-T750 WeakPolarHBondContact OD1-CG2 3.49Å; N723-T750 PolarHBondContact OD1-OG1 3.16Å; N723-L783 CarbonylContact O-C 3.55Å; N723-L783 WeakPolarHBondContact O-CA 3.08Å; N723-E784 HydrophobicContact CB-CB 4.35Å; N723-E784 PolarHBondContact N-O 2.91Å; N723-E784 PolarHBondContact O-N 3.48Å
724	I	91.6	Very high	80.3	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	121.6	165.4	-46.1	-179.2	0	0	0	107.5	T700 V702 Y722 F737 R748 V749 E765 V781 T782 L783	T700-I724 HydrophobicContact CG2-CD1 4.26Å; V702-I724 HydrophobicContact CG2-CD1 3.83Å; Y722-I724 HydrophobicContact CD2-CD1 4.24Å; Y722-I724 HydrophobicContact CD2-CG1 3.85Å; Y722-I724 HydrophobicContact CE2-CD1 3.96Å; Y722-I724 HydrophobicContact CE2-CG1 4.01Å; I724-F737 HydrophobicContact CB-CE2 4.41Å; I724-F737 HydrophobicContact CB-CZ 3.8Å; I724-F737 HydrophobicContact CG2-CZ 3.73Å; I724-F737 WeakPolarHBondContact O-CE2 2.79Å; I724-R748 VanDerWaalsContact O-CA 3.32Å; I724-R748 WeakPolarHBondContact O-CA 3.19Å; I724-V749 HydrophobicContact CB-CG1 3.84Å; I724-V749 HydrophobicContact CD1-CG1 4.44Å; I724-V749 HydrophobicContact CG1-CG1 4.19Å; I724-V749 PolarHBondContact N-O 3.19Å; I724-V749 PolarHBondContact O-N 3.24Å; I724-E765 HydrophobicContact CD1-CB 4.29Å; I724-E765 HydrophobicContact CD1-CG 3.89Å; I724-V781 HydrophobicContact CG2-CG1 3.59Å; I724-T782 CarbonylContact C-O 3.59Å; I724-T782 WeakPolarHBondContact CA-O 3.5Å; I724-L783 HydrophobicContact CD1-CD1 4.45Å; I724-L783 HydrophobicContact CG1-CD1 3.81Å
725	T	91	Very high	81.7	Confident	4 Å²	4	53.8 Å²	53.8	3%	0.025	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	128.9	178.2	-53.1	0	0	0	0	110.1	L728 R748 T782	T725-L728 HydrophobicContact CG2-CB 4.3Å; T725-L728 HydrophobicContact CG2-CD1 3.71Å; T725-R748 HydrophobicContact CG2-CB 4.44Å; T725-R748 WeakPolarHBondContact OG1-CD 3.3Å; T725-R748 WeakPolarHBondContact OG1-CG 3.46Å; T725-T782 PolarHBondContact N-O 2.82Å; T725-T782 PolarHBondContact O-N 3.36Å
726	L	89.1	Confident	83.4	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	136.3	178.6	-55.1	171.8	0	0	0	110.3	L728 A735 F737 R747 F767 N780 V781	L726-L728 VanDerWaalsContact C-N 3.3Å; L726-L728 PolarHBondContact O-N 3.23Å; L726-A735 HydrophobicContact CB-CB 4.43Å; L726-A735 HydrophobicContact CD1-CB 3.8Å; L726-F737 HydrophobicContact CD1-CD2 3.87Å; L726-F737 HydrophobicContact CD1-CE1 4.43Å; L726-F737 HydrophobicContact CD1-CE2 3.55Å; L726-F737 HydrophobicContact CD1-CG 4.44Å; L726-F737 HydrophobicContact CD1-CZ 3.84Å; L726-F737 HydrophobicContact CD2-CE2 4.21Å; L726-F737 HydrophobicContact CD2-CZ 3.92Å; L726-F737 HydrophobicContact CG-CD2 4.33Å; L726-F737 HydrophobicContact CG-CE2 3.55Å; L726-F737 HydrophobicContact CG-CZ 3.79Å; L726-R747 PolarHBondContact N-O 2.87Å; L726-F767 HydrophobicContact CD1-CB 3.69Å; L726-F767 HydrophobicContact CD1-CD1 4.21Å; L726-F767 HydrophobicContact CD1-CD2 4.05Å; L726-F767 HydrophobicContact CD1-CG 3.75Å; L726-F767 HydrophobicContact CD2-CD1 3.81Å; L726-F767 HydrophobicContact CD2-CD2 4.43Å; L726-F767 HydrophobicContact CD2-CE1 3.77Å; L726-F767 HydrophobicContact CD2-CE2 4.39Å; L726-F767 HydrophobicContact CD2-CG 4.13Å; L726-F767 HydrophobicContact CD2-CZ 4.05Å; L726-N780 CarbonylContact C-O 3.52Å; L726-V781 HydrophobicContact CD2-CB 4.41Å; L726-V781 HydrophobicContact CD2-CG1 4.04Å; L726-V781 HydrophobicContact CD2-CG2 3.9Å
727	D	85.6	Confident	84.3	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.011	25%	0.247	C	C	.	.	S	Bend	trans	50.5	45.6	177.7	-84.8	-19.7	0	0	0	113	P729 R730 A733 R734 I779 N780	D727-P729 VanDerWaalsContact C-N 3.3Å; D727-P729 VanDerWaalsContact O-N 3.13Å; D727-R730 HydrophobicContact CB-CB 4.33Å; D727-R730 PolarHBondContact O-N 3.2Å; D727-A733 HydrophobicContact CB-CB 4.09Å; D727-R734 IonicContact OD1-CZ 3.84Å; D727-R734 IonicContact OD1-NE 3.64Å; D727-R734 IonicContact OD1-NH2 3.54Å; D727-R734 PolarHBondContact OD1-NH2 2.84Å; D727-R734 VanDerWaalsContact OD2-CB 3.24Å; D727-R734 WeakPolarHBondContact OD2-CB 2.96Å; D727-R734 WeakPolarHBondContact OD2-CG 3.28Å; D727-R734 IonicContact OD2-CZ 3.88Å; D727-R734 PolarHBondContact OD2-N 3.08Å; D727-R734 IonicContact OD2-NE 3.22Å; D727-R734 PolarHBondContact OD2-NE 2.87Å; D727-R734 IonicContact OD2-NH2 3.01Å; D727-R734 PolarHBondContact OD2-NH2 2.94Å; D727-I779 WeakPolarHBondContact OD1-CA 3.32Å; D727-N780 PolarHBondContact N-O 2.97Å; D727-N780 PolarHBondContact OD1-N 3.38Å
728	L	81.8	Confident	84.3	Confident	73 Å²	73	42.8 Å²	42.8	38%	0.382	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.3	-42.1	-178.5	-173.4	70.3	0	0	0	114.4	T725 L726 R730 T782	T725-L728 HydrophobicContact CG2-CB 4.3Å; T725-L728 HydrophobicContact CG2-CD1 3.71Å; L726-L728 VanDerWaalsContact C-N 3.3Å; L726-L728 PolarHBondContact O-N 3.23Å; L728-R730 VanDerWaalsContact C-N 3.27Å; L728-R730 PolarHBondContact O-N 3.33Å; L728-T782 HydrophobicContact CD2-CG2 4.37Å
729	P	77.6	Confident	83.4	Confident	101 Å²	101	45.6 Å²	45.6	66%	0.656	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-17	-180	-16.8	31	0	0	0	114.7	D727	D727-P729 VanDerWaalsContact C-N 3.3Å; D727-P729 VanDerWaalsContact O-N 3.13Å
730	R	74.9	Confident	81.8	Confident	61 Å²	61	49.6 Å²	49.6	23%	0.23	26%	0.261	C	S	.	.	S	Bend	trans	-96.4	142.1	-174.5	-68.6	-177.8	166.4	-123.2	-0.2	111.3	D727 L728 K732 R747 D774 D777	D727-R730 HydrophobicContact CB-CB 4.33Å; D727-R730 PolarHBondContact O-N 3.2Å; L728-R730 VanDerWaalsContact C-N 3.27Å; L728-R730 PolarHBondContact O-N 3.33Å; R730-K732 VanDerWaalsContact C-N 3.31Å; R730-K732 PolarHBondContact O-N 3.35Å; R730-R747 PolarHBondContact O-NH1 2.91Å; R730-D774 IonicContact CZ-OD2 3.49Å; R730-D774 VanDerWaalsContact CZ-OD2 3.26Å; R730-D774 IonicContact NH1-OD2 2.87Å; R730-D774 PolarHBondContact NH1-OD2 3.22Å; R730-D774 IonicContact NH2-OD2 3.75Å; R730-D774 PolarHBondContact NH2-OD2 2.88Å; R730-D777 IonicContact CZ-OD2 3.62Å; R730-D777 IonicContact NE-OD2 3.74Å; R730-D777 IonicContact NH2-OD2 2.85Å; R730-D777 PolarHBondContact NH2-OD2 3.09Å
731	A	74.8	Confident	80	Confident	111 Å²	111	56.6 Å²	56.6	92%	0.917	30%	0.298	S	S	*	.	S	Bend	trans	-65.4	-33.8	174.6	0	0	0	0	0	112.7
732	K	76	Confident	78.1	Confident	181 Å²	181	57.1 Å²	57.1	79%	0.787	31%	0.308	S	S	*	.	S	Bend	trans	-122.1	116.2	174.8	-170.4	175.8	-177.2	177.2	0	109.3	R730	R730-K732 VanDerWaalsContact C-N 3.31Å; R730-K732 PolarHBondContact O-N 3.35Å
733	A	81.1	Confident	76.1	Confident	17 Å²	17	64 Å²	64	14%	0.14	35%	0.345	C	S	.	.			trans	-70.4	141.4	179.5	0	0	0	0	0	111	D727 A735 R747	D727-A733 HydrophobicContact CB-CB 4.09Å; A733-A735 VanDerWaalsContact C-N 3.32Å; A733-R747 HydrophobicContact CB-CB 3.6Å
734	R	83.8	Confident	74.3	Confident	11 Å²	11	71.1 Å²	71.1	4%	0.042	38%	0.375	C	S	.	.	S	Bend	trans	-88.3	-3.5	176.7	-62.3	169	-68	176.2	-0.9	112.7	D727 S770 L773 D774 D777 P778	D727-R734 IonicContact OD1-CZ 3.84Å; D727-R734 IonicContact OD1-NE 3.64Å; D727-R734 IonicContact OD1-NH2 3.54Å; D727-R734 PolarHBondContact OD1-NH2 2.84Å; D727-R734 VanDerWaalsContact OD2-CB 3.24Å; D727-R734 WeakPolarHBondContact OD2-CB 2.96Å; D727-R734 WeakPolarHBondContact OD2-CG 3.28Å; D727-R734 IonicContact OD2-CZ 3.88Å; D727-R734 PolarHBondContact OD2-N 3.08Å; D727-R734 IonicContact OD2-NE 3.22Å; D727-R734 PolarHBondContact OD2-NE 2.87Å; D727-R734 IonicContact OD2-NH2 3.01Å; D727-R734 PolarHBondContact OD2-NH2 2.94Å; R734-S770 WeakPolarHBondContact O-CB 3.31Å; R734-S770 PolarHBondContact O-N 3.42Å; R734-S770 PolarHBondContact O-OG 2.6Å; R734-L773 HydrophobicContact CB-CD2 4.08Å; R734-D774 PolarHBondContact NH1-O 3.38Å; R734-D777 PolarHBondContact NH1-O 2.81Å; R734-P778 PolarHBondContact NH2-O 2.79Å
735	A	84	Confident	73	Confident	2 Å²	2	75.7 Å²	75.7	2%	0.017	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	153.4	176.5	0	0	0	0	0	110.1	L726 A733 F767 I768	L726-A735 HydrophobicContact CB-CB 4.43Å; L726-A735 HydrophobicContact CD1-CB 3.8Å; A733-A735 VanDerWaalsContact C-N 3.32Å; A735-F767 HydrophobicContact CB-CD2 3.71Å; A735-F767 HydrophobicContact CB-CE2 3.96Å; A735-I768 CarbonylContact C-O 3.59Å; A735-I768 VanDerWaalsContact CA-O 3.26Å; A735-I768 WeakPolarHBondContact CA-O 3.43Å
736	S	85.4	Confident	72.3	Confident	20 Å²	20	79.8 Å²	79.8	14%	0.14	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	147.2	178.7	56.5	0	0	0	0	110.4	D746 F767 I768	S736-D746 WeakPolarHBondContact CA-O 3.43Å; S736-F767 WeakPolarHBondContact O-CA 3.41Å; S736-F767 WeakPolarHBondContact O-CB 3.35Å; S736-I768 PolarHBondContact N-O 3.39Å; S736-I768 PolarHBondContact O-N 3.11Å
737	F	85.5	Confident	72.1	Confident	15 Å²	15	84.1 Å²	84.1	7%	0.066	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	148.3	171.6	-67.6	-80.2	0	0	0	110.5	I724 L726 D746 V749 E765 F767	I724-F737 HydrophobicContact CB-CE2 4.41Å; I724-F737 HydrophobicContact CB-CZ 3.8Å; I724-F737 HydrophobicContact CG2-CZ 3.73Å; I724-F737 WeakPolarHBondContact O-CE2 2.79Å; L726-F737 HydrophobicContact CD1-CD2 3.87Å; L726-F737 HydrophobicContact CD1-CE1 4.43Å; L726-F737 HydrophobicContact CD1-CE2 3.55Å; L726-F737 HydrophobicContact CD1-CG 4.44Å; L726-F737 HydrophobicContact CD1-CZ 3.84Å; L726-F737 HydrophobicContact CD2-CE2 4.21Å; L726-F737 HydrophobicContact CD2-CZ 3.92Å; L726-F737 HydrophobicContact CG-CD2 4.33Å; L726-F737 HydrophobicContact CG-CE2 3.55Å; L726-F737 HydrophobicContact CG-CZ 3.79Å; F737-D746 PolarHBondContact N-O 3.46Å; F737-V749 HydrophobicContact CB-CB 4.48Å; F737-V749 HydrophobicContact CD1-CB 4.21Å; F737-V749 HydrophobicContact CD1-CG1 3.92Å; F737-V749 HydrophobicContact CD2-CB 3.77Å; F737-V749 HydrophobicContact CD2-CG1 3.92Å; F737-V749 HydrophobicContact CE1-CB 4.44Å; F737-V749 HydrophobicContact CE1-CG1 3.69Å; F737-V749 HydrophobicContact CE2-CB 4Å; F737-V749 HydrophobicContact CE2-CG1 3.66Å; F737-V749 HydrophobicContact CG-CB 3.88Å; F737-V749 HydrophobicContact CG-CG1 4.04Å; F737-V749 HydrophobicContact CZ-CB 4.35Å; F737-V749 HydrophobicContact CZ-CG1 3.57Å; F737-E765 HydrophobicContact CE1-CB 4.22Å; F737-F767 HydrophobicContact CD1-CB 3.8Å; F737-F767 HydrophobicContact CE1-CB 3.96Å; F737-F767 HydrophobicContact CE1-CD1 4.09Å; F737-F767 HydrophobicContact CE1-CG 4.49Å; F737-F767 HydrophobicContact CG-CB 4.31Å; F737-F767 HydrophobicContact CZ-CD1 4.49Å
738	I	72.6	Confident	72.2	Confident	51 Å²	51	90 Å²	90	26%	0.262	47%	0.468	S	S	.	.			trans	-95.2	110.6	173.5	-61	168.4	0	0	0	107	H690 I768	H690-I738 VanDerWaalsContact CE1-CG2 3.44Å; H690-I738 WeakPolarHBondContact CE1-CG2 2.91Å; I738-I768 HydrophobicContact CD1-CB 3.94Å; I738-I768 HydrophobicContact CD1-CD1 4.34Å; I738-I768 HydrophobicContact CD1-CG2 4.13Å; I738-I768 HydrophobicContact CG1-CB 4.14Å; I738-I768 HydrophobicContact CG1-CG2 3.81Å
739	D	61.9	Low	72.5	Confident	81 Å²	81	87.4 Å²	87.4	43%	0.433	46%	0.455	S	S	.	.			trans	-95.1	136.1	167.3	-153.7	-17.8	0	0	0	109.1
740	Q	55.2	Low	73.1	Confident	187 Å²	187	85.3 Å²	85.3	87%	0.874	44%	0.44	S	S	*	.	S	Bend	trans	-80.1	-19.4	-176.1	-74	-177.1	-11.4	0	0	112.5
741	D	51.2	Low	73.8	Confident	148 Å²	148	86.5 Å²	86.5	79%	0.791	45%	0.447	S	S	*	.	S	Bend	trans	-115.8	-1.9	-168.5	-72	-38	0	0	0	115.4
742	L	52.3	Low	74.6	Confident	113 Å²	113	84.9 Å²	84.9	59%	0.592	43%	0.426	S	S	*	.			trans	-136.9	132.2	-178.2	-72.2	165.4	0	0	0	111.8	K744	L742-K744 PolarHBondContact O-N 3.44Å
743	D	49.6	Very low	75.3	Confident	148 Å²	148	76.9 Å²	76.9	79%	0.791	39%	0.391	S	S	*	.	S	Bend	trans	-66.2	19.5	174.1	-96.9	-32.9	0	0	0	114.5	K691	K691-D743 IonicContact NZ-OD1 3.06Å; K691-D743 PolarHBondContact NZ-OD1 3.41Å
744	K	54.6	Low	75.8	Confident	167 Å²	167	79.3 Å²	79.3	73%	0.726	41%	0.407	S	S	*	.			trans	-111.8	108.1	-180	-71.3	-176	179.2	178.3	0	110.2	L742 D746	L742-K744 PolarHBondContact O-N 3.44Å; K744-D746 PolarHBondContact O-N 3.29Å
745	S	64.4	Low	75.9	Confident	96 Å²	96	78.8 Å²	78.8	67%	0.671	41%	0.405	S	S	*	.			trans	-72.8	111	163.7	60.2	0	0	0	0	109.1
746	D	76.6	Confident	76.1	Confident	91 Å²	91	80.3 Å²	80.3	49%	0.487	42%	0.416	S	S	.	.			trans	-106.1	147.2	177.7	-154.6	-26.3	0	0	0	111	S736 F737 K744 R748	S736-D746 WeakPolarHBondContact CA-O 3.43Å; F737-D746 PolarHBondContact N-O 3.46Å; K744-D746 PolarHBondContact O-N 3.29Å; D746-R748 VanDerWaalsContact C-N 3.3Å; D746-R748 PolarHBondContact OD1-N 3.34Å
747	R	85.8	Confident	76	Confident	91 Å²	91	82.5 Å²	82.5	34%	0.343	43%	0.426	S	S	.	.	S	Bend	trans	-79.5	-16.5	175	73.3	176.4	-160.8	163.9	8.4	112.4	L726 R730 A733	L726-R747 PolarHBondContact N-O 2.87Å; R730-R747 PolarHBondContact O-NH1 2.91Å; A733-R747 HydrophobicContact CB-CB 3.6Å
748	R	86.8	Confident	75.9	Confident	126 Å²	126	84.8 Å²	84.8	48%	0.475	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	134.9	-178.4	-176.3	172.4	66.3	-177.2	1	109.9	I724 T725 D746	I724-R748 VanDerWaalsContact O-CA 3.32Å; I724-R748 WeakPolarHBondContact O-CA 3.19Å; T725-R748 HydrophobicContact CG2-CB 4.44Å; T725-R748 WeakPolarHBondContact OG1-CD 3.3Å; T725-R748 WeakPolarHBondContact OG1-CG 3.46Å; D746-R748 VanDerWaalsContact C-N 3.3Å; D746-R748 PolarHBondContact OD1-N 3.34Å
749	V	88.9	Confident	76.5	Confident	18 Å²	18	85.9 Å²	85.9	11%	0.109	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	134.6	167.3	68.5	0	0	0	0	108.8	N723 I724 F737 K751	N723-V749 CarbonylContact C-O 3.55Å; N723-V749 VanDerWaalsContact CA-O 3.3Å; N723-V749 WeakPolarHBondContact CA-O 3.21Å; I724-V749 HydrophobicContact CB-CG1 3.84Å; I724-V749 HydrophobicContact CD1-CG1 4.44Å; I724-V749 HydrophobicContact CG1-CG1 4.19Å; I724-V749 PolarHBondContact N-O 3.19Å; I724-V749 PolarHBondContact O-N 3.24Å; F737-V749 HydrophobicContact CB-CB 4.48Å; F737-V749 HydrophobicContact CD1-CB 4.21Å; F737-V749 HydrophobicContact CD1-CG1 3.92Å; F737-V749 HydrophobicContact CD2-CB 3.77Å; F737-V749 HydrophobicContact CD2-CG1 3.92Å; F737-V749 HydrophobicContact CE1-CB 4.44Å; F737-V749 HydrophobicContact CE1-CG1 3.69Å; F737-V749 HydrophobicContact CE2-CB 4Å; F737-V749 HydrophobicContact CE2-CG1 3.66Å; F737-V749 HydrophobicContact CG-CB 3.88Å; F737-V749 HydrophobicContact CG-CG1 4.04Å; F737-V749 HydrophobicContact CZ-CB 4.35Å; F737-V749 HydrophobicContact CZ-CG1 3.57Å; V749-K751 HydrophobicContact CG2-CD 4.35Å; V749-K751 HydrophobicContact CG2-CG 4.16Å
750	T	89.8	Confident	77.8	Confident	57 Å²	57	86 Å²	86	35%	0.35	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	129.5	173.9	-67.5	0	0	0	0	108	R721 Y722 N723	R721-T750 HydrophobicContact CG-CG2 4.07Å; Y722-T750 WeakPolarHBondContact O-CA 3.25Å; N723-T750 WeakPolarHBondContact OD1-CB 3.15Å; N723-T750 VanDerWaalsContact OD1-CG2 3.25Å; N723-T750 WeakPolarHBondContact OD1-CG2 3.49Å; N723-T750 PolarHBondContact OD1-OG1 3.16Å
751	K	90.1	Very high	79.6	Confident	85 Å²	85	78.3 Å²	78.3	37%	0.37	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	149.7	178	-63.5	-66.2	-174.9	-175.1	0	109.6	R721 Y722 V749	R721-K751 WeakPolarHBondContact CA-O 3.48Å; Y722-K751 HydrophobicContact CD1-CB 4.14Å; Y722-K751 HydrophobicContact CE1-CB 3.51Å; Y722-K751 HydrophobicContact CE1-CG 4.37Å; Y722-K751 HydrophobicContact CE2-CB 4.07Å; Y722-K751 HydrophobicContact CE2-CG 4.23Å; Y722-K751 VanDerWaalsContact CZ-CB 3.46Å; Y722-K751 PolarHBondContact N-O 3.3Å; Y722-K751 PolarHBondContact O-N 3.09Å; V749-K751 HydrophobicContact CG2-CD 4.35Å; V749-K751 HydrophobicContact CG2-CG 4.16Å
752	T	92	Very high	81.6	Confident	78 Å²	78	74.5 Å²	74.5	48%	0.479	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	149.5	170.8	56.4	0	0	0	0	110.1	M720 R721	M720-T752 CarbonylContact O-C 3.54Å; M720-T752 WeakPolarHBondContact O-CA 3.35Å; R721-T752 HydrophobicContact CB-CG2 4.3Å
753	F	90.6	Very high	83.5	Confident	13 Å²	13	73.1 Å²	73.1	6%	0.057	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	150.3	174.8	68.4	-80.7	0	0	0	110.6	F704 M720 Y722 I755 I761	F704-F753 HydrophobicContact CB-CE2 4.36Å; F704-F753 HydrophobicContact CB-CZ 3.96Å; F704-F753 HydrophobicContact CD1-CZ 4.25Å; F704-F753 AromaticContact CD2-CE1 3.78Å; F704-F753 HydrophobicContact CD2-CE1 3.78Å; F704-F753 HydrophobicContact CD2-CE2 4.15Å; F704-F753 AromaticContact CD2-CZ 3.38Å; F704-F753 HydrophobicContact CD2-CZ 3.38Å; F704-F753 AromaticContact CE2-CE1 3.74Å; F704-F753 HydrophobicContact CE2-CE1 3.74Å; F704-F753 AromaticContact CE2-CZ 3.85Å; F704-F753 HydrophobicContact CE2-CZ 3.85Å; F704-F753 HydrophobicContact CG-CE1 4.29Å; F704-F753 HydrophobicContact CG-CE2 4.4Å; F704-F753 AromaticContact CG-CZ 3.6Å; F704-F753 HydrophobicContact CG-CZ 3.6Å; F704-F753 HydrophobicContact CZ-CE1 4.24Å; F704-F753 HydrophobicContact CZ-CZ 4.46Å; M720-F753 HydrophobicContact CB-CD1 4.2Å; M720-F753 HydrophobicContact CB-CE1 3.7Å; M720-F753 HydrophobicContact CB-CE2 4.16Å; M720-F753 HydrophobicContact CB-CZ 3.67Å; M720-F753 HydrophobicContact CG-CZ 4.33Å; M720-F753 PolarHBondContact N-O 2.84Å; M720-F753 PolarHBondContact O-N 2.98Å; M720-F753 HydrophobicContact SD-CE2 4.17Å; M720-F753 HydrophobicContact SD-CZ 3.85Å; Y722-F753 AromaticContact CD1-CD1 3.68Å; Y722-F753 HydrophobicContact CD1-CD1 3.68Å; Y722-F753 AromaticContact CD1-CE1 3.6Å; Y722-F753 HydrophobicContact CD1-CE1 3.6Å; Y722-F753 AromaticContact CE1-CD1 3.83Å; Y722-F753 HydrophobicContact CE1-CD1 3.83Å; Y722-F753 HydrophobicContact CE1-CE1 4.12Å; F753-I755 HydrophobicContact CD2-CB 4.32Å; F753-I755 HydrophobicContact CE2-CB 3.97Å; F753-I755 HydrophobicContact CE2-CD1 4.12Å; F753-I755 HydrophobicContact CE2-CG2 4.41Å; F753-I761 HydrophobicContact CD2-CD1 4.11Å; F753-I761 HydrophobicContact CD2-CG2 4.28Å; F753-I761 HydrophobicContact CE2-CB 4.44Å; F753-I761 HydrophobicContact CE2-CD1 4.44Å
754	S	89.6	Confident	85.5	Confident	68 Å²	68	74.2 Å²	74.2	48%	0.476	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	135.7	174	-49.2	0	0	0	0	110.4	T718 I761	T718-S754 WeakPolarHBondContact O-CA 3.36Å; S754-I761 VanDerWaalsContact O-CD1 3.24Å; S754-I761 WeakPolarHBondContact O-CD1 3.45Å
755	I	87.9	Confident	87.1	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	147.1	175.7	-166.4	160	0	0	0	110.2	F704 Y706 T718 M720 F753 Q759 I761	F704-I755 HydrophobicContact CB-CD1 4.42Å; Y706-I755 HydrophobicContact CD1-CG2 3.92Å; Y706-I755 HydrophobicContact CG-CG2 4.02Å; T718-I755 PolarHBondContact N-O 2.85Å; T718-I755 PolarHBondContact O-N 3.03Å; M720-I755 HydrophobicContact CE-CG2 3.41Å; M720-I755 VanDerWaalsContact CE-CG2 3.41Å; M720-I755 HydrophobicContact CG-CG2 3.93Å; M720-I755 HydrophobicContact SD-CG2 3.51Å; M720-I755 VanDerWaalsContact SD-CG2 3.51Å; F753-I755 HydrophobicContact CD2-CB 4.32Å; F753-I755 HydrophobicContact CE2-CB 3.97Å; F753-I755 HydrophobicContact CE2-CD1 4.12Å; F753-I755 HydrophobicContact CE2-CG2 4.41Å; I755-Q759 HydrophobicContact CG1-CB 4.16Å; I755-I761 HydrophobicContact CB-CD1 3.95Å; I755-I761 HydrophobicContact CD1-CB 4.37Å; I755-I761 HydrophobicContact CD1-CD1 4.17Å; I755-I761 HydrophobicContact CD1-CG1 4.15Å; I755-I761 HydrophobicContact CG1-CD1 3.82Å; I755-I761 HydrophobicContact CG1-CG1 4.22Å
756	S	86.8	Confident	88.2	Confident	34 Å²	34	70 Å²	70	24%	0.238	36%	0.363	C	S	.	.			trans	-107.9	160.5	175.8	61.5	0	0	0	0	111.5	G758 Q759	S756-G758 PolarHBondContact O-N 3.42Å; S756-Q759 VanDerWaalsContact O-CB 3.25Å; S756-Q759 WeakPolarHBondContact O-CB 3.36Å; S756-Q759 PolarHBondContact O-N 3.1Å; S756-Q759 VanDerWaalsContact O-N 3.16Å; S756-Q759 PolarHBondContact OG-OE1 2.92Å
757	N	84.6	Confident	88.8	Confident	66 Å²	66	65.6 Å²	65.6	35%	0.353	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	128.3	-179	-171.4	13.7	0	0	0	111.8	R707 V708 Q759	R707-N757 WeakPolarHBondContact CA-OD1 3.47Å; V708-N757 PolarHBondContact N-OD1 3.2Å; N757-Q759 VanDerWaalsContact C-N 3.29Å; N757-Q759 PolarHBondContact O-N 3.02Å
758	G	82.3	Confident	88.7	Confident	62 Å²	62	62.1 Å²	62.1	64%	0.639	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	80	4.6	-179.8	0	0	0	0	0	114.8	Y706 S756	Y706-G758 WeakPolarHBondContact O-CA 3.15Å; Y706-G758 PolarHBondContact O-N 3.29Å; S756-G758 PolarHBondContact O-N 3.42Å
759	Q	85.3	Confident	88.3	Confident	75 Å²	75	56.4 Å²	56.4	35%	0.35	31%	0.307	S	S	.	.			trans	-90.5	146.7	179.3	-165.9	179.5	7.8	0	0	111.6	Y706 I755 S756 N757 I761	Y706-Q759 PolarHBondContact N-O 2.96Å; I755-Q759 HydrophobicContact CG1-CB 4.16Å; S756-Q759 VanDerWaalsContact O-CB 3.25Å; S756-Q759 WeakPolarHBondContact O-CB 3.36Å; S756-Q759 PolarHBondContact O-N 3.1Å; S756-Q759 VanDerWaalsContact O-N 3.16Å; S756-Q759 PolarHBondContact OG-OE1 2.92Å; N757-Q759 VanDerWaalsContact C-N 3.29Å; N757-Q759 PolarHBondContact O-N 3.02Å; Q759-I761 HydrophobicContact CG-CG1 4.08Å
760	T	90.1	Very high	87.6	Confident	82 Å²	82	57.7 Å²	57.7	50%	0.503	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	127.1	168	-56.5	0	0	0	0	109.5	F704	F704-T760 CarbonylContact O-C 3.59Å; F704-T760 VanDerWaalsContact O-CA 3.27Å; F704-T760 WeakPolarHBondContact O-CA 3.36Å; F704-T760 WeakPolarHBondContact O-CG2 3.41Å
761	I	92.6	Very high	86.3	Confident	26 Å²	26	60 Å²	60	13%	0.133	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	128.4	179.4	-64	179.5	0	0	0	109.4	C703 F704 F753 S754 I755 Q759 K763	C703-I761 CarbonylContact C-O 3.52Å; C703-I761 WeakPolarHBondContact CA-O 3.22Å; F704-I761 PolarHBondContact N-O 2.84Å; F704-I761 PolarHBondContact O-N 3.26Å; F753-I761 HydrophobicContact CD2-CD1 4.11Å; F753-I761 HydrophobicContact CD2-CG2 4.28Å; F753-I761 HydrophobicContact CE2-CB 4.44Å; F753-I761 HydrophobicContact CE2-CD1 4.44Å; S754-I761 VanDerWaalsContact O-CD1 3.24Å; S754-I761 WeakPolarHBondContact O-CD1 3.45Å; I755-I761 HydrophobicContact CB-CD1 3.95Å; I755-I761 HydrophobicContact CD1-CB 4.37Å; I755-I761 HydrophobicContact CD1-CD1 4.17Å; I755-I761 HydrophobicContact CD1-CG1 4.15Å; I755-I761 HydrophobicContact CG1-CD1 3.82Å; I755-I761 HydrophobicContact CG1-CG1 4.22Å; Q759-I761 HydrophobicContact CG-CG1 4.08Å; I761-K763 HydrophobicContact CG2-CD 4.41Å; I761-K763 HydrophobicContact CG2-CG 4.46Å
762	C	93.3	Very high	84.9	Confident	69 Å²	69	67.2 Å²	67.2	47%	0.466	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	133	173.2	-58.1	0	0	0	0	111.2	T701 V702 C703	T701-C762 HydrophobicContact CG2-CB 4.28Å; V702-C762 CarbonylContact O-C 3.56Å; V702-C762 WeakPolarHBondContact O-CA 3.09Å; C703-C762 HydrophobicContact CB-CB 4.14Å; C703-C762 WeakPolarHBondContact CB-SG 3.36Å; C703-C762 WeakPolarHBondContact SG-CB 3.19Å; C703-C762 CovalentContact SG-SG 2.05Å; C703-C762 PolarHBondContact SG-SG 3.01Å
763	K	92.4	Very high	83.4	Confident	83 Å²	83	65.6 Å²	65.6	36%	0.361	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	143.8	174.5	-62.6	-63.2	-175.4	177.8	0	109.7	T701 V702 Y722 I761	T701-K763 CarbonylContact C-O 3.47Å; T701-K763 WeakPolarHBondContact CA-O 3.35Å; V702-K763 PolarHBondContact N-O 3.44Å; V702-K763 PolarHBondContact O-N 3.41Å; Y722-K763 HydrophobicContact CE1-CB 4.46Å; Y722-K763 HydrophobicContact CE1-CG 4.18Å; Y722-K763 WeakPolarHBondContact OH-CB 3.35Å; I761-K763 HydrophobicContact CG2-CD 4.41Å; I761-K763 HydrophobicContact CG2-CG 4.46Å
764	K	90.7	Very high	82.1	Confident	171 Å²	171	67.9 Å²	67.9	74%	0.743	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.5	126.1	179.2	-66.6	-174.3	178.4	-177.1	0	108.8	T700 T701	T700-K764 CarbonylContact O-C 3.24Å; T700-K764 WeakPolarHBondContact O-CA 3.42Å; T701-K764 HydrophobicContact CG2-CG 4.13Å
765	E	89.5	Confident	80.9	Confident	35 Å²	35	70.5 Å²	70.5	16%	0.164	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	152.1	174.8	-60	-60	161.8	0	0	109.4	T700 Y722 I724 F737	T700-E765 PolarHBondContact N-O 2.97Å; T700-E765 PolarHBondContact O-N 3.33Å; Y722-E765 HydrophobicContact CE2-CG 4.46Å; Y722-E765 PolarHBondContact OH-OE1 3.26Å; I724-E765 HydrophobicContact CD1-CB 4.29Å; I724-E765 HydrophobicContact CD1-CG 3.89Å; F737-E765 HydrophobicContact CE1-CB 4.22Å
766	R	87.3	Confident	79.9	Confident	139 Å²	139	75 Å²	75	53%	0.525	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	132.3	177.3	-177.8	179.1	-72.1	161.4	-0.1	109.8	C697 V698 N699	C697-R766 HydrophobicContact CB-CG 4.39Å; V698-R766 WeakPolarHBondContact O-CA 3.45Å; N699-R766 PolarHBondContact OD1-NE 3.39Å; N699-R766 PolarHBondContact OD1-NH2 3.22Å; N699-R766 VanDerWaalsContact OD1-NH2 3.12Å
767	F	87.4	Confident	79.2	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	158	173.3	65.8	-101.8	0	0	0	111.4	C697 V698 T700 L726 A735 S736 F737 V781 I808	C697-F767 WeakPolarHBondContact CA-O 3.21Å; V698-F767 HydrophobicContact CB-CD1 4.32Å; V698-F767 HydrophobicContact CB-CD2 4.11Å; V698-F767 HydrophobicContact CB-CE1 3.83Å; V698-F767 HydrophobicContact CB-CE2 3.59Å; V698-F767 HydrophobicContact CB-CG 4.47Å; V698-F767 HydrophobicContact CB-CZ 3.44Å; V698-F767 VanDerWaalsContact CB-CZ 3.44Å; V698-F767 HydrophobicContact CG1-CE1 3.86Å; V698-F767 HydrophobicContact CG1-CE2 4.28Å; V698-F767 HydrophobicContact CG1-CZ 3.63Å; V698-F767 HydrophobicContact CG2-CD2 4.35Å; V698-F767 HydrophobicContact CG2-CE2 3.61Å; V698-F767 HydrophobicContact CG2-CZ 3.8Å; V698-F767 PolarHBondContact N-O 3.38Å; V698-F767 PolarHBondContact O-N 3.34Å; V698-F767 VanDerWaalsContact O-N 3.15Å; T700-F767 VanDerWaalsContact OG1-CE1 3.29Å; T700-F767 WeakPolarHBondContact OG1-CE1 3.24Å; L726-F767 HydrophobicContact CD1-CB 3.69Å; L726-F767 HydrophobicContact CD1-CD1 4.21Å; L726-F767 HydrophobicContact CD1-CD2 4.05Å; L726-F767 HydrophobicContact CD1-CG 3.75Å; L726-F767 HydrophobicContact CD2-CD1 3.81Å; L726-F767 HydrophobicContact CD2-CD2 4.43Å; L726-F767 HydrophobicContact CD2-CE1 3.77Å; L726-F767 HydrophobicContact CD2-CE2 4.39Å; L726-F767 HydrophobicContact CD2-CG 4.13Å; L726-F767 HydrophobicContact CD2-CZ 4.05Å; A735-F767 HydrophobicContact CB-CD2 3.71Å; A735-F767 HydrophobicContact CB-CE2 3.96Å; S736-F767 WeakPolarHBondContact O-CA 3.41Å; S736-F767 WeakPolarHBondContact O-CB 3.35Å; F737-F767 HydrophobicContact CD1-CB 3.8Å; F737-F767 HydrophobicContact CE1-CB 3.96Å; F737-F767 HydrophobicContact CE1-CD1 4.09Å; F737-F767 HydrophobicContact CE1-CG 4.49Å; F737-F767 HydrophobicContact CG-CB 4.31Å; F737-F767 HydrophobicContact CZ-CD1 4.49Å; F767-V781 HydrophobicContact CE1-CG2 4.21Å; F767-V781 HydrophobicContact CZ-CG2 4.07Å; F767-I808 HydrophobicContact CZ-CD1 3.75Å
768	I	84.1	Confident	79	Confident	18 Å²	18	73.8 Å²	73.8	9%	0.092	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	147	-178.4	-164.5	169	0	0	0	110.6	H690 A735 S736 I738	H690-I768 HydrophobicContact CB-CD1 3.69Å; A735-I768 CarbonylContact C-O 3.59Å; A735-I768 VanDerWaalsContact CA-O 3.26Å; A735-I768 WeakPolarHBondContact CA-O 3.43Å; S736-I768 PolarHBondContact N-O 3.39Å; S736-I768 PolarHBondContact O-N 3.11Å; I738-I768 HydrophobicContact CD1-CB 3.94Å; I738-I768 HydrophobicContact CD1-CD1 4.34Å; I738-I768 HydrophobicContact CD1-CG2 4.13Å; I738-I768 HydrophobicContact CG1-CB 4.14Å; I738-I768 HydrophobicContact CG1-CG2 3.81Å
769	M	79.6	Confident	79.1	Confident	6 Å²	6	70.8 Å²	70.8	3%	0.03	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	147.2	177.7	-67.2	-174.8	62.9	0	0	112.4	I679 S695 V696 L773 I779 L810	I679-M769 HydrophobicContact CD1-CE 4.37Å; I679-M769 HydrophobicContact CD1-SD 3.31Å; I679-M769 WeakPolarHBondContact CD1-SD 3.43Å; I679-M769 HydrophobicContact CG1-SD 4.49Å; I679-M769 HydrophobicContact CG2-SD 4.03Å; S695-M769 PolarHBondContact OG-O 3.34Å; V696-M769 HydrophobicContact CB-CB 4.42Å; V696-M769 HydrophobicContact CB-CG 4.26Å; V696-M769 HydrophobicContact CB-SD 3.8Å; V696-M769 HydrophobicContact CG1-SD 4.14Å; V696-M769 HydrophobicContact CG2-SD 4.38Å; V696-M769 PolarHBondContact O-N 3.32Å; V696-M769 VanDerWaalsContact O-N 3.09Å; M769-L773 HydrophobicContact CB-CD2 4.32Å; M769-L773 HydrophobicContact CE-CD1 3.48Å; M769-L773 VanDerWaalsContact CE-CD1 3.48Å; M769-L773 HydrophobicContact CE-CD2 3.23Å; M769-L773 HydrophobicContact CE-CG 3.95Å; M769-I779 HydrophobicContact CE-CD1 3.55Å; M769-I779 HydrophobicContact CG-CD1 4.39Å; M769-I779 HydrophobicContact SD-CD1 4Å; M769-L810 HydrophobicContact CE-CD2 3.9Å
770	S	74.1	Confident	79.2	Confident	45 Å²	45	69.1 Å²	69.1	32%	0.315	35%	0.345	S	S	.	.			trans	-77.1	149.6	175.3	-70.2	0	0	0	0	111.6	R734 R772 L773	R734-S770 WeakPolarHBondContact O-CB 3.31Å; R734-S770 PolarHBondContact O-N 3.42Å; R734-S770 PolarHBondContact O-OG 2.6Å; S770-R772 VanDerWaalsContact C-N 3.26Å; S770-R772 PolarHBondContact O-N 2.83Å; S770-L773 WeakPolarHBondContact O-CD2 3.5Å; S770-L773 WeakPolarHBondContact O-CG 3.38Å
771	A	61.4	Low	79.2	Confident	105 Å²	105	65.2 Å²	65.2	87%	0.868	32%	0.321	S	S	*	.	S	Bend	trans	-68.7	-13.6	-174.8	0	0	0	0	0	115.8
772	R	60.4	Low	79.2	Confident	236 Å²	236	64.4 Å²	64.4	89%	0.891	32%	0.317	S	S	*	.	S	Bend	trans	-114.7	92.8	174.9	-72	-172.9	-176.1	177	1.8	109.3	S770	S770-R772 VanDerWaalsContact C-N 3.26Å; S770-R772 PolarHBondContact O-N 2.83Å
773	L	61.7	Low	79.2	Confident	45 Å²	45	61.1 Å²	61.1	24%	0.236	29%	0.294	C	S	.	.			trans	-92.4	124.6	-179.1	-63.8	165.1	0	0	0	109.7	L681 R734 M769 S770 F775	L681-L773 HydrophobicContact CD2-CB 4.38Å; L681-L773 HydrophobicContact CD2-CD1 3.45Å; L681-L773 VanDerWaalsContact CD2-CD1 3.45Å; R734-L773 HydrophobicContact CB-CD2 4.08Å; M769-L773 HydrophobicContact CB-CD2 4.32Å; M769-L773 HydrophobicContact CE-CD1 3.48Å; M769-L773 VanDerWaalsContact CE-CD1 3.48Å; M769-L773 HydrophobicContact CE-CD2 3.23Å; M769-L773 HydrophobicContact CE-CG 3.95Å; S770-L773 WeakPolarHBondContact O-CD2 3.5Å; S770-L773 WeakPolarHBondContact O-CG 3.38Å; L773-F775 PolarHBondContact O-N 3.48Å
774	D	62.1	Low	79.2	Confident	61 Å²	61	60.6 Å²	60.6	33%	0.326	29%	0.293	S	S	.	.			trans	-76.7	114.6	158.8	-180	3.9	0	0	0	107.4	R730 R734 K776	R730-D774 IonicContact CZ-OD2 3.49Å; R730-D774 VanDerWaalsContact CZ-OD2 3.26Å; R730-D774 IonicContact NH1-OD2 2.87Å; R730-D774 PolarHBondContact NH1-OD2 3.22Å; R730-D774 IonicContact NH2-OD2 3.75Å; R730-D774 PolarHBondContact NH2-OD2 2.88Å; R734-D774 PolarHBondContact NH1-O 3.38Å; D774-K776 PolarHBondContact O-N 2.9Å; D774-K776 WeakPolarHBondContact OD1-CB 3.08Å; D774-K776 PolarHBondContact OD1-N 2.87Å; D774-K776 VanDerWaalsContact OD1-N 3.1Å
775	F	65.7	Low	79.2	Confident	122 Å²	122	53.1 Å²	53.1	54%	0.535	26%	0.261	S	S	.	.	S	Bend	trans	-83.6	5.4	-176.5	53.9	-92.6	0	0	0	113	L681 L773	L681-F775 HydrophobicContact CD1-CB 3.7Å; L773-F775 PolarHBondContact O-N 3.48Å
776	K	66.6	Low	79.2	Confident	95 Å²	95	52.1 Å²	52.1	41%	0.413	26%	0.26	S	S	.	.	S	Bend	trans	-81.5	-38.5	-173.6	-152	-176.6	-170.7	-164.1	0	114	D774 Y894 P895	D774-K776 PolarHBondContact O-N 2.9Å; D774-K776 WeakPolarHBondContact OD1-CB 3.08Å; D774-K776 PolarHBondContact OD1-N 2.87Å; D774-K776 VanDerWaalsContact OD1-N 3.1Å; K776-Y894 HydrophobicContact CD-CE1 3.66Å; K776-Y894 HydrophobicContact CG-CE1 3.85Å; K776-Y894 WeakPolarHBondContact CG-OH 3.21Å; K776-P895 HydrophobicContact CB-CB 4.37Å; K776-P895 HydrophobicContact CG-CB 3.54Å; K776-P895 HydrophobicContact CG-CG 3.79Å
777	D	73	Confident	79.2	Confident	51 Å²	51	46.4 Å²	46.4	27%	0.273	24%	0.24	S	C	.	.	S	Bend	trans	-115.5	148.9	-175.8	-72.8	-45.2	0	0	0	113.2	R730 R734 L810 Y894	R730-D777 IonicContact CZ-OD2 3.62Å; R730-D777 IonicContact NE-OD2 3.74Å; R730-D777 IonicContact NH2-OD2 2.85Å; R730-D777 PolarHBondContact NH2-OD2 3.09Å; R734-D777 PolarHBondContact NH1-O 2.81Å; D777-L810 WeakPolarHBondContact O-CD1 3.49Å; D777-Y894 WeakPolarHBondContact OD1-CE2 3.5Å; D777-Y894 PolarHBondContact OD1-OH 2.89Å; D777-Y894 PolarHBondContact OD2-OH 2.71Å
778	P	79.9	Confident	79	Confident	23 Å²	23	49.4 Å²	49.4	15%	0.149	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-64.7	158.8	167.3	31.8	-36.3	0	0	0	111.2	R734 I808	R734-P778 PolarHBondContact NH2-O 2.79Å; P778-I808 CarbonylContact C-O 3.48Å; P778-I808 VanDerWaalsContact CA-O 3.26Å; P778-I808 WeakPolarHBondContact CA-O 3.44Å; P778-I808 WeakPolarHBondContact CB-O 3.33Å
779	I	84.2	Confident	78.8	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	123.4	175.2	-59	175.8	0	0	0	108.9	D727 M769 V781 T807 I808 L810	D727-I779 WeakPolarHBondContact OD1-CA 3.32Å; M769-I779 HydrophobicContact CE-CD1 3.55Å; M769-I779 HydrophobicContact CG-CD1 4.39Å; M769-I779 HydrophobicContact SD-CD1 4Å; I779-V781 HydrophobicContact CG2-CG2 4.47Å; I779-T807 CarbonylContact O-C 3.55Å; I779-T807 VanDerWaalsContact O-CA 3.27Å; I779-T807 WeakPolarHBondContact O-CA 3.48Å; I779-I808 HydrophobicContact CB-CB 4.32Å; I779-I808 PolarHBondContact N-O 2.84Å; I779-I808 PolarHBondContact O-N 2.77Å; I779-L810 HydrophobicContact CD1-CD2 4.11Å; I779-L810 HydrophobicContact CG1-CD1 4.4Å; I779-L810 HydrophobicContact CG1-CD2 4.32Å
780	N	87.6	Confident	78.5	Confident	40 Å²	40	58.6 Å²	58.6	21%	0.214	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	125	177	-69.3	3.9	0	0	0	109.8	L726 D727 T805 T807	L726-N780 CarbonylContact C-O 3.52Å; D727-N780 PolarHBondContact N-O 2.97Å; D727-N780 PolarHBondContact OD1-N 3.38Å; N780-T805 HydrophobicContact CB-CG2 4.44Å; N780-T807 VanDerWaalsContact OD1-CG2 3.27Å; N780-T807 WeakPolarHBondContact OD1-CG2 3.49Å
781	V	90.2	Very high	78.3	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	107.7	173	-174.1	0	0	0	0	107	M672 L674 I724 L726 F767 I779 T805 K806 I808	M672-V781 HydrophobicContact CE-CB 4.18Å; M672-V781 HydrophobicContact CE-CG1 3.99Å; M672-V781 WeakPolarHBondContact CE-O 3.15Å; M672-V781 HydrophobicContact SD-CG1 3.8Å; L674-V781 HydrophobicContact CD1-CB 4.35Å; L674-V781 HydrophobicContact CD1-CG2 4.18Å; L674-V781 HydrophobicContact CD2-CB 4.47Å; L674-V781 HydrophobicContact CD2-CG1 4.28Å; L674-V781 HydrophobicContact CD2-CG2 4.28Å; I724-V781 HydrophobicContact CG2-CG1 3.59Å; L726-V781 HydrophobicContact CD2-CB 4.41Å; L726-V781 HydrophobicContact CD2-CG1 4.04Å; L726-V781 HydrophobicContact CD2-CG2 3.9Å; F767-V781 HydrophobicContact CE1-CG2 4.21Å; F767-V781 HydrophobicContact CZ-CG2 4.07Å; I779-V781 HydrophobicContact CG2-CG2 4.47Å; V781-T805 WeakPolarHBondContact O-CA 2.97Å; V781-K806 PolarHBondContact N-O 2.86Å; V781-K806 PolarHBondContact O-N 2.89Å; V781-I808 HydrophobicContact CG2-CD1 4.2Å; V781-I808 HydrophobicContact CG2-CG1 4.47Å
782	T	91.9	Very high	78.6	Confident	8 Å²	8	62.6 Å²	62.6	5%	0.049	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	121.2	-179.2	-60	0	0	0	0	109.3	I724 T725 L728 E784 T805	I724-T782 CarbonylContact C-O 3.59Å; I724-T782 WeakPolarHBondContact CA-O 3.5Å; T725-T782 PolarHBondContact N-O 2.82Å; T725-T782 PolarHBondContact O-N 3.36Å; L728-T782 HydrophobicContact CD2-CG2 4.37Å; T782-E784 HydrophobicContact CG2-CG 4.31Å; T782-T805 WeakPolarHBondContact CG2-OG1 2.98Å; T782-T805 PolarHBondContact OG1-OG1 3.46Å
783	L	92.9	Very high	79.2	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	123	172.2	173.5	72.6	0	0	0	108.5	M672 V702 F704 Y722 N723 I724 F785 S803 I804	M672-L783 HydrophobicContact CB-CD2 4.47Å; M672-L783 HydrophobicContact CE-CB 4.31Å; M672-L783 HydrophobicContact SD-CB 3.97Å; V702-L783 HydrophobicContact CG1-CD1 3.95Å; V702-L783 HydrophobicContact CG1-CD2 3.35Å; V702-L783 HydrophobicContact CG1-CG 4.3Å; V702-L783 HydrophobicContact CG2-CD1 4.27Å; V702-L783 HydrophobicContact CG2-CD2 4.43Å; F704-L783 HydrophobicContact CE1-CD2 4.4Å; F704-L783 HydrophobicContact CZ-CD1 4.25Å; F704-L783 HydrophobicContact CZ-CD2 4.5Å; Y722-L783 HydrophobicContact CD2-CD1 3.96Å; Y722-L783 HydrophobicContact CG-CD1 4.38Å; N723-L783 CarbonylContact O-C 3.55Å; N723-L783 WeakPolarHBondContact O-CA 3.08Å; I724-L783 HydrophobicContact CD1-CD1 4.45Å; I724-L783 HydrophobicContact CG1-CD1 3.81Å; L783-F785 HydrophobicContact CD2-CD1 4.02Å; L783-F785 HydrophobicContact CD2-CE1 4.37Å; L783-F785 HydrophobicContact CG-CD1 3.98Å; L783-S803 CarbonylContact O-C 3.58Å; L783-S803 WeakPolarHBondContact O-CA 3.06Å; L783-S803 WeakPolarHBondContact O-CB 3.37Å; L783-I804 PolarHBondContact N-O 2.97Å; L783-I804 PolarHBondContact O-N 3.33Å
784	E	92.5	Very high	80.1	Confident	73 Å²	73	52.3 Å²	52.3	34%	0.341	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	136.7	169.1	-62.3	169.8	162.8	0	0	108.1	Y722 N723 T782	Y722-E784 CarbonylContact C-O 3.56Å; Y722-E784 VanDerWaalsContact CA-O 3.24Å; Y722-E784 WeakPolarHBondContact CA-O 3.21Å; N723-E784 HydrophobicContact CB-CB 4.35Å; N723-E784 PolarHBondContact N-O 2.91Å; N723-E784 PolarHBondContact O-N 3.48Å; T782-E784 HydrophobicContact CG2-CG 4.31Å
785	F	91.9	Very high	81.3	Confident	13 Å²	13	50.6 Å²	50.6	6%	0.057	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	149.2	-177.4	56.2	-84.8	0	0	0	111.6	L668 S670 F704 R721 L783 P801 T802 I804	L668-F785 HydrophobicContact CD2-CD2 3.6Å; L668-F785 HydrophobicContact CD2-CE2 4.09Å; L668-F785 HydrophobicContact CG-CD2 3.86Å; L668-F785 HydrophobicContact CG-CE2 3.88Å; S670-F785 WeakPolarHBondContact OG-CE1 3.34Å; S670-F785 WeakPolarHBondContact OG-CZ 3.44Å; F704-F785 HydrophobicContact CD1-CB 4.46Å; F704-F785 HydrophobicContact CD1-CD2 4.49Å; F704-F785 HydrophobicContact CD1-CG 4.4Å; F704-F785 HydrophobicContact CE1-CB 3.64Å; F704-F785 HydrophobicContact CE1-CD1 4.24Å; F704-F785 HydrophobicContact CE1-CD2 4.34Å; F704-F785 AromaticContact CE1-CG 3.81Å; F704-F785 HydrophobicContact CE1-CG 3.81Å; F704-F785 HydrophobicContact CZ-CB 4.39Å; R721-F785 WeakPolarHBondContact O-CA 3.29Å; L783-F785 HydrophobicContact CD2-CD1 4.02Å; L783-F785 HydrophobicContact CD2-CE1 4.37Å; L783-F785 HydrophobicContact CG-CD1 3.98Å; F785-P801 WeakPolarHBondContact CE2-O 3.5Å; F785-P801 WeakPolarHBondContact CZ-O 3.38Å; F785-T802 WeakPolarHBondContact CD1-O 3.26Å; F785-T802 PolarHBondContact N-O 2.9Å; F785-I804 HydrophobicContact CE1-CD1 4.33Å; F785-I804 HydrophobicContact CE1-CG1 4.18Å
786	G	89.4	Confident	82.2	Confident	15 Å²	15	46.2 Å²	46.2	16%	0.155	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174	-174.4	-178.5	0	0	0	0	0	112.6	M720 R721	M720-G786 WeakPolarHBondContact CA-O 3.41Å; R721-G786 PolarHBondContact N-O 2.83Å; R721-G786 PolarHBondContact O-N 2.99Å
787	L	86.2	Confident	83	Confident	18 Å²	18	42.6 Å²	42.6	9%	0.094	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	146.4	173.9	-61.7	170.4	0	0	0	109.9	T718 M720 P794 L796	T718-L787 HydrophobicContact CG2-CD2 3.35Å; M720-L787 HydrophobicContact CE-CD2 4.43Å; L787-P794 WeakPolarHBondContact CD1-O 3.39Å; L787-L796 HydrophobicContact CD1-CD2 4.18Å; L787-L796 HydrophobicContact CD1-CG 3.89Å; L787-L796 HydrophobicContact CD2-CD2 4.28Å; L787-L796 HydrophobicContact CG-CD1 4.15Å; L787-L796 HydrophobicContact CG-CD2 4.06Å; L787-L796 HydrophobicContact CG-CG 3.93Å
788	T	84.1	Confident	83.1	Confident	63 Å²	63	43.9 Å²	43.9	39%	0.387	25%	0.251	S	S	.	.	S	Bend	trans	-78	-36.3	177.1	-51.4	0	0	0	0	111.4	E719 R721	E719-T788 VanDerWaalsContact C-OG1 3.31Å; E719-T788 VanDerWaalsContact O-CB 3.28Å; E719-T788 WeakPolarHBondContact O-CB 3.31Å; E719-T788 PolarHBondContact O-N 2.84Å; E719-T788 PolarHBondContact O-OG1 2.78Å; R721-T788 PolarHBondContact N-OG1 3.07Å
789	D	78.4	Confident	82.9	Confident	70 Å²	70	47 Å²	47	37%	0.374	27%	0.273	S	S	.	.			trans	-116.6	109.2	172.1	-171	-15.1	0	0	0	107.7	D791 K792	D789-D791 VanDerWaalsContact C-N 3.32Å; D789-D791 WeakPolarHBondContact OD1-CB 3.31Å; D789-D791 PolarHBondContact OD1-N 3.3Å; D789-K792 PolarHBondContact OD1-N 3.33Å; D789-K792 VanDerWaalsContact OD2-CD 3.32Å; D789-K792 WeakPolarHBondContact OD2-CD 2.92Å; D789-K792 WeakPolarHBondContact OD2-CG 3.19Å
790	E	73.3	Confident	82.9	Confident	147 Å²	147	49.5 Å²	49.5	69%	0.687	29%	0.286	S	S	*	.	S	Bend	trans	-81.7	-15.2	179.1	-66.3	-178.3	173.1	0	0	112.1	R663	R663-E790 PolarHBondContact NH1-O 3Å; R663-E790 PolarHBondContact NH2-O 3.14Å
791	D	70.3	Confident	82.9	Confident	78 Å²	78	51.5 Å²	51.5	42%	0.417	30%	0.301	S	S	.	.	S	Bend	trans	-90.4	-12.6	-176.2	-72.4	-21.1	0	0	0	112.7	K30 D789	K30-D791 IonicContact NZ-OD1 2.8Å; K30-D791 PolarHBondContact NZ-OD1 3.05Å; K30-D791 IonicContact NZ-OD2 3.43Å; K30-D791 PolarHBondContact NZ-OD2 3.17Å; D789-D791 VanDerWaalsContact C-N 3.32Å; D789-D791 WeakPolarHBondContact OD1-CB 3.31Å; D789-D791 PolarHBondContact OD1-N 3.3Å
792	K	68.1	Low	82.8	Confident	156 Å²	156	55.3 Å²	55.3	68%	0.678	33%	0.325	S	S	*	.	S	Bend	trans	-125.4	137.4	-179.5	-64.1	-174.2	-171.8	166.6	0	112.2	D789	D789-K792 PolarHBondContact OD1-N 3.33Å; D789-K792 VanDerWaalsContact OD2-CD 3.32Å; D789-K792 WeakPolarHBondContact OD2-CD 2.92Å; D789-K792 WeakPolarHBondContact OD2-CG 3.19Å
793	G	73.1	Confident	82.8	Confident	49 Å²	49	57.9 Å²	57.9	51%	0.505	34%	0.343	S	S	.	.	S	Bend	trans	86.5	-164.2	178.1	0	0	0	0	0	113.4	R663	R663-G793 VanDerWaalsContact CZ-O 3.29Å; R663-G793 PolarHBondContact NE-O 3.43Å; R663-G793 PolarHBondContact NH2-O 2.78Å
794	P	81.1	Confident	82.6	Confident	16 Å²	16	59.7 Å²	59.7	10%	0.104	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-70.6	153.5	-176.8	28.6	-34.1	0	0	0	112	D664 A666 Y706 V708 L787	D664-P794 HydrophobicContact CB-CB 4.12Å; D664-P794 CarbonylContact O-C 3.59Å; D664-P794 WeakPolarHBondContact O-CA 3.12Å; D664-P794 WeakPolarHBondContact O-CB 3.25Å; A666-P794 HydrophobicContact CB-CB 4Å; A666-P794 HydrophobicContact CB-CG 4.09Å; Y706-P794 WeakPolarHBondContact OH-CG 3.32Å; V708-P794 HydrophobicContact CG2-CG 4.43Å; L787-P794 WeakPolarHBondContact CD1-O 3.39Å
795	V	85.9	Confident	82.5	Confident	26 Å²	26	59.9 Å²	59.9	16%	0.158	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	145.8	173.7	-173.1	0	0	0	0	110.1	F25 R663 D664 V665 A666	F25-V795 VanDerWaalsContact O-CB 3.28Å; F25-V795 WeakPolarHBondContact O-CB 3.45Å; F25-V795 WeakPolarHBondContact O-CG1 3.49Å; F25-V795 VanDerWaalsContact O-CG2 3.28Å; F25-V795 WeakPolarHBondContact O-CG2 3.32Å; R663-V795 HydrophobicContact CB-CG2 4.11Å; D664-V795 PolarHBondContact O-N 3.22Å; V665-V795 CarbonylContact C-O 3.49Å; V665-V795 WeakPolarHBondContact CA-O 3.24Å; A666-V795 PolarHBondContact N-O 3.24Å
796	L	85.9	Confident	82.3	Confident	29 Å²	29	63 Å²	63	15%	0.152	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	139.1	177.2	-63.2	-179.7	0	0	0	111.1	A666 L668 L787 A798 T802	A666-L796 WeakPolarHBondContact O-CA 3.44Å; L668-L796 HydrophobicContact CB-CD2 3.81Å; L668-L796 HydrophobicContact CD2-CD1 4.14Å; L668-L796 HydrophobicContact CD2-CD2 4.07Å; L787-L796 HydrophobicContact CD1-CD2 4.18Å; L787-L796 HydrophobicContact CD1-CG 3.89Å; L787-L796 HydrophobicContact CD2-CD2 4.28Å; L787-L796 HydrophobicContact CG-CD1 4.15Å; L787-L796 HydrophobicContact CG-CD2 4.06Å; L787-L796 HydrophobicContact CG-CG 3.93Å; L796-A798 PolarHBondContact O-N 3.48Å; L796-T802 HydrophobicContact CD1-CG2 4.48Å
797	D	82.4	Confident	82.2	Confident	20 Å²	20	65.8 Å²	65.8	11%	0.107	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-60.5	118.7	176.2	-167	-40.3	0	0	0	111	V665 A666 K709 S799 L800	V665-D797 HydrophobicContact CG1-CB 3.87Å; A666-D797 PolarHBondContact O-N 2.64Å; K709-D797 WeakPolarHBondContact CE-OD2 3.49Å; K709-D797 IonicContact NZ-OD2 2.78Å; K709-D797 PolarHBondContact NZ-OD2 3.11Å; D797-S799 VanDerWaalsContact CG-OG 3.29Å; D797-S799 PolarHBondContact O-N 2.89Å; D797-S799 VanDerWaalsContact OD1-CB 3.27Å; D797-S799 WeakPolarHBondContact OD1-CB 3.35Å; D797-S799 PolarHBondContact OD1-N 3.33Å; D797-S799 PolarHBondContact OD1-OG 3.05Å; D797-L800 HydrophobicContact CB-CD1 4.27Å; D797-L800 HydrophobicContact CB-CG 4.42Å; D797-L800 PolarHBondContact O-N 3.47Å; D797-L800 VanDerWaalsContact O-N 3.13Å
798	A	76.6	Confident	82.1	Confident	77 Å²	77	65 Å²	65	64%	0.636	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-11.5	-175.4	0	0	0	0	0	113.3	F25 L796 L800	F25-A798 HydrophobicContact CD2-CB 3.71Å; F25-A798 HydrophobicContact CE2-CB 3.4Å; F25-A798 VanDerWaalsContact CE2-N 3.34Å; F25-A798 HydrophobicContact CZ-CB 4.29Å; L796-A798 PolarHBondContact O-N 3.48Å; A798-L800 VanDerWaalsContact C-N 3.28Å
799	S	75.9	Confident	81.9	Confident	89 Å²	89	62.4 Å²	62.4	62%	0.622	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-17.4	172.7	69.9	0	0	0	0	112.8	D797	D797-S799 VanDerWaalsContact CG-OG 3.29Å; D797-S799 PolarHBondContact O-N 2.89Å; D797-S799 VanDerWaalsContact OD1-CB 3.27Å; D797-S799 WeakPolarHBondContact OD1-CB 3.35Å; D797-S799 PolarHBondContact OD1-N 3.33Å; D797-S799 PolarHBondContact OD1-OG 3.05Å
800	L	84.1	Confident	81.9	Confident	52 Å²	52	59.6 Å²	59.6	27%	0.272	35%	0.351	S	S	.	.	S	Bend	trans	-97.8	144	-178.8	-63.4	177.3	0	0	0	111.8	E667 T669 D797 A798	E667-L800 HydrophobicContact CB-CD1 3.92Å; E667-L800 HydrophobicContact CG-CD1 4.27Å; T669-L800 HydrophobicContact CG2-CD1 4.12Å; T669-L800 HydrophobicContact CG2-CD2 4.42Å; D797-L800 HydrophobicContact CB-CD1 4.27Å; D797-L800 HydrophobicContact CB-CG 4.42Å; D797-L800 PolarHBondContact O-N 3.47Å; D797-L800 VanDerWaalsContact O-N 3.13Å; A798-L800 VanDerWaalsContact C-N 3.28Å
801	P	86.3	Confident	82	Confident	82 Å²	82	53.2 Å²	53.2	53%	0.532	32%	0.323	S	S	.	.			trans	-72.9	139.7	179.4	29.8	-34.3	0	0	0	111.5	F785	F785-P801 WeakPolarHBondContact CE2-O 3.5Å; F785-P801 WeakPolarHBondContact CZ-O 3.38Å
802	T	88.5	Confident	82.2	Confident	80 Å²	80	52.2 Å²	52.2	49%	0.491	32%	0.317	S	S	.	.	S	Bend	trans	-98.3	4.2	173	53.4	0	0	0	0	113.3	F785 L796	F785-T802 WeakPolarHBondContact CD1-O 3.26Å; F785-T802 PolarHBondContact N-O 2.9Å; L796-T802 HydrophobicContact CD1-CG2 4.48Å
803	S	91.1	Very high	82.3	Confident	63 Å²	63	45.6 Å²	45.6	44%	0.441	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	147.2	174.4	67.8	0	0	0	0	112.8	L783	L783-S803 CarbonylContact O-C 3.58Å; L783-S803 WeakPolarHBondContact O-CA 3.06Å; L783-S803 WeakPolarHBondContact O-CB 3.37Å
804	I	90.4	Very high	82.1	Confident	38 Å²	38	44.8 Å²	44.8	20%	0.195	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	127.5	177.1	-61.5	176.4	0	0	0	108.1	S670 L783 F785 K806	S670-I804 WeakPolarHBondContact O-CD1 3.5Å; S670-I804 WeakPolarHBondContact OG-CD1 3.46Å; L783-I804 PolarHBondContact N-O 2.97Å; L783-I804 PolarHBondContact O-N 3.33Å; F785-I804 HydrophobicContact CE1-CD1 4.33Å; F785-I804 HydrophobicContact CE1-CG1 4.18Å; I804-K806 HydrophobicContact CG2-CG 4.48Å
805	T	89.8	Confident	81.2	Confident	77 Å²	77	51.5 Å²	51.5	47%	0.472	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	130.4	172.3	-61.5	0	0	0	0	110	N780 V781 T782	N780-T805 HydrophobicContact CB-CG2 4.44Å; V781-T805 WeakPolarHBondContact O-CA 2.97Å; T782-T805 WeakPolarHBondContact CG2-OG1 2.98Å; T782-T805 PolarHBondContact OG1-OG1 3.46Å
806	K	88.5	Confident	80.1	Confident	78 Å²	78	55.5 Å²	55.5	34%	0.339	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	153.6	167.9	-68.4	-164.3	170.9	-170.4	0	110.4	M672 L674 V781 I804	M672-K806 HydrophobicContact CE-CB 3.75Å; M672-K806 HydrophobicContact CE-CD 4.42Å; M672-K806 HydrophobicContact CE-CG 3.85Å; M672-K806 VanDerWaalsContact O-CD 3.23Å; M672-K806 WeakPolarHBondContact O-CD 3.42Å; M672-K806 WeakPolarHBondContact O-CE 3.45Å; M672-K806 PolarHBondContact O-NZ 3.46Å; L674-K806 HydrophobicContact CD1-CB 3.73Å; V781-K806 PolarHBondContact N-O 2.86Å; V781-K806 PolarHBondContact O-N 2.89Å; I804-K806 HydrophobicContact CG2-CG 4.48Å
807	T	85.8	Confident	79	Confident	74 Å²	74	59.3 Å²	59.3	45%	0.454	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	144.7	-179.3	59.2	0	0	0	0	110.5	I779 N780	I779-T807 CarbonylContact O-C 3.55Å; I779-T807 VanDerWaalsContact O-CA 3.27Å; I779-T807 WeakPolarHBondContact O-CA 3.48Å; N780-T807 VanDerWaalsContact OD1-CG2 3.27Å; N780-T807 WeakPolarHBondContact OD1-CG2 3.49Å
808	I	85.1	Confident	78.4	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	112.1	172.4	-52.4	177.8	0	0	0	108.3	L674 I679 V698 F767 P778 I779 V781	L674-I808 HydrophobicContact CB-CD1 4.32Å; L674-I808 HydrophobicContact CB-CG1 4.45Å; L674-I808 HydrophobicContact CD1-CD1 3.94Å; L674-I808 HydrophobicContact CD1-CG1 3.59Å; L674-I808 HydrophobicContact CD2-CD1 4.43Å; L674-I808 HydrophobicContact CG-CD1 4.46Å; I679-I808 HydrophobicContact CD1-CG2 3.73Å; I679-I808 HydrophobicContact CG1-CG2 3.73Å; V698-I808 HydrophobicContact CG1-CD1 3.79Å; V698-I808 HydrophobicContact CG2-CD1 4.21Å; F767-I808 HydrophobicContact CZ-CD1 3.75Å; P778-I808 CarbonylContact C-O 3.48Å; P778-I808 VanDerWaalsContact CA-O 3.26Å; P778-I808 WeakPolarHBondContact CA-O 3.44Å; P778-I808 WeakPolarHBondContact CB-O 3.33Å; I779-I808 HydrophobicContact CB-CB 4.32Å; I779-I808 PolarHBondContact N-O 2.84Å; I779-I808 PolarHBondContact O-N 2.77Å; V781-I808 HydrophobicContact CG2-CD1 4.2Å; V781-I808 HydrophobicContact CG2-CG1 4.47Å
809	P	79.1	Confident	78.2	Confident	10 Å²	10	60.7 Å²	60.7	7%	0.065	35%	0.346	C	S	.	.			trans	-70.9	144.4	178.2	29.7	-35.4	0	0	0	112.1	A677 K678 I679 D929	A677-P809 WeakPolarHBondContact O-CD 3.4Å; K678-P809 HydrophobicContact CB-CG 4.1Å; K678-P809 HydrophobicContact CD-CG 4.19Å; K678-P809 HydrophobicContact CG-CG 3.7Å; I679-P809 PolarHBondContact N-O 3.45Å; P809-D929 HydrophobicContact CB-CB 3.7Å; P809-D929 WeakPolarHBondContact CB-OD2 3.43Å; P809-D929 HydrophobicContact CG-CB 4.15Å
810	L	78.1	Confident	78.4	Confident	10 Å²	10	59.7 Å²	59.7	5%	0.052	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	126	175.5	-57.6	178.9	0	0	0	108.5	I679 M769 D777 I779	I679-L810 HydrophobicContact CB-CD2 3.98Å; I679-L810 HydrophobicContact CD1-CD2 4.48Å; I679-L810 HydrophobicContact CG2-CD2 4.29Å; M769-L810 HydrophobicContact CE-CD2 3.9Å; D777-L810 WeakPolarHBondContact O-CD1 3.49Å; I779-L810 HydrophobicContact CD1-CD2 4.11Å; I779-L810 HydrophobicContact CG1-CD1 4.4Å; I779-L810 HydrophobicContact CG1-CD2 4.32Å
811	V	75	Confident	78.5	Confident	14 Å²	14	57.2 Å²	57.2	9%	0.085	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	145	-179.9	-62.1	0	0	0	0	111.2	I679 N680 L681 Y858	I679-V811 PolarHBondContact O-N 3.48Å; N680-V811 WeakPolarHBondContact CA-O 3.32Å; N680-V811 HydrophobicContact CB-CG2 4.26Å; L681-V811 PolarHBondContact N-O 3.36Å; L681-V811 VanDerWaalsContact N-O 3.1Å; V811-Y858 HydrophobicContact CB-CD2 4.02Å; V811-Y858 HydrophobicContact CB-CE2 4.24Å; V811-Y858 HydrophobicContact CB-CG 4.47Å; V811-Y858 HydrophobicContact CG1-CD2 3.84Å; V811-Y858 HydrophobicContact CG1-CG 4.03Å
812	D	74.4	Confident	78.6	Confident	56 Å²	56	54.1 Å²	54.1	30%	0.299	30%	0.299	S	S	.	.			trans	-119.8	109.5	170.2	-171.9	-12.6	0	0	0	109.3	Q682 G814 Y858	Q682-D812 WeakPolarHBondContact CG-OD1 3.45Å; Q682-D812 PolarHBondContact NE2-OD2 3.01Å; Q682-D812 VanDerWaalsContact NE2-OD2 3.14Å; D812-G814 PolarHBondContact OD1-N 3.36Å; D812-G814 VanDerWaalsContact OD1-N 3.07Å; D812-Y858 PolarHBondContact N-OH 2.98Å; D812-Y858 WeakPolarHBondContact O-CE2 3.43Å; D812-Y858 PolarHBondContact O-OH 3.38Å
813	C	70.6	Confident	78.6	Confident	17 Å²	17	50.3 Å²	50.3	12%	0.115	28%	0.275	C	S	.	.			trans	-107.2	13	-176.6	-54.8	0	0	0	0	113.1	Q816 C819	C813-Q816 WeakPolarHBondContact CB-O 3.33Å; C813-Q816 WeakPolarHBondContact O-CB 3.05Å; C813-Q816 PolarHBondContact O-N 3.36Å; C813-C819 WeakPolarHBondContact CA-SG 3.24Å; C813-C819 HydrophobicContact CB-CB 4.11Å; C813-C819 WeakPolarHBondContact CB-SG 3.36Å; C813-C819 VanDerWaalsContact SG-CA 3.58Å; C813-C819 WeakPolarHBondContact SG-CB 3.03Å; C813-C819 PolarHBondContact SG-N 3.08Å; C813-C819 CovalentContact SG-SG 2.03Å; C813-C819 PolarHBondContact SG-SG 2.99Å
814	G	68.7	Low	78.6	Confident	32 Å²	32	48.3 Å²	48.3	33%	0.33	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	-139.5	-174.5	0	0	0	0	0	112.5	D812 Q816	D812-G814 PolarHBondContact OD1-N 3.36Å; D812-G814 VanDerWaalsContact OD1-N 3.07Å; G814-Q816 PolarHBondContact O-N 2.85Å
815	D	63	Low	78.7	Confident	158 Å²	158	47 Å²	47	85%	0.845	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-3.9	178.7	-60.8	-36.2	0	0	0	113.5
816	Q	62.7	Low	78.8	Confident	110 Å²	110	47.3 Å²	47.3	51%	0.514	26%	0.257	S	S	.	.	S	Bend	trans	-92.1	139.4	179.6	-59.4	-174.7	-2.8	0	0	111.3	C813 G814 K818	C813-Q816 WeakPolarHBondContact CB-O 3.33Å; C813-Q816 WeakPolarHBondContact O-CB 3.05Å; C813-Q816 PolarHBondContact O-N 3.36Å; G814-Q816 PolarHBondContact O-N 2.85Å; Q816-K818 VanDerWaalsContact C-N 3.26Å; Q816-K818 PolarHBondContact O-N 3.5Å
817	L	63	Low	79	Confident	109 Å²	109	43.9 Å²	43.9	57%	0.571	24%	0.243	S	C	*	.	S	Bend	trans	-66.7	-25.2	177.8	-86	144.2	0	0	0	113.4	Q685	Q685-L817 HydrophobicContact CG-CD2 4.48Å
818	K	68.7	Low	79.3	Confident	115 Å²	115	47.3 Å²	47.3	50%	0.5	25%	0.254	S	S	.	.	S	Bend	trans	-143.7	132.6	-175.1	-69.4	172.1	163.9	-124.4	0	110.4	Q816 E931	Q816-K818 VanDerWaalsContact C-N 3.26Å; Q816-K818 PolarHBondContact O-N 3.5Å; K818-E931 WeakPolarHBondContact CD-OE2 3.33Å; K818-E931 IonicContact NZ-OE1 3.08Å; K818-E931 PolarHBondContact NZ-OE1 3.34Å; K818-E931 IonicContact NZ-OE2 2.82Å; K818-E931 PolarHBondContact NZ-OE2 2.9Å
819	C	72.6	Confident	79.6	Confident	10 Å²	10	48.6 Å²	48.6	7%	0.068	27%	0.265	C	S	.	.			trans	-83.4	125.3	170.7	-65.7	0	0	0	0	109	C813 E931	C813-C819 WeakPolarHBondContact CA-SG 3.24Å; C813-C819 HydrophobicContact CB-CB 4.11Å; C813-C819 WeakPolarHBondContact CB-SG 3.36Å; C813-C819 VanDerWaalsContact SG-CA 3.58Å; C813-C819 WeakPolarHBondContact SG-CB 3.03Å; C813-C819 PolarHBondContact SG-N 3.08Å; C813-C819 CovalentContact SG-SG 2.03Å; C813-C819 PolarHBondContact SG-SG 2.99Å; C819-E931 PolarHBondContact O-N 2.9Å
820	I	81.9	Confident	80.1	Confident	68 Å²	68	51 Å²	51	35%	0.349	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	111	176.6	-56.9	177.8	0	0	0	110.4	R854 D855 E931	I820-R854 VanDerWaalsContact O-CB 3.29Å; I820-R854 WeakPolarHBondContact O-CB 3.37Å; I820-D855 PolarHBondContact N-OD2 2.89Å; I820-D855 VanDerWaalsContact N-OD2 3.09Å; I820-D855 WeakPolarHBondContact O-CB 3.26Å; I820-D855 PolarHBondContact O-N 2.81Å; I820-E931 CarbonylContact C-O 3.49Å; I820-E931 VanDerWaalsContact CA-O 3.26Å; I820-E931 WeakPolarHBondContact CA-O 3.49Å
821	T	84.9	Confident	80.5	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	163.1	178.6	54.8	0	0	0	0	111.8	D855 N856 A857 S930 E931 E932	T821-D855 WeakPolarHBondContact CG2-O 3.28Å; T821-N856 WeakPolarHBondContact CG2-O 3.33Å; T821-A857 HydrophobicContact CG2-CB 3.64Å; T821-S930 WeakPolarHBondContact OG1-CB 3.5Å; T821-E931 PolarHBondContact N-O 3.38Å; T821-E931 PolarHBondContact OG1-O 2.82Å; T821-E932 WeakPolarHBondContact O-CG 3.49Å
822	D	88.4	Confident	80.9	Confident	16 Å²	16	63.5 Å²	63.5	9%	0.086	34%	0.336	C	S	.	.			trans	-144	92.2	174.7	176.5	-25.2	0	0	0	105.3	N852 K853 R854	D822-N852 CarbonylContact O-C 3.49Å; D822-N852 WeakPolarHBondContact O-CA 3.26Å; D822-N852 PolarHBondContact O-OD1 2.82Å; D822-K853 HydrophobicContact CB-CB 4.07Å; D822-K853 PolarHBondContact O-N 2.91Å; D822-K853 IonicContact OD1-NZ 2.89Å; D822-K853 PolarHBondContact OD1-NZ 3.04Å; D822-K853 IonicContact OD2-NZ 3.71Å; D822-R854 HydrophobicContact CB-CB 4.08Å; D822-R854 HydrophobicContact CB-CG 3.7Å; D822-R854 IonicContact OD2-NE 2.82Å
823	L	89.8	Confident	81.4	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	155.1	177.5	-69.5	177.1	0	0	0	108.7	S851 N852 A857 T860 L897 T926 E932 N940	L823-S851 CarbonylContact C-O 3.46Å; L823-S851 WeakPolarHBondContact CA-O 3.42Å; L823-N852 HydrophobicContact CD2-CB 4Å; L823-A857 HydrophobicContact CD2-CB 3.85Å; L823-A857 HydrophobicContact CG-CB 4.43Å; L823-T860 HydrophobicContact CD1-CG2 4.04Å; L823-T860 HydrophobicContact CD2-CG2 4.19Å; L823-L897 HydrophobicContact CD2-CD2 3.98Å; L823-T926 HydrophobicContact CB-CG2 3.86Å; L823-T926 HydrophobicContact CD1-CG2 4.07Å; L823-E932 PolarHBondContact N-OE1 3.27Å; L823-N940 WeakPolarHBondContact CB-OD1 3.4Å; L823-N940 PolarHBondContact O-OD1 2.95Å
824	S	90.7	Very high	82.1	Confident	22 Å²	22	64.9 Å²	64.9	15%	0.154	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	127.1	178.2	-166	0	0	0	0	108.9	I850 S851 D939	S824-I850 CarbonylContact O-C 3.5Å; S824-I850 WeakPolarHBondContact O-CA 3.43Å; S824-S851 PolarHBondContact N-O 3.46Å; S824-S851 PolarHBondContact O-N 3.03Å; S824-D939 VanDerWaalsContact CB-OD2 3.26Å; S824-D939 WeakPolarHBondContact CB-OD2 3.34Å; S824-D939 PolarHBondContact OG-OD2 3.21Å
825	L	92.9	Very high	82.7	Confident	10 Å²	10	66.3 Å²	66.3	5%	0.052	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	130.4	-170.4	178.2	77.2	0	0	0	110.8	I848 I850 V924 T926 D939 N940 K942	L825-I848 HydrophobicContact CD1-CG2 3.5Å; L825-I850 HydrophobicContact CD1-CD1 4.25Å; L825-I850 HydrophobicContact CD1-CG1 3.48Å; L825-I850 VanDerWaalsContact CD1-CG1 3.48Å; L825-V924 HydrophobicContact CD1-CG1 4.14Å; L825-V924 HydrophobicContact CD2-CB 4.01Å; L825-V924 HydrophobicContact CD2-CG1 3.75Å; L825-V924 WeakPolarHBondContact CD2-O 3.32Å; L825-V924 HydrophobicContact CG-CG1 4.48Å; L825-T926 HydrophobicContact CB-CG2 4.09Å; L825-D939 PolarHBondContact N-O 2.93Å; L825-N940 WeakPolarHBondContact CD2-O 3.23Å; L825-K942 HydrophobicContact CD2-CB 4.3Å
826	T	91.3	Very high	83.5	Confident	83 Å²	83	58.8 Å²	58.8	51%	0.509	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	133.4	165.9	52.9	0	0	0	0	109.9	D849	T826-D849 PolarHBondContact N-O 3.39Å; T826-D849 PolarHBondContact O-N 3.21Å; T826-D849 WeakPolarHBondContact OG1-CB 3.33Å; T826-D849 PolarHBondContact OG1-O 2.67Å
827	A	92.3	Very high	84.2	Confident	6 Å²	6	57.2 Å²	57.2	5%	0.05	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	136.5	-179.8	0	0	0	0	0	111.3	V846 K847 I848 V924 K942 I944	A827-V846 HydrophobicContact CB-CG1 4.47Å; A827-K847 CarbonylContact C-O 3.49Å; A827-K847 VanDerWaalsContact CA-O 3.26Å; A827-K847 WeakPolarHBondContact CA-O 3.22Å; A827-I848 HydrophobicContact CB-CG1 4.22Å; A827-V924 HydrophobicContact CB-CB 4.39Å; A827-V924 HydrophobicContact CB-CG2 4.17Å; A827-K942 HydrophobicContact CB-CB 4.29Å; A827-K942 HydrophobicContact CB-CG 4.15Å; A827-I944 HydrophobicContact CB-CD1 4Å
828	E	92.5	Very high	84.4	Confident	146 Å²	146	53.7 Å²	53.7	68%	0.682	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.1	133.3	-178.8	-66.2	-174.2	171	0	0	110.8	K847	E828-K847 PolarHBondContact N-O 3.01Å; E828-K847 PolarHBondContact O-N 3.46Å
829	A	91.8	Very high	84.2	Confident	28 Å²	28	54.3 Å²	54.3	23%	0.231	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	150.8	174.1	0	0	0	0	0	111.8	E831 L844 I944 I946	A829-E831 VanDerWaalsContact C-N 3.29Å; A829-E831 PolarHBondContact O-N 2.89Å; A829-L844 HydrophobicContact CB-CD1 4.31Å; A829-I944 HydrophobicContact CB-CG2 3.85Å; A829-I946 HydrophobicContact CB-CD1 3.73Å; A829-I946 HydrophobicContact CB-CG1 4.4Å
830	S	89.1	Confident	83.9	Confident	59 Å²	59	55.1 Å²	55.1	41%	0.413	30%	0.297	S	S	.	.	S	Bend	trans	-65.7	-32.2	176.5	58.5	0	0	0	0	113	D845	S830-D845 WeakPolarHBondContact CB-O 3.29Å; S830-D845 PolarHBondContact N-O 2.97Å; S830-D845 PolarHBondContact OG-N 2.97Å; S830-D845 PolarHBondContact OG-O 3Å
831	E	86.1	Confident	83.6	Confident	99 Å²	99	58.8 Å²	58.8	46%	0.463	31%	0.311	S	S	.	.			trans	-119.9	143.6	-176.8	-62.8	-58.8	154.5	0	0	111.4	A829 L844	A829-E831 VanDerWaalsContact C-N 3.29Å; A829-E831 PolarHBondContact O-N 2.89Å; E831-L844 HydrophobicContact CB-CD1 4.31Å
832	K	84.1	Confident	83.4	Confident	188 Å²	188	60.9 Å²	60.9	82%	0.817	32%	0.322	S	S	*	.	S	Bend	trans	-96.1	-14.6	176.7	-66.3	-174.7	179.5	-178.9	0	113.6	P947	K832-P947 VanDerWaalsContact O-CD 3.31Å; K832-P947 WeakPolarHBondContact O-CD 3.42Å
833	S	85.6	Confident	83.4	Confident	77 Å²	77	66.6 Å²	66.6	54%	0.538	35%	0.346	S	S	.	.	S	Bend	trans	-161.9	147.9	176.3	58.7	0	0	0	0	108.9	P947	S833-P947 WeakPolarHBondContact CA-O 3.32Å
834	M	83.9	Confident	83.4	Confident	25 Å²	25	66.6 Å²	66.6	12%	0.123	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	144.9	-175.6	-148.8	169.5	76.8	0	0	113.2	I836 T911 I920 P947 V948 K949	M834-I836 HydrophobicContact CE-CD1 4.06Å; M834-I836 HydrophobicContact CE-CG1 3.55Å; M834-T911 HydrophobicContact CE-CG2 3.04Å; M834-T911 HydrophobicContact SD-CG2 4.48Å; M834-I920 HydrophobicContact CE-CD1 4.35Å; M834-P947 PolarHBondContact N-O 2.78Å; M834-P947 VanDerWaalsContact N-O 3.1Å; M834-V948 WeakPolarHBondContact O-CA 3.28Å; M834-K949 PolarHBondContact O-N 2.82Å
835	L	82.4	Confident	83.5	Confident	62 Å²	62	66.4 Å²	66.4	33%	0.325	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	111.9	168.2	178.8	67.1	0	0	0	107.4	K949 E1113	L835-K949 CarbonylContact C-O 3.41Å; L835-K949 WeakPolarHBondContact CA-O 3.41Å; L835-K949 HydrophobicContact CD1-CB 3.77Å; L835-E1113 HydrophobicContact CD1-CB 4.34Å
836	I	79.5	Confident	83.5	Confident	1 Å²	1	66 Å²	66	1%	0.005	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	117.5	177.8	-64.4	178	0	0	0	108.2	M834 T911 V948 K949 Y950 E951	M834-I836 HydrophobicContact CE-CD1 4.06Å; M834-I836 HydrophobicContact CE-CG1 3.55Å; I836-T911 HydrophobicContact CD1-CG2 3.77Å; I836-T911 HydrophobicContact CG1-CG2 3.85Å; I836-V948 HydrophobicContact CB-CG1 4.44Å; I836-V948 HydrophobicContact CD1-CG1 3.43Å; I836-V948 VanDerWaalsContact CD1-CG1 3.43Å; I836-V948 HydrophobicContact CG1-CG1 3.65Å; I836-K949 PolarHBondContact N-O 3.39Å; I836-Y950 HydrophobicContact CB-CD1 4.01Å; I836-Y950 HydrophobicContact CB-CE1 4.28Å; I836-Y950 HydrophobicContact CD1-CD1 4.3Å; I836-Y950 HydrophobicContact CD1-CE1 3.69Å; I836-Y950 HydrophobicContact CG2-CD1 4.2Å; I836-Y950 HydrophobicContact CG2-CE1 4.43Å; I836-E951 PolarHBondContact O-N 3.45Å
837	H	76.8	Confident	83.7	Confident	76 Å²	76	66.7 Å²	66.7	35%	0.352	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-79.2	148.9	174	-60.2	-88.7	0	0	0	111.1	N839 S840 D842 E951	H837-N839 PolarHBondContact O-N 3.17Å; H837-S840 WeakPolarHBondContact CA-OG 3.27Å; H837-S840 VanDerWaalsContact CB-OG 3.28Å; H837-S840 WeakPolarHBondContact CB-OG 3.33Å; H837-S840 PolarHBondContact N-OG 3.47Å; H837-S840 PolarHBondContact O-N 3.1Å; H837-S840 PolarHBondContact O-OG 3.33Å; H837-D842 IonicContact CD2-OD2 2.8Å; H837-D842 PolarHBondContact N-OD2 2.95Å; H837-E951 IonicContact CE1-OE2 3.9Å; H837-E951 IonicContact CG-OE2 3.7Å; H837-E951 IonicContact ND1-OE2 3.58Å; H837-E951 PolarHBondContact ND1-OE2 3.46Å
838	V	66.4	Low	83.8	Confident	35 Å²	35	66.4 Å²	66.4	21%	0.212	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	124	178.5	164.6	0	0	0	0	109.6	S840 E951 T999	V838-S840 PolarHBondContact O-N 3.23Å; V838-E951 WeakPolarHBondContact CG2-O 3.44Å; V838-T999 HydrophobicContact CB-CG2 4.41Å; V838-T999 HydrophobicContact CG1-CG2 3.38Å; V838-T999 HydrophobicContact CG2-CG2 4.09Å
839	N	64.4	Low	83.7	Confident	128 Å²	128	61.9 Å²	61.9	68%	0.684	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	16.4	-175.7	-52.1	-32.6	0	0	0	114	H837	H837-N839 PolarHBondContact O-N 3.17Å
840	S	67.7	Low	83.8	Confident	28 Å²	28	60.6 Å²	60.6	20%	0.196	31%	0.305	C	S	.	.			trans	-84.4	150.6	165.5	66.2	0	0	0	0	110.6	H837 V838 D842	H837-S840 WeakPolarHBondContact CA-OG 3.27Å; H837-S840 VanDerWaalsContact CB-OG 3.28Å; H837-S840 WeakPolarHBondContact CB-OG 3.33Å; H837-S840 PolarHBondContact N-OG 3.47Å; H837-S840 PolarHBondContact O-N 3.1Å; H837-S840 PolarHBondContact O-OG 3.33Å; V838-S840 PolarHBondContact O-N 3.23Å; S840-D842 PolarHBondContact OG-OD1 2.99Å; S840-D842 PolarHBondContact OG-OD2 3.19Å
841	K	74.3	Confident	83.9	Confident	145 Å²	145	58.9 Å²	58.9	63%	0.63	29%	0.292	S	S	*	.			trans	-104.4	58.3	173.6	-65.7	-178.6	156.4	-101.7	0	108.4	E910	K841-E910 HydrophobicContact CB-CG 3.9Å; K841-E910 WeakPolarHBondContact CB-OE1 3.4Å; K841-E910 WeakPolarHBondContact CD-OE1 3.44Å; K841-E910 VanDerWaalsContact CE-OE1 3.27Å; K841-E910 WeakPolarHBondContact CE-OE1 3.17Å; K841-E910 HydrophobicContact CG-CG 4.43Å; K841-E910 WeakPolarHBondContact CG-OE1 3.26Å; K841-E910 IonicContact NZ-OE1 3.52Å; K841-E910 PolarHBondContact NZ-OE1 2.9Å
842	D	82.4	Confident	84.1	Confident	45 Å²	45	54.2 Å²	54.2	24%	0.241	27%	0.271	C	S	.	.			trans	-64.6	138.2	-177.5	-65.1	-36.2	0	0	0	109.4	H837 S840 E910 T911	H837-D842 IonicContact CD2-OD2 2.8Å; H837-D842 PolarHBondContact N-OD2 2.95Å; S840-D842 PolarHBondContact OG-OD1 2.99Å; S840-D842 PolarHBondContact OG-OD2 3.19Å; D842-E910 WeakPolarHBondContact O-CA 3.44Å; D842-T911 HydrophobicContact CB-CG2 4.22Å; D842-T911 PolarHBondContact N-OG1 2.69Å; D842-T911 PolarHBondContact O-N 3.03Å; D842-T911 PolarHBondContact O-OG1 3.42Å
843	K	87.6	Confident	84.2	Confident	135 Å²	135	49.5 Å²	49.5	59%	0.587	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.1	130.9	-170.1	-67.6	172.2	-179.5	173.4	0	110.2	F909	K843-F909 WeakPolarHBondContact CA-O 3.49Å
844	L	90.6	Very high	84.2	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	124.4	175	172.3	67.8	0	0	0	108.8	A829 E831 I870 F909 I920 I922 I946	A829-L844 HydrophobicContact CB-CD1 4.31Å; E831-L844 HydrophobicContact CB-CD1 4.31Å; L844-I870 HydrophobicContact CD2-CD1 4.43Å; L844-F909 HydrophobicContact CB-CB 4.28Å; L844-F909 PolarHBondContact N-O 2.79Å; L844-F909 PolarHBondContact O-N 2.82Å; L844-I920 HydrophobicContact CD2-CD1 4.36Å; L844-I920 HydrophobicContact CD2-CG2 4.47Å; L844-I922 HydrophobicContact CD2-CD1 3.96Å; L844-I946 HydrophobicContact CD1-CD1 3.69Å; L844-I946 HydrophobicContact CD2-CD1 3.57Å; L844-I946 HydrophobicContact CG-CD1 4.26Å
845	D	92.3	Very high	84.2	Confident	19 Å²	19	53 Å²	53	10%	0.102	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	133.3	176.8	-69.7	-21.2	0	0	0	110.9	S830 K906 V907 R908	S830-D845 WeakPolarHBondContact CB-O 3.29Å; S830-D845 PolarHBondContact N-O 2.97Å; S830-D845 PolarHBondContact OG-N 2.97Å; S830-D845 PolarHBondContact OG-O 3Å; D845-K906 HydrophobicContact CB-CD 3.6Å; D845-K906 HydrophobicContact CB-CG 3.86Å; D845-K906 VanDerWaalsContact CB-NZ 3.35Å; D845-K906 WeakPolarHBondContact OD2-CD 3.21Å; D845-K906 WeakPolarHBondContact OD2-CE 3.41Å; D845-K906 IonicContact OD2-NZ 3.28Å; D845-K906 PolarHBondContact OD2-NZ 2.78Å; D845-V907 CarbonylContact C-O 3.36Å; D845-V907 WeakPolarHBondContact CA-O 3.04Å; D845-R908 VanDerWaalsContact OD1-CB 3.26Å; D845-R908 WeakPolarHBondContact OD1-CB 3.23Å; D845-R908 WeakPolarHBondContact OD1-CG 3.23Å; D845-R908 IonicContact OD1-CZ 4Å; D845-R908 IonicContact OD1-NE 3.48Å; D845-R908 PolarHBondContact OD1-NE 2.68Å; D845-R908 IonicContact OD1-NH2 2.67Å; D845-R908 IonicContact OD2-CZ 2.79Å; D845-R908 IonicContact OD2-NE 2.74Å; D845-R908 IonicContact OD2-NH2 3.45Å; D845-R908 PolarHBondContact OD2-NH2 2.86Å; D845-R908 VanDerWaalsContact OD2-NH2 3.12Å
846	V	93.6	Very high	84.3	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	118.4	174.6	-179.6	0	0	0	0	109.3	A827 I848 K906 V907 F909 I922 I944	A827-V846 HydrophobicContact CB-CG1 4.47Å; V846-I848 HydrophobicContact CG1-CD1 4.45Å; V846-I848 HydrophobicContact CG1-CG1 4.03Å; V846-K906 CarbonylContact O-C 3.48Å; V846-K906 WeakPolarHBondContact O-CA 2.92Å; V846-V907 PolarHBondContact N-O 2.79Å; V846-V907 PolarHBondContact O-N 3.49Å; V846-F909 HydrophobicContact CB-CE2 4.27Å; V846-F909 HydrophobicContact CG2-CD2 4.04Å; V846-F909 HydrophobicContact CG2-CE2 3.81Å; V846-I922 HydrophobicContact CG2-CD1 3.7Å; V846-I944 HydrophobicContact CG1-CD1 3.5Å; V846-I944 VanDerWaalsContact CG1-CD1 3.5Å; V846-I944 HydrophobicContact CG2-CD1 4.39Å
847	K	93.9	Very high	84.5	Confident	98 Å²	98	52.4 Å²	52.4	43%	0.426	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	130.8	173.9	-173.9	-175.1	173.1	-157.6	0	109.4	A827 E828 D849 S904	A827-K847 CarbonylContact C-O 3.49Å; A827-K847 VanDerWaalsContact CA-O 3.26Å; A827-K847 WeakPolarHBondContact CA-O 3.22Å; E828-K847 PolarHBondContact N-O 3.01Å; E828-K847 PolarHBondContact O-N 3.46Å; K847-D849 VanDerWaalsContact CE-OD2 3.3Å; K847-D849 WeakPolarHBondContact CE-OD2 3.42Å; K847-D849 IonicContact NZ-OD1 3.7Å; K847-D849 IonicContact NZ-OD2 3.82Å; K847-D849 PolarHBondContact NZ-OD2 2.79Å; K847-S904 WeakPolarHBondContact CE-OG 3.39Å
848	I	94.1	Very high	84.7	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	124.7	-176.8	-57.2	174.1	0	0	0	108.6	L825 A827 V846 I850 V862 L864 S904 F905 V907 V924	L825-I848 HydrophobicContact CD1-CG2 3.5Å; A827-I848 HydrophobicContact CB-CG1 4.22Å; V846-I848 HydrophobicContact CG1-CD1 4.45Å; V846-I848 HydrophobicContact CG1-CG1 4.03Å; I848-I850 HydrophobicContact CG2-CD1 3.99Å; I848-I850 HydrophobicContact CG2-CG1 4.09Å; I848-V862 HydrophobicContact CD1-CG1 4.34Å; I848-L864 HydrophobicContact CD1-CD2 3.8Å; I848-L864 HydrophobicContact CD1-CG 4.37Å; I848-S904 WeakPolarHBondContact O-CA 3.48Å; I848-F905 HydrophobicContact CB-CE1 4.44Å; I848-F905 HydrophobicContact CB-CE2 4.24Å; I848-F905 HydrophobicContact CB-CZ 4.18Å; I848-F905 HydrophobicContact CD1-CE2 3.9Å; I848-F905 HydrophobicContact CD1-CZ 4.21Å; I848-F905 HydrophobicContact CG2-CE1 4.31Å; I848-F905 HydrophobicContact CG2-CZ 4.13Å; I848-F905 PolarHBondContact N-O 3.33Å; I848-F905 PolarHBondContact O-N 3.2Å; I848-V907 HydrophobicContact CD1-CG2 3.93Å; I848-V924 HydrophobicContact CD1-CG1 3.87Å; I848-V924 HydrophobicContact CD1-CG2 4.45Å; I848-V924 HydrophobicContact CG1-CG1 4.41Å; I848-V924 HydrophobicContact CG2-CG1 4.33Å
849	D	92.1	Very high	85.4	Confident	51 Å²	51	49.4 Å²	49.4	27%	0.273	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123.7	178.2	-69.6	-59.4	0	0	0	108.5	T826 K847 E903 S904	T826-D849 PolarHBondContact N-O 3.39Å; T826-D849 PolarHBondContact O-N 3.21Å; T826-D849 WeakPolarHBondContact OG1-CB 3.33Å; T826-D849 PolarHBondContact OG1-O 2.67Å; K847-D849 VanDerWaalsContact CE-OD2 3.3Å; K847-D849 WeakPolarHBondContact CE-OD2 3.42Å; K847-D849 IonicContact NZ-OD1 3.7Å; K847-D849 IonicContact NZ-OD2 3.82Å; K847-D849 PolarHBondContact NZ-OD2 2.79Å; D849-E903 WeakPolarHBondContact CA-O 3.23Å; D849-S904 WeakPolarHBondContact OD1-CB 3.44Å; D849-S904 PolarHBondContact OD1-OG 2.97Å
850	I	92.6	Very high	86.4	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.01	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	139.4	-178.1	-61.1	144.4	0	0	0	108.9	S824 L825 I848 V862 V892 L897 K902 E903 F905	S824-I850 CarbonylContact O-C 3.5Å; S824-I850 WeakPolarHBondContact O-CA 3.43Å; L825-I850 HydrophobicContact CD1-CD1 4.25Å; L825-I850 HydrophobicContact CD1-CG1 3.48Å; L825-I850 VanDerWaalsContact CD1-CG1 3.48Å; I848-I850 HydrophobicContact CG2-CD1 3.99Å; I848-I850 HydrophobicContact CG2-CG1 4.09Å; I850-V862 HydrophobicContact CD1-CG2 3.18Å; I850-V862 HydrophobicContact CG1-CG2 4.24Å; I850-V892 HydrophobicContact CD1-CB 4.45Å; I850-V892 HydrophobicContact CD1-CG1 3.96Å; I850-V892 HydrophobicContact CD1-CG2 3.96Å; I850-L897 HydrophobicContact CG2-CD2 3.84Å; I850-K902 CarbonylContact O-C 3.25Å; I850-K902 VanDerWaalsContact O-CA 3.27Å; I850-K902 WeakPolarHBondContact O-CA 3.47Å; I850-E903 PolarHBondContact N-O 3.12Å; I850-E903 PolarHBondContact O-N 3.46Å; I850-F905 HydrophobicContact CD1-CE1 3.66Å; I850-F905 HydrophobicContact CD1-CZ 4.28Å
851	S	90.8	Very high	87.4	Confident	22 Å²	22	44.8 Å²	44.8	15%	0.154	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	144.6	174	65.5	0	0	0	0	111.3	L823 S824 A901	L823-S851 CarbonylContact C-O 3.46Å; L823-S851 WeakPolarHBondContact CA-O 3.42Å; S824-S851 PolarHBondContact N-O 3.46Å; S824-S851 PolarHBondContact O-N 3.03Å; S851-A901 WeakPolarHBondContact CA-O 3.48Å
852	N	90.4	Very high	88.3	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	117	171.9	177.8	11	0	0	0	109.1	D822 L823 R854 D855 A857 L897 G898 K900 A901	D822-N852 CarbonylContact O-C 3.49Å; D822-N852 WeakPolarHBondContact O-CA 3.26Å; D822-N852 PolarHBondContact O-OD1 2.82Å; L823-N852 HydrophobicContact CD2-CB 4Å; N852-R854 PolarHBondContact OD1-N 3.18Å; N852-D855 PolarHBondContact ND2-O 2.84Å; N852-D855 PolarHBondContact OD1-O 2.94Å; N852-A857 PolarHBondContact ND2-N 3.29Å; N852-L897 HydrophobicContact CB-CD2 3.76Å; N852-L897 HydrophobicContact CB-CG 3.89Å; N852-L897 PolarHBondContact ND2-O 2.8Å; N852-G898 PolarHBondContact ND2-O 3.2Å; N852-K900 CarbonylContact O-C 3.13Å; N852-K900 WeakPolarHBondContact O-CA 3.43Å; N852-K900 PolarHBondContact O-N 3.3Å; N852-A901 PolarHBondContact N-O 3.44Å
853	K	86.6	Confident	88.7	Confident	89 Å²	89	37.4 Å²	37.4	39%	0.387	17%	0.173	S	C	.	.			trans	-88.6	-17.1	-173	-55.8	-177.7	-153.8	115.7	0	113.7	D822 D939	D822-K853 HydrophobicContact CB-CB 4.07Å; D822-K853 PolarHBondContact O-N 2.91Å; D822-K853 IonicContact OD1-NZ 2.89Å; D822-K853 PolarHBondContact OD1-NZ 3.04Å; D822-K853 IonicContact OD2-NZ 3.71Å; K853-D939 IonicContact NZ-OD2 3.68Å; K853-D939 PolarHBondContact NZ-OD2 2.97Å
854	R	85.3	Confident	88.9	Confident	117 Å²	117	31 Å²	31	44%	0.442	15%	0.145	S	C	.	.	S	Bend	trans	-123.1	-133.4	-172.5	-68.3	-172.2	-177	-153.7	-2.4	113	I820 D822 N852 S899	I820-R854 VanDerWaalsContact O-CB 3.29Å; I820-R854 WeakPolarHBondContact O-CB 3.37Å; D822-R854 HydrophobicContact CB-CB 4.08Å; D822-R854 HydrophobicContact CB-CG 3.7Å; D822-R854 IonicContact OD2-NE 2.82Å; N852-R854 PolarHBondContact OD1-N 3.18Å; R854-S899 WeakPolarHBondContact O-CA 3.34Å; R854-S899 WeakPolarHBondContact O-CB 3.38Å; R854-S899 PolarHBondContact O-OG 2.9Å
855	D	84.9	Confident	89	Confident	59 Å²	59	33.8 Å²	33.8	32%	0.316	17%	0.165	S	C	.	.	S	Bend	trans	-70.2	175.4	-176.4	-59.5	-29.1	0	0	0	111.4	I820 T821 N852 A857	I820-D855 PolarHBondContact N-OD2 2.89Å; I820-D855 VanDerWaalsContact N-OD2 3.09Å; I820-D855 WeakPolarHBondContact O-CB 3.26Å; I820-D855 PolarHBondContact O-N 2.81Å; T821-D855 WeakPolarHBondContact CG2-O 3.28Å; N852-D855 PolarHBondContact ND2-O 2.84Å; N852-D855 PolarHBondContact OD1-O 2.94Å; D855-A857 PolarHBondContact O-N 2.93Å
856	N	84.4	Confident	89	Confident	50 Å²	50	33.4 Å²	33.4	27%	0.267	16%	0.162	S	C	.	.			trans	-63.7	133	-178.4	-64.5	-22.3	0	0	0	112.5	T821 Y858 F896 G898 S899 S930	T821-N856 WeakPolarHBondContact CG2-O 3.33Å; N856-Y858 HydrophobicContact CB-CE2 4.02Å; N856-F896 HydrophobicContact CB-CD2 3.9Å; N856-F896 HydrophobicContact CB-CG 4.43Å; N856-G898 WeakPolarHBondContact OD1-CA 3.43Å; N856-S899 PolarHBondContact OD1-N 2.89Å; N856-S930 PolarHBondContact O-OG 3.28Å
857	A	84.3	Confident	88.9	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	102.3	176	0	0	0	0	0	111.4	T821 L823 N852 D855 T860 F896 L897	T821-A857 HydrophobicContact CG2-CB 3.64Å; L823-A857 HydrophobicContact CD2-CB 3.85Å; L823-A857 HydrophobicContact CG-CB 4.43Å; N852-A857 PolarHBondContact ND2-N 3.29Å; D855-A857 PolarHBondContact O-N 2.93Å; A857-T860 VanDerWaalsContact CB-OG1 3.27Å; A857-T860 WeakPolarHBondContact CB-OG1 2.87Å; A857-T860 PolarHBondContact O-OG1 2.91Å; A857-F896 CarbonylContact O-C 3.56Å; A857-F896 WeakPolarHBondContact O-CA 3.34Å; A857-F896 WeakPolarHBondContact O-CB 3.4Å; A857-L897 HydrophobicContact CB-CB 4.33Å; A857-L897 PolarHBondContact N-O 2.86Å; A857-L897 PolarHBondContact O-N 3.01Å
858	Y	81.1	Confident	88.6	Confident	21 Å²	21	31.6 Å²	31.6	8%	0.082	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	138.8	-176.9	-70.2	-84.4	0	0	0	111.1	V811 D812 N856 T860 F896 D929 S930	V811-Y858 HydrophobicContact CB-CD2 4.02Å; V811-Y858 HydrophobicContact CB-CE2 4.24Å; V811-Y858 HydrophobicContact CB-CG 4.47Å; V811-Y858 HydrophobicContact CG1-CD2 3.84Å; V811-Y858 HydrophobicContact CG1-CG 4.03Å; D812-Y858 PolarHBondContact N-OH 2.98Å; D812-Y858 WeakPolarHBondContact O-CE2 3.43Å; D812-Y858 PolarHBondContact O-OH 3.38Å; N856-Y858 HydrophobicContact CB-CE2 4.02Å; Y858-T860 VanDerWaalsContact C-N 3.27Å; Y858-T860 PolarHBondContact O-N 3.11Å; Y858-F896 HydrophobicContact CD1-CB 3.68Å; Y858-F896 HydrophobicContact CD1-CD1 4.27Å; Y858-F896 HydrophobicContact CD1-CG 4.29Å; Y858-F896 HydrophobicContact CE1-CB 3.94Å; Y858-F896 AromaticContact CE1-CD1 3.83Å; Y858-F896 HydrophobicContact CE1-CD1 3.83Å; Y858-F896 HydrophobicContact CE1-CG 4.04Å; Y858-F896 HydrophobicContact CG-CB 4.14Å; Y858-D929 PolarHBondContact O-N 2.02Å; Y858-S930 PolarHBondContact N-OG 3Å
859	N	79.4	Confident	88.2	Confident	28 Å²	28	31.6 Å²	31.6	15%	0.15	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	47.9	178.6	-164.6	24.4	0	0	0	112	K861 P895 D929	N859-K861 WeakPolarHBondContact O-CG 3.16Å; N859-K861 PolarHBondContact O-N 3.15Å; N859-K861 VanDerWaalsContact OD1-CE 3.23Å; N859-K861 WeakPolarHBondContact OD1-CE 3.46Å; N859-P895 PolarHBondContact N-O 2.94Å; N859-D929 HydrophobicContact CB-CB 4.44Å; N859-D929 VanDerWaalsContact CB-OD2 3.22Å; N859-D929 WeakPolarHBondContact CB-OD2 3.3Å; N859-D929 PolarHBondContact ND2-OD2 3.22Å
860	T	86.4	Confident	88	Confident	2 Å²	2	29.2 Å²	29.2	1%	0.012	15%	0.148	C	C	.	.			trans	-67	128.5	178.9	-56.7	0	0	0	0	109.5	L823 A857 Y858 V892 L897 V927	L823-T860 HydrophobicContact CD1-CG2 4.04Å; L823-T860 HydrophobicContact CD2-CG2 4.19Å; A857-T860 VanDerWaalsContact CB-OG1 3.27Å; A857-T860 WeakPolarHBondContact CB-OG1 2.87Å; A857-T860 PolarHBondContact O-OG1 2.91Å; Y858-T860 VanDerWaalsContact C-N 3.27Å; Y858-T860 PolarHBondContact O-N 3.11Å; T860-V892 HydrophobicContact CG2-CB 4.44Å; T860-V892 PolarHBondContact O-N 2.91Å; T860-L897 HydrophobicContact CG2-CD2 4.46Å; T860-V927 CarbonylContact C-O 3.42Å; T860-V927 WeakPolarHBondContact CA-O 3.45Å
861	K	89.3	Confident	87.9	Confident	57 Å²	57	32.8 Å²	32.8	25%	0.248	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	148	-179.4	-50.4	-171.4	-173.7	174.5	0	111.3	N859 E889 C890 T926 V927	N859-K861 WeakPolarHBondContact O-CG 3.16Å; N859-K861 PolarHBondContact O-N 3.15Å; N859-K861 VanDerWaalsContact OD1-CE 3.23Å; N859-K861 WeakPolarHBondContact OD1-CE 3.46Å; K861-E889 HydrophobicContact CB-CG 4.27Å; K861-E889 HydrophobicContact CD-CG 3.88Å; K861-E889 WeakPolarHBondContact CD-OE1 3.38Å; K861-E889 WeakPolarHBondContact CE-OE1 2.98Å; K861-E889 IonicContact NZ-OE1 2.78Å; K861-E889 PolarHBondContact NZ-OE1 3.31Å; K861-C890 CarbonylContact C-O 3.53Å; K861-C890 WeakPolarHBondContact CA-O 3.34Å; K861-T926 CarbonylContact O-C 3.55Å; K861-T926 WeakPolarHBondContact O-CA 3.33Å; K861-T926 PolarHBondContact O-OG1 3.4Å; K861-V927 HydrophobicContact CB-CG2 4.06Å; K861-V927 PolarHBondContact N-O 3Å; K861-V927 PolarHBondContact O-N 3.12Å
862	V	91.6	Very high	87.9	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	121.3	172.9	177.9	0	0	0	0	108.2	I848 I850 L864 E889 C890 V892 F905 V924 T925	I848-V862 HydrophobicContact CD1-CG1 4.34Å; I850-V862 HydrophobicContact CD1-CG2 3.18Å; I850-V862 HydrophobicContact CG1-CG2 4.24Å; V862-L864 HydrophobicContact CG1-CD1 3.97Å; V862-L864 HydrophobicContact CG1-CG 4.39Å; V862-E889 CarbonylContact O-C 3.52Å; V862-E889 WeakPolarHBondContact O-CA 3.2Å; V862-C890 PolarHBondContact N-O 3.32Å; V862-C890 PolarHBondContact O-N 2.95Å; V862-V892 HydrophobicContact CB-CG2 4.34Å; V862-V892 HydrophobicContact CG2-CG2 3.54Å; V862-F905 HydrophobicContact CB-CZ 4.18Å; V862-F905 HydrophobicContact CG1-CZ 4.3Å; V862-F905 HydrophobicContact CG2-CE1 4.35Å; V862-F905 HydrophobicContact CG2-CZ 4.01Å; V862-V924 HydrophobicContact CG1-CG1 3.57Å; V862-T925 CarbonylContact C-O 3.34Å; V862-T925 WeakPolarHBondContact CA-O 3.49Å
863	I	91.8	Very high	87.9	Confident	34 Å²	34	37.3 Å²	37.3	17%	0.174	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	117.7	177.4	-61.4	172.1	0	0	0	107.2	K887 V888 E889 T925 V927	I863-K887 HydrophobicContact CG2-CD 4.18Å; I863-K887 HydrophobicContact CG2-CG 3.94Å; I863-V888 CarbonylContact C-O 3.58Å; I863-V888 WeakPolarHBondContact CA-O 3.47Å; I863-E889 HydrophobicContact CG1-CG 4.28Å; I863-T925 PolarHBondContact N-O 3.42Å; I863-T925 PolarHBondContact O-N 3.01Å; I863-V927 HydrophobicContact CD1-CG1 4.42Å; I863-V927 HydrophobicContact CD1-CG2 3.94Å; I863-V927 HydrophobicContact CG1-CG2 4.47Å
864	L	92.6	Very high	88.1	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	126.6	170.7	-59.1	95	0	0	0	108.4	I848 V862 F866 K887 V888 V907 F909 N923 V924	I848-L864 HydrophobicContact CD1-CD2 3.8Å; I848-L864 HydrophobicContact CD1-CG 4.37Å; V862-L864 HydrophobicContact CG1-CD1 3.97Å; V862-L864 HydrophobicContact CG1-CG 4.39Å; L864-F866 HydrophobicContact CB-CD1 4.47Å; L864-K887 CarbonylContact O-C 3.4Å; L864-K887 WeakPolarHBondContact O-CA 3.23Å; L864-V888 HydrophobicContact CB-CB 4.47Å; L864-V888 HydrophobicContact CD1-CB 4.39Å; L864-V888 HydrophobicContact CD1-CG1 4.42Å; L864-V888 PolarHBondContact N-O 3.43Å; L864-V888 PolarHBondContact O-N 2.86Å; L864-V907 HydrophobicContact CD1-CG2 4.47Å; L864-V907 HydrophobicContact CD2-CB 4.22Å; L864-V907 HydrophobicContact CD2-CG1 4.17Å; L864-V907 HydrophobicContact CD2-CG2 4.01Å; L864-F909 HydrophobicContact CD2-CE2 4.31Å; L864-F909 HydrophobicContact CD2-CZ 3.88Å; L864-N923 CarbonylContact C-O 3.17Å; L864-N923 WeakPolarHBondContact CA-O 3.48Å; L864-V924 HydrophobicContact CD2-CG2 4.33Å; L864-V924 HydrophobicContact CG-CG1 4.43Å; L864-V924 HydrophobicContact CG-CG2 4.46Å
865	S	92.3	Very high	88.5	Confident	59 Å²	59	32.2 Å²	32.2	41%	0.413	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	124.7	169.2	-176.7	0	0	0	0	108.3	T886 I922 N923	S865-T886 WeakPolarHBondContact CA-O 3.37Å; S865-I922 CarbonylContact O-C 3.55Å; S865-I922 WeakPolarHBondContact O-CA 3.21Å; S865-N923 PolarHBondContact N-O 2.9Å; S865-N923 PolarHBondContact O-N 3.01Å
866	F	92.5	Very high	88.7	Confident	11 Å²	11	32.7 Å²	32.7	5%	0.048	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	163.7	-175.4	49.8	-89.1	0	0	0	113.1	L864 I870 T886 V888 F909 Y921 I922	L864-F866 HydrophobicContact CB-CD1 4.47Å; F866-I870 HydrophobicContact CB-CD1 3.87Å; F866-I870 HydrophobicContact CB-CG1 4.17Å; F866-I870 HydrophobicContact CD2-CD1 4.28Å; F866-I870 HydrophobicContact CD2-CG1 3.87Å; F866-I870 WeakPolarHBondContact CD2-O 3.34Å; F866-I870 VanDerWaalsContact CE2-O 3.31Å; F866-I870 WeakPolarHBondContact CE2-O 3.29Å; F866-I870 HydrophobicContact CG-CD1 4.25Å; F866-I870 HydrophobicContact CG-CG1 4.32Å; F866-T886 WeakPolarHBondContact CD1-O 3.49Å; F866-T886 WeakPolarHBondContact CE1-O 3.44Å; F866-T886 PolarHBondContact N-O 2.83Å; F866-T886 WeakPolarHBondContact O-CB 3.35Å; F866-V888 HydrophobicContact CE1-CB 4.39Å; F866-V888 HydrophobicContact CE1-CG2 3.69Å; F866-V888 HydrophobicContact CZ-CG2 4.05Å; F866-F909 AromaticContact CD1-CE1 3.56Å; F866-F909 HydrophobicContact CD1-CE1 3.56Å; F866-F909 HydrophobicContact CD1-CZ 4.06Å; F866-F909 HydrophobicContact CD2-CE1 4.31Å; F866-F909 AromaticContact CE1-CE1 3.68Å; F866-F909 HydrophobicContact CE1-CE1 3.68Å; F866-F909 HydrophobicContact CE1-CZ 4.41Å; F866-F909 HydrophobicContact CE2-CE1 4.39Å; F866-F909 AromaticContact CG-CE1 3.9Å; F866-F909 HydrophobicContact CG-CE1 3.9Å; F866-F909 HydrophobicContact CZ-CE1 4.1Å; F866-Y921 CarbonylContact C-O 3.08Å; F866-Y921 WeakPolarHBondContact CA-O 3.38Å; F866-I922 HydrophobicContact CB-CG1 4.13Å; F866-I922 HydrophobicContact CB-CG2 4.49Å
867	T	90.8	Very high	88.7	Confident	18 Å²	18	34.4 Å²	34.4	11%	0.11	18%	0.184	C	C	.	.			trans	-73.1	152	175.1	38.6	0	0	0	0	112.6	N869 I870 I920 Y921	T867-N869 WeakPolarHBondContact CB-OD1 3.15Å; T867-N869 PolarHBondContact O-N 3.16Å; T867-N869 PolarHBondContact O-OD1 3.28Å; T867-N869 PolarHBondContact OG1-OD1 3.04Å; T867-I870 WeakPolarHBondContact O-CG1 3.23Å; T867-I870 PolarHBondContact O-N 3.47Å; T867-I920 WeakPolarHBondContact OG1-CA 3.48Å; T867-Y921 HydrophobicContact CG2-CD2 3.81Å; T867-Y921 HydrophobicContact CG2-CG 4.42Å; T867-Y921 PolarHBondContact N-O 2.97Å; T867-Y921 VanDerWaalsContact N-O 3.13Å; T867-Y921 PolarHBondContact OG1-N 3.24Å
868	P	86.5	Confident	88.7	Confident	43 Å²	43	43.5 Å²	43.5	28%	0.279	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-3.9	-174.8	29.6	-36.9	0	0	0	114.7	I870 T886 H915	P868-I870 PolarHBondContact O-N 3.35Å; P868-T886 HydrophobicContact CB-CG2 4.31Å; P868-H915 HydrophobicContact CB-CB 4.21Å; P868-H915 HydrophobicContact CG-CB 4.26Å; P868-H915 PolarHBondContact O-ND1 3.23Å
869	N	86.6	Confident	88.8	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-0.1	174.1	65.2	-22.1	0	0	0	113.6	T867 D912 H915 H917 I920 Y950	T867-N869 WeakPolarHBondContact CB-OD1 3.15Å; T867-N869 PolarHBondContact O-N 3.16Å; T867-N869 PolarHBondContact O-OD1 3.28Å; T867-N869 PolarHBondContact OG1-OD1 3.04Å; N869-D912 PolarHBondContact O-N 2.88Å; N869-H915 HydrophobicContact CB-CB 4.48Å; N869-H915 WeakPolarHBondContact CB-O 3.5Å; N869-H917 HydrophobicContact CB-CB 4.47Å; N869-I920 WeakPolarHBondContact ND2-CG1 3.32Å; N869-Y950 PolarHBondContact ND2-OH 3.49Å
870	I	89	Confident	89	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	148.5	171.3	56.7	165	0	0	0	110.8	L844 F866 T867 P868 F909 E910 T911 I920 I922	L844-I870 HydrophobicContact CD2-CD1 4.43Å; F866-I870 HydrophobicContact CB-CD1 3.87Å; F866-I870 HydrophobicContact CB-CG1 4.17Å; F866-I870 HydrophobicContact CD2-CD1 4.28Å; F866-I870 HydrophobicContact CD2-CG1 3.87Å; F866-I870 WeakPolarHBondContact CD2-O 3.34Å; F866-I870 VanDerWaalsContact CE2-O 3.31Å; F866-I870 WeakPolarHBondContact CE2-O 3.29Å; F866-I870 HydrophobicContact CG-CD1 4.25Å; F866-I870 HydrophobicContact CG-CG1 4.32Å; T867-I870 WeakPolarHBondContact O-CG1 3.23Å; T867-I870 PolarHBondContact O-N 3.47Å; P868-I870 PolarHBondContact O-N 3.35Å; I870-F909 HydrophobicContact CB-CB 4.32Å; I870-F909 HydrophobicContact CD1-CB 4.19Å; I870-F909 HydrophobicContact CD1-CD1 3.83Å; I870-F909 HydrophobicContact CD1-CD2 4.46Å; I870-F909 HydrophobicContact CD1-CE1 4.29Å; I870-F909 HydrophobicContact CD1-CG 3.91Å; I870-F909 HydrophobicContact CG1-CD1 4.41Å; I870-E910 CarbonylContact C-O 3.32Å; I870-E910 WeakPolarHBondContact CA-O 3.46Å; I870-T911 HydrophobicContact CG2-CG2 4.27Å; I870-I920 HydrophobicContact CD1-CG2 3.58Å; I870-I920 HydrophobicContact CG1-CG2 4.14Å; I870-I920 HydrophobicContact CG2-CD1 3.65Å; I870-I920 HydrophobicContact CG2-CG1 4.04Å; I870-I920 HydrophobicContact CG2-CG2 4.38Å; I870-I922 HydrophobicContact CD1-CD1 3.72Å; I870-I922 HydrophobicContact CD1-CG1 3.94Å
871	N	89.6	Confident	89	Confident	77 Å²	77	51.1 Å²	51.1	41%	0.412	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	139.4	-179.9	-72.3	-40.5	0	0	0	110.5	F909 E910	N871-F909 CarbonylContact O-C 3.55Å; N871-F909 WeakPolarHBondContact O-CA 3.47Å; N871-E910 PolarHBondContact N-O 2.98Å; N871-E910 PolarHBondContact O-N 2.88Å
872	Y	91.3	Very high	88.8	Confident	56 Å²	56	52.4 Å²	52.4	22%	0.22	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	132.7	173.6	171.6	-91.2	0	0	0	110.8	V875 P883 V888 V907	Y872-V875 PolarHBondContact OH-N 3.49Å; Y872-P883 HydrophobicContact CD1-CB 4.36Å; Y872-V888 HydrophobicContact CD1-CG2 4.36Å; Y872-V888 HydrophobicContact CD2-CB 4.37Å; Y872-V888 HydrophobicContact CD2-CG1 3.99Å; Y872-V888 HydrophobicContact CD2-CG2 3.79Å; Y872-V888 HydrophobicContact CE2-CG1 3.88Å; Y872-V888 HydrophobicContact CE2-CG2 4.49Å; Y872-V888 HydrophobicContact CG-CG1 4.48Å; Y872-V888 HydrophobicContact CG-CG2 3.7Å; Y872-V907 HydrophobicContact CD2-CG1 3.64Å; Y872-V907 HydrophobicContact CE2-CG1 3.64Å
873	V	90	Very high	88.5	Confident	62 Å²	62	56.5 Å²	56.5	38%	0.376	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	-58.7	177.8	-175.6	0	0	0	0	111.2	R908 E910	V873-R908 HydrophobicContact CB-CG 4.3Å; V873-R908 WeakPolarHBondContact CB-O 3.47Å; V873-R908 PolarHBondContact N-O 3.2Å; V873-E910 HydrophobicContact CG2-CB 3.48Å; V873-E910 VanDerWaalsContact CG2-CB 3.48Å
874	K	91.1	Very high	88	Confident	91 Å²	91	59.9 Å²	59.9	40%	0.396	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.4	169	-177.2	61	170.8	169.2	165.2	0	112.5	E876 R908	K874-E876 HydrophobicContact CD-CG 4.36Å; K874-E876 WeakPolarHBondContact CE-OE1 3.32Å; K874-E876 IonicContact NZ-OE1 3.56Å; K874-E876 PolarHBondContact NZ-OE1 2.85Å; K874-R908 HydrophobicContact CG-CB 4.26Å; K874-R908 PolarHBondContact N-O 3.11Å; K874-R908 PolarHBondContact O-N 3.29Å
875	V	92.6	Very high	87.4	Confident	9 Å²	9	66.9 Å²	66.9	6%	0.055	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	140.6	172.4	65.9	0	0	0	0	110.7	Y872 P877 K879 F905 K906 V907	Y872-V875 PolarHBondContact OH-N 3.49Å; V875-P877 CarbonylContact C-O 3.53Å; V875-P877 CarbonylContact O-C 3.53Å; V875-K879 HydrophobicContact CG1-CB 3.86Å; V875-K879 HydrophobicContact CG2-CB 4.38Å; V875-K879 HydrophobicContact CG2-CD 4.35Å; V875-F905 HydrophobicContact CG2-CB 4.41Å; V875-F905 HydrophobicContact CG2-CD2 3.48Å; V875-F905 VanDerWaalsContact CG2-CD2 3.48Å; V875-F905 HydrophobicContact CG2-CE2 4.07Å; V875-F905 HydrophobicContact CG2-CG 4.26Å; V875-K906 CarbonylContact C-O 3.55Å; V875-K906 WeakPolarHBondContact CA-O 3.41Å; V875-V907 HydrophobicContact CG2-CG2 4.21Å
876	E	89.1	Confident	87.1	Confident	69 Å²	69	67 Å²	67	32%	0.322	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	122.1	179.8	-69.5	177.2	170.4	0	0	110.1	K874 K906 R908	K874-E876 HydrophobicContact CD-CG 4.36Å; K874-E876 WeakPolarHBondContact CE-OE1 3.32Å; K874-E876 IonicContact NZ-OE1 3.56Å; K874-E876 PolarHBondContact NZ-OE1 2.85Å; E876-K906 PolarHBondContact N-O 3.1Å; E876-K906 PolarHBondContact O-N 2.84Å; E876-R908 IonicContact OE1-CZ 2.83Å; E876-R908 IonicContact OE1-NH1 3.93Å; E876-R908 PolarHBondContact OE1-NH1 2.94Å; E876-R908 IonicContact OE1-NH2 3.46Å; E876-R908 IonicContact OE2-CZ 3.86Å; E876-R908 IonicContact OE2-NH1 3.04Å; E876-R908 IonicContact OE2-NH2 2.89Å; E876-R908 PolarHBondContact OE2-NH2 2.78Å
877	P	86.1	Confident	86.9	Confident	86 Å²	86	70.4 Å²	70.4	56%	0.558	37%	0.371	S	S	*	.	S	Bend	cis	-62.9	160.6	-6.5	29.4	-35.6	0	0	0	112.3	V875 K879	V875-P877 CarbonylContact C-O 3.53Å; V875-P877 CarbonylContact O-C 3.53Å; P877-K879 PolarHBondContact O-N 2.79Å
878	E	83	Confident	86.9	Confident	190 Å²	190	69.5 Å²	69.5	89%	0.888	37%	0.366	S	S	*	.			trans	-58.3	126.7	-177.4	-164.9	171	-165.3	0	0	110.7
879	K	84.1	Confident	87.1	Confident	43 Å²	43	70 Å²	70	19%	0.187	37%	0.365	C	S	.	.			trans	-135.6	154.2	-178.5	-75.4	176.7	169.6	-70.8	0	108.8	V875 P877 C881 E903 F905	V875-K879 HydrophobicContact CG1-CB 3.86Å; V875-K879 HydrophobicContact CG2-CB 4.38Å; V875-K879 HydrophobicContact CG2-CD 4.35Å; P877-K879 PolarHBondContact O-N 2.79Å; K879-C881 PolarHBondContact O-N 2.86Å; K879-C881 VanDerWaalsContact O-N 3.07Å; K879-E903 IonicContact NZ-OE2 3.84Å; K879-E903 PolarHBondContact NZ-OE2 3.38Å; K879-F905 HydrophobicContact CD-CB 4.17Å; K879-F905 HydrophobicContact CD-CD1 3.94Å; K879-F905 HydrophobicContact CD-CD2 4.33Å; K879-F905 HydrophobicContact CD-CE1 4.37Å; K879-F905 HydrophobicContact CD-CG 3.9Å
880	E	84	Confident	87.2	Confident	144 Å²	144	70 Å²	70	67%	0.673	37%	0.365	S	S	*	.			trans	-71.3	103.5	175.2	-167.1	170.7	-170.7	0	0	109.2	A891	E880-A891 HydrophobicContact CB-CB 4.43Å; E880-A891 PolarHBondContact O-N 2.81Å
881	C	86.2	Confident	87.1	Confident	24 Å²	24	71 Å²	71	16%	0.162	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	132.6	177.6	-61.4	0	0	0	0	110	K879 P883 V888 E889 C890	K879-C881 PolarHBondContact O-N 2.86Å; K879-C881 VanDerWaalsContact O-N 3.07Å; C881-P883 WeakPolarHBondContact O-CD 3.28Å; C881-V888 HydrophobicContact CB-CG1 4.11Å; C881-E889 CarbonylContact C-O 3.53Å; C881-E889 WeakPolarHBondContact CA-O 3.37Å; C881-C890 HydrophobicContact CB-CB 4.11Å; C881-C890 WeakPolarHBondContact CB-SG 3.43Å; C881-C890 VanDerWaalsContact SG-CA 3.59Å; C881-C890 WeakPolarHBondContact SG-CB 3.47Å; C881-C890 CovalentContact SG-SG 2.04Å; C881-C890 PolarHBondContact SG-SG 2.89Å
882	T	84.9	Confident	86.9	Confident	85 Å²	85	67.4 Å²	67.4	52%	0.521	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	107	174.7	52.2	0	0	0	0	109.3	E889	T882-E889 PolarHBondContact N-O 2.89Å; T882-E889 PolarHBondContact O-N 2.79Å; T882-E889 VanDerWaalsContact O-N 3.07Å; T882-E889 PolarHBondContact OG1-O 2.84Å
883	P	84.1	Confident	86.2	Confident	86 Å²	86	65.4 Å²	65.4	56%	0.558	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	137.1	174.4	31.1	-32.9	0	0	0	111.2	Y872 C881 V888	Y872-P883 HydrophobicContact CD1-CB 4.36Å; C881-P883 WeakPolarHBondContact O-CD 3.28Å; P883-V888 HydrophobicContact CB-CG2 4.11Å
884	D	81.1	Confident	85.2	Confident	104 Å²	104	66.1 Å²	66.1	56%	0.556	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137	86.8	177	179.9	19.5	0	0	0	109.3	T886 K887	D884-T886 PolarHBondContact O-N 3.28Å; D884-K887 CarbonylContact C-O 3.58Å; D884-K887 WeakPolarHBondContact CA-O 3.39Å; D884-K887 PolarHBondContact N-O 3.43Å; D884-K887 WeakPolarHBondContact O-CA 3.17Å; D884-K887 WeakPolarHBondContact O-CB 3.36Å; D884-K887 PolarHBondContact O-N 2.88Å; D884-K887 VanDerWaalsContact O-O 3.06Å
885	N	80.6	Confident	84	Confident	148 Å²	148	63.2 Å²	63.2	79%	0.791	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	-105.4	-174.7	-65.8	-35.3	0	0	0	113	K887	N885-K887 VanDerWaalsContact C-N 3.34Å
886	T	86.1	Confident	83.4	Confident	60 Å²	60	66.1 Å²	66.1	37%	0.368	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	7.9	-179.6	54.9	0	0	0	0	113.5	S865 F866 P868 D884	S865-T886 WeakPolarHBondContact CA-O 3.37Å; F866-T886 WeakPolarHBondContact CD1-O 3.49Å; F866-T886 WeakPolarHBondContact CE1-O 3.44Å; F866-T886 PolarHBondContact N-O 2.83Å; F866-T886 WeakPolarHBondContact O-CB 3.35Å; P868-T886 HydrophobicContact CB-CG2 4.31Å; D884-T886 PolarHBondContact O-N 3.28Å
887	K	88.8	Confident	83.1	Confident	83 Å²	83	63 Å²	63	36%	0.361	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	135.9	179.4	-168.6	-179	178	-169.2	0	109.6	I863 L864 D884 N885	I863-K887 HydrophobicContact CG2-CD 4.18Å; I863-K887 HydrophobicContact CG2-CG 3.94Å; L864-K887 CarbonylContact O-C 3.4Å; L864-K887 WeakPolarHBondContact O-CA 3.23Å; D884-K887 CarbonylContact C-O 3.58Å; D884-K887 WeakPolarHBondContact CA-O 3.39Å; D884-K887 PolarHBondContact N-O 3.43Å; D884-K887 WeakPolarHBondContact O-CA 3.17Å; D884-K887 WeakPolarHBondContact O-CB 3.36Å; D884-K887 PolarHBondContact O-N 2.88Å; D884-K887 VanDerWaalsContact O-O 3.06Å; N885-K887 VanDerWaalsContact C-N 3.34Å
888	V	90.9	Very high	83	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	128.8	175	174.4	0	0	0	0	108.6	I863 L864 F866 Y872 C881 P883	I863-V888 CarbonylContact C-O 3.58Å; I863-V888 WeakPolarHBondContact CA-O 3.47Å; L864-V888 HydrophobicContact CB-CB 4.47Å; L864-V888 HydrophobicContact CD1-CB 4.39Å; L864-V888 HydrophobicContact CD1-CG1 4.42Å; L864-V888 PolarHBondContact N-O 3.43Å; L864-V888 PolarHBondContact O-N 2.86Å; F866-V888 HydrophobicContact CE1-CB 4.39Å; F866-V888 HydrophobicContact CE1-CG2 3.69Å; F866-V888 HydrophobicContact CZ-CG2 4.05Å; Y872-V888 HydrophobicContact CD1-CG2 4.36Å; Y872-V888 HydrophobicContact CD2-CB 4.37Å; Y872-V888 HydrophobicContact CD2-CG1 3.99Å; Y872-V888 HydrophobicContact CD2-CG2 3.79Å; Y872-V888 HydrophobicContact CE2-CG1 3.88Å; Y872-V888 HydrophobicContact CE2-CG2 4.49Å; Y872-V888 HydrophobicContact CG-CG1 4.48Å; Y872-V888 HydrophobicContact CG-CG2 3.7Å; C881-V888 HydrophobicContact CB-CG1 4.11Å; P883-V888 HydrophobicContact CB-CG2 4.11Å
889	E	89.8	Confident	83	Confident	54 Å²	54	53.7 Å²	53.7	25%	0.252	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	117.1	178	-175.1	173.6	150.3	0	0	109.2	K861 V862 I863 C881 T882	K861-E889 HydrophobicContact CB-CG 4.27Å; K861-E889 HydrophobicContact CD-CG 3.88Å; K861-E889 WeakPolarHBondContact CD-OE1 3.38Å; K861-E889 WeakPolarHBondContact CE-OE1 2.98Å; K861-E889 IonicContact NZ-OE1 2.78Å; K861-E889 PolarHBondContact NZ-OE1 3.31Å; V862-E889 CarbonylContact O-C 3.52Å; V862-E889 WeakPolarHBondContact O-CA 3.2Å; I863-E889 HydrophobicContact CG1-CG 4.28Å; C881-E889 CarbonylContact C-O 3.53Å; C881-E889 WeakPolarHBondContact CA-O 3.37Å; T882-E889 PolarHBondContact N-O 2.89Å; T882-E889 PolarHBondContact O-N 2.79Å; T882-E889 VanDerWaalsContact O-N 3.07Å; T882-E889 PolarHBondContact OG1-O 2.84Å
890	C	89.8	Confident	83	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	130.3	-177.5	-71.9	0	0	0	0	111.1	K861 V862 C881	K861-C890 CarbonylContact C-O 3.53Å; K861-C890 WeakPolarHBondContact CA-O 3.34Å; V862-C890 PolarHBondContact N-O 3.32Å; V862-C890 PolarHBondContact O-N 2.95Å; C881-C890 HydrophobicContact CB-CB 4.11Å; C881-C890 WeakPolarHBondContact CB-SG 3.43Å; C881-C890 VanDerWaalsContact SG-CA 3.59Å; C881-C890 WeakPolarHBondContact SG-CB 3.47Å; C881-C890 CovalentContact SG-SG 2.04Å; C881-C890 PolarHBondContact SG-SG 2.89Å
891	A	86.6	Confident	83.1	Confident	20 Å²	20	54.5 Å²	54.5	17%	0.165	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	135.5	174.6	0	0	0	0	0	111.6	E880	E880-A891 HydrophobicContact CB-CB 4.43Å; E880-A891 PolarHBondContact O-N 2.81Å
892	V	85.6	Confident	83.3	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.006	33%	0.33	C	S	.	.			trans	-128.6	129.6	-177.1	-177.5	0	0	0	0	110.5	I850 T860 V862 Y894 E903 F905	I850-V892 HydrophobicContact CD1-CB 4.45Å; I850-V892 HydrophobicContact CD1-CG1 3.96Å; I850-V892 HydrophobicContact CD1-CG2 3.96Å; T860-V892 HydrophobicContact CG2-CB 4.44Å; T860-V892 PolarHBondContact O-N 2.91Å; V862-V892 HydrophobicContact CB-CG2 4.34Å; V862-V892 HydrophobicContact CG2-CG2 3.54Å; V892-Y894 PolarHBondContact O-N 3.49Å; V892-E903 HydrophobicContact CG1-CB 4.02Å; V892-E903 HydrophobicContact CG1-CG 4.41Å; V892-F905 HydrophobicContact CG2-CE1 3.64Å; V892-F905 HydrophobicContact CG2-CZ 4.06Å
893	G	75.1	Confident	83.6	Confident	15 Å²	15	60.5 Å²	60.5	16%	0.155	32%	0.32	C	S	.	.	S	Bend	trans	61.8	22	-177.9	0	0	0	0	0	114.5	P895 F896	G893-P895 CarbonylContact O-C 3.54Å; G893-F896 CarbonylContact O-C 3.21Å; G893-F896 WeakPolarHBondContact O-CA 3.19Å; G893-F896 PolarHBondContact O-N 3.18Å
894	Y	69.9	Low	83.9	Confident	77 Å²	77	59.1 Å²	59.1	30%	0.302	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	127.3	-174.7	176.6	-95.5	0	0	0	112.1	K776 D777 V892	K776-Y894 HydrophobicContact CD-CE1 3.66Å; K776-Y894 HydrophobicContact CG-CE1 3.85Å; K776-Y894 WeakPolarHBondContact CG-OH 3.21Å; D777-Y894 WeakPolarHBondContact OD1-CE2 3.5Å; D777-Y894 PolarHBondContact OD1-OH 2.89Å; D777-Y894 PolarHBondContact OD2-OH 2.71Å; V892-Y894 PolarHBondContact O-N 3.49Å
895	P	66.6	Low	84.5	Confident	29 Å²	29	54.4 Å²	54.4	19%	0.188	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	cis	-86.1	-17.4	10	31.5	-34.5	0	0	0	117.1	K776 N859 G893	K776-P895 HydrophobicContact CB-CB 4.37Å; K776-P895 HydrophobicContact CG-CB 3.54Å; K776-P895 HydrophobicContact CG-CG 3.79Å; N859-P895 PolarHBondContact N-O 2.94Å; G893-P895 CarbonylContact O-C 3.54Å
896	F	78.5	Confident	85.1	Confident	71 Å²	71	51 Å²	51	31%	0.311	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	141.3	177.8	63.2	-94.5	0	0	0	111.8	N856 A857 Y858 G893 G898	N856-F896 HydrophobicContact CB-CD2 3.9Å; N856-F896 HydrophobicContact CB-CG 4.43Å; A857-F896 CarbonylContact O-C 3.56Å; A857-F896 WeakPolarHBondContact O-CA 3.34Å; A857-F896 WeakPolarHBondContact O-CB 3.4Å; Y858-F896 HydrophobicContact CD1-CB 3.68Å; Y858-F896 HydrophobicContact CD1-CD1 4.27Å; Y858-F896 HydrophobicContact CD1-CG 4.29Å; Y858-F896 HydrophobicContact CE1-CB 3.94Å; Y858-F896 AromaticContact CE1-CD1 3.83Å; Y858-F896 HydrophobicContact CE1-CD1 3.83Å; Y858-F896 HydrophobicContact CE1-CG 4.04Å; Y858-F896 HydrophobicContact CG-CB 4.14Å; G893-F896 CarbonylContact O-C 3.21Å; G893-F896 WeakPolarHBondContact O-CA 3.19Å; G893-F896 PolarHBondContact O-N 3.18Å; F896-G898 PolarHBondContact O-N 2.6Å
897	L	84.5	Confident	85.4	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.016	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	110.2	170.8	-174.6	63.3	0	0	0	108.3	L823 I850 N852 A857 T860 A901 E903	L823-L897 HydrophobicContact CD2-CD2 3.98Å; I850-L897 HydrophobicContact CG2-CD2 3.84Å; N852-L897 HydrophobicContact CB-CD2 3.76Å; N852-L897 HydrophobicContact CB-CG 3.89Å; N852-L897 PolarHBondContact ND2-O 2.8Å; A857-L897 HydrophobicContact CB-CB 4.33Å; A857-L897 PolarHBondContact N-O 2.86Å; A857-L897 PolarHBondContact O-N 3.01Å; T860-L897 HydrophobicContact CG2-CD2 4.46Å; L897-A901 HydrophobicContact CD1-CB 3.83Å; L897-A901 HydrophobicContact CG-CB 4.31Å; L897-E903 HydrophobicContact CD1-CG 4.05Å
898	G	82.3	Confident	85.6	Confident	19 Å²	19	46.2 Å²	46.2	20%	0.196	24%	0.238	C	C	.	.			trans	-59.6	160.3	-174.9	0	0	0	0	0	114.1	N852 N856 F896 K900 A901	N852-G898 PolarHBondContact ND2-O 3.2Å; N856-G898 WeakPolarHBondContact OD1-CA 3.43Å; F896-G898 PolarHBondContact O-N 2.6Å; G898-K900 PolarHBondContact O-N 3.47Å; G898-A901 WeakPolarHBondContact O-CB 3.38Å; G898-A901 PolarHBondContact O-N 3.15Å; G898-A901 VanDerWaalsContact O-N 3.09Å
899	S	83.3	Confident	85.7	Confident	62 Å²	62	46.2 Å²	46.2	43%	0.434	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	128.9	173.5	-177.1	0	0	0	0	111.7	R854 N856 A901	R854-S899 WeakPolarHBondContact O-CA 3.34Å; R854-S899 WeakPolarHBondContact O-CB 3.38Å; R854-S899 PolarHBondContact O-OG 2.9Å; N856-S899 PolarHBondContact OD1-N 2.89Å; S899-A901 PolarHBondContact O-N 2.99Å; S899-A901 VanDerWaalsContact O-N 3.13Å
900	K	84	Confident	85.7	Confident	170 Å²	170	45.6 Å²	45.6	74%	0.739	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.6	14.3	-179.2	-57	178	-175.2	175.4	0	114.4	N852 G898	N852-K900 CarbonylContact O-C 3.13Å; N852-K900 WeakPolarHBondContact O-CA 3.43Å; N852-K900 PolarHBondContact O-N 3.3Å; G898-K900 PolarHBondContact O-N 3.47Å
901	A	87.4	Confident	85.6	Confident	33 Å²	33	46 Å²	46	27%	0.273	24%	0.238	S	C	.	.			trans	-77.2	151.5	176.5	0	0	0	0	0	111.6	S851 N852 L897 G898 S899	S851-A901 WeakPolarHBondContact CA-O 3.48Å; N852-A901 PolarHBondContact N-O 3.44Å; L897-A901 HydrophobicContact CD1-CB 3.83Å; L897-A901 HydrophobicContact CG-CB 4.31Å; G898-A901 WeakPolarHBondContact O-CB 3.38Å; G898-A901 PolarHBondContact O-N 3.15Å; G898-A901 VanDerWaalsContact O-N 3.09Å; S899-A901 PolarHBondContact O-N 2.99Å; S899-A901 VanDerWaalsContact O-N 3.13Å
902	K	89.5	Confident	85.4	Confident	170 Å²	170	46.7 Å²	46.7	74%	0.739	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-128.9	138.4	172.8	-58.4	-165.5	174.3	-176.9	0	109.7	I850	I850-K902 CarbonylContact O-C 3.25Å; I850-K902 VanDerWaalsContact O-CA 3.27Å; I850-K902 WeakPolarHBondContact O-CA 3.47Å
903	E	90.9	Very high	84.7	Confident	66 Å²	66	48.5 Å²	48.5	31%	0.308	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	146.3	172	-76.4	-144.9	170.8	0	0	111.4	D849 I850 K879 V892 L897	D849-E903 WeakPolarHBondContact CA-O 3.23Å; I850-E903 PolarHBondContact N-O 3.12Å; I850-E903 PolarHBondContact O-N 3.46Å; K879-E903 IonicContact NZ-OE2 3.84Å; K879-E903 PolarHBondContact NZ-OE2 3.38Å; V892-E903 HydrophobicContact CG1-CB 4.02Å; V892-E903 HydrophobicContact CG1-CG 4.41Å; L897-E903 HydrophobicContact CD1-CG 4.05Å
904	S	91.1	Very high	84.5	Confident	57 Å²	57	51.5 Å²	51.5	40%	0.399	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	134.7	-179.4	-170.6	0	0	0	0	109.9	K847 I848 D849	K847-S904 WeakPolarHBondContact CE-OG 3.39Å; I848-S904 WeakPolarHBondContact O-CA 3.48Å; D849-S904 WeakPolarHBondContact OD1-CB 3.44Å; D849-S904 PolarHBondContact OD1-OG 2.97Å
905	F	93.1	Very high	84.8	Confident	5 Å²	5	52 Å²	52	2%	0.022	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	167	173.7	62.3	-88.7	0	0	0	111.5	I848 I850 V862 V875 K879 V892 V907	I848-F905 HydrophobicContact CB-CE1 4.44Å; I848-F905 HydrophobicContact CB-CE2 4.24Å; I848-F905 HydrophobicContact CB-CZ 4.18Å; I848-F905 HydrophobicContact CD1-CE2 3.9Å; I848-F905 HydrophobicContact CD1-CZ 4.21Å; I848-F905 HydrophobicContact CG2-CE1 4.31Å; I848-F905 HydrophobicContact CG2-CZ 4.13Å; I848-F905 PolarHBondContact N-O 3.33Å; I848-F905 PolarHBondContact O-N 3.2Å; I850-F905 HydrophobicContact CD1-CE1 3.66Å; I850-F905 HydrophobicContact CD1-CZ 4.28Å; V862-F905 HydrophobicContact CB-CZ 4.18Å; V862-F905 HydrophobicContact CG1-CZ 4.3Å; V862-F905 HydrophobicContact CG2-CE1 4.35Å; V862-F905 HydrophobicContact CG2-CZ 4.01Å; V875-F905 HydrophobicContact CG2-CB 4.41Å; V875-F905 HydrophobicContact CG2-CD2 3.48Å; V875-F905 VanDerWaalsContact CG2-CD2 3.48Å; V875-F905 HydrophobicContact CG2-CE2 4.07Å; V875-F905 HydrophobicContact CG2-CG 4.26Å; K879-F905 HydrophobicContact CD-CB 4.17Å; K879-F905 HydrophobicContact CD-CD1 3.94Å; K879-F905 HydrophobicContact CD-CD2 4.33Å; K879-F905 HydrophobicContact CD-CE1 4.37Å; K879-F905 HydrophobicContact CD-CG 3.9Å; V892-F905 HydrophobicContact CG2-CE1 3.64Å; V892-F905 HydrophobicContact CG2-CZ 4.06Å; F905-V907 HydrophobicContact CD2-CG2 3.99Å; F905-V907 HydrophobicContact CE2-CG2 3.73Å
906	K	93	Very high	85.2	Confident	76 Å²	76	53.3 Å²	53.3	33%	0.33	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	132.2	-178.5	-164.2	-177.7	-132.9	-156.6	0	110.2	D845 V846 V875 E876	D845-K906 HydrophobicContact CB-CD 3.6Å; D845-K906 HydrophobicContact CB-CG 3.86Å; D845-K906 VanDerWaalsContact CB-NZ 3.35Å; D845-K906 WeakPolarHBondContact OD2-CD 3.21Å; D845-K906 WeakPolarHBondContact OD2-CE 3.41Å; D845-K906 IonicContact OD2-NZ 3.28Å; D845-K906 PolarHBondContact OD2-NZ 2.78Å; V846-K906 CarbonylContact O-C 3.48Å; V846-K906 WeakPolarHBondContact O-CA 2.92Å; V875-K906 CarbonylContact C-O 3.55Å; V875-K906 WeakPolarHBondContact CA-O 3.41Å; E876-K906 PolarHBondContact N-O 3.1Å; E876-K906 PolarHBondContact O-N 2.84Å
907	V	93.3	Very high	85.2	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	126.5	173	-178.9	0	0	0	0	108.9	D845 V846 I848 L864 Y872 V875 F905 F909	D845-V907 CarbonylContact C-O 3.36Å; D845-V907 WeakPolarHBondContact CA-O 3.04Å; V846-V907 PolarHBondContact N-O 2.79Å; V846-V907 PolarHBondContact O-N 3.49Å; I848-V907 HydrophobicContact CD1-CG2 3.93Å; L864-V907 HydrophobicContact CD1-CG2 4.47Å; L864-V907 HydrophobicContact CD2-CB 4.22Å; L864-V907 HydrophobicContact CD2-CG1 4.17Å; L864-V907 HydrophobicContact CD2-CG2 4.01Å; Y872-V907 HydrophobicContact CD2-CG1 3.64Å; Y872-V907 HydrophobicContact CE2-CG1 3.64Å; V875-V907 HydrophobicContact CG2-CG2 4.21Å; F905-V907 HydrophobicContact CD2-CG2 3.99Å; F905-V907 HydrophobicContact CE2-CG2 3.73Å; V907-F909 HydrophobicContact CB-CE2 4.09Å; V907-F909 HydrophobicContact CG1-CD2 4.2Å; V907-F909 HydrophobicContact CG1-CE1 4.33Å; V907-F909 HydrophobicContact CG1-CE2 3.57Å; V907-F909 HydrophobicContact CG1-CZ 3.66Å
908	R	92.9	Very high	85.1	Confident	43 Å²	43	58 Å²	58	16%	0.162	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	128	178.8	-178.9	164.9	-67.1	134.1	16.4	110.4	D845 V873 K874 E876	D845-R908 VanDerWaalsContact OD1-CB 3.26Å; D845-R908 WeakPolarHBondContact OD1-CB 3.23Å; D845-R908 WeakPolarHBondContact OD1-CG 3.23Å; D845-R908 IonicContact OD1-CZ 4Å; D845-R908 IonicContact OD1-NE 3.48Å; D845-R908 PolarHBondContact OD1-NE 2.68Å; D845-R908 IonicContact OD1-NH2 2.67Å; D845-R908 IonicContact OD2-CZ 2.79Å; D845-R908 IonicContact OD2-NE 2.74Å; D845-R908 IonicContact OD2-NH2 3.45Å; D845-R908 PolarHBondContact OD2-NH2 2.86Å; D845-R908 VanDerWaalsContact OD2-NH2 3.12Å; V873-R908 HydrophobicContact CB-CG 4.3Å; V873-R908 WeakPolarHBondContact CB-O 3.47Å; V873-R908 PolarHBondContact N-O 3.2Å; K874-R908 HydrophobicContact CG-CB 4.26Å; K874-R908 PolarHBondContact N-O 3.11Å; K874-R908 PolarHBondContact O-N 3.29Å; E876-R908 IonicContact OE1-CZ 2.83Å; E876-R908 IonicContact OE1-NH1 3.93Å; E876-R908 PolarHBondContact OE1-NH1 2.94Å; E876-R908 IonicContact OE1-NH2 3.46Å; E876-R908 IonicContact OE2-CZ 3.86Å; E876-R908 IonicContact OE2-NH1 3.04Å; E876-R908 IonicContact OE2-NH2 2.89Å; E876-R908 PolarHBondContact OE2-NH2 2.78Å
909	F	91.9	Very high	85.2	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	155.8	174	-63	-84.5	0	0	0	110.8	K843 L844 V846 L864 F866 I870 N871 V907 I922	K843-F909 WeakPolarHBondContact CA-O 3.49Å; L844-F909 HydrophobicContact CB-CB 4.28Å; L844-F909 PolarHBondContact N-O 2.79Å; L844-F909 PolarHBondContact O-N 2.82Å; V846-F909 HydrophobicContact CB-CE2 4.27Å; V846-F909 HydrophobicContact CG2-CD2 4.04Å; V846-F909 HydrophobicContact CG2-CE2 3.81Å; L864-F909 HydrophobicContact CD2-CE2 4.31Å; L864-F909 HydrophobicContact CD2-CZ 3.88Å; F866-F909 AromaticContact CD1-CE1 3.56Å; F866-F909 HydrophobicContact CD1-CE1 3.56Å; F866-F909 HydrophobicContact CD1-CZ 4.06Å; F866-F909 HydrophobicContact CD2-CE1 4.31Å; F866-F909 AromaticContact CE1-CE1 3.68Å; F866-F909 HydrophobicContact CE1-CE1 3.68Å; F866-F909 HydrophobicContact CE1-CZ 4.41Å; F866-F909 HydrophobicContact CE2-CE1 4.39Å; F866-F909 AromaticContact CG-CE1 3.9Å; F866-F909 HydrophobicContact CG-CE1 3.9Å; F866-F909 HydrophobicContact CZ-CE1 4.1Å; I870-F909 HydrophobicContact CB-CB 4.32Å; I870-F909 HydrophobicContact CD1-CB 4.19Å; I870-F909 HydrophobicContact CD1-CD1 3.83Å; I870-F909 HydrophobicContact CD1-CD2 4.46Å; I870-F909 HydrophobicContact CD1-CE1 4.29Å; I870-F909 HydrophobicContact CD1-CG 3.91Å; I870-F909 HydrophobicContact CG1-CD1 4.41Å; N871-F909 CarbonylContact O-C 3.55Å; N871-F909 WeakPolarHBondContact O-CA 3.47Å; V907-F909 HydrophobicContact CB-CE2 4.09Å; V907-F909 HydrophobicContact CG1-CD2 4.2Å; V907-F909 HydrophobicContact CG1-CE1 4.33Å; V907-F909 HydrophobicContact CG1-CE2 3.57Å; V907-F909 HydrophobicContact CG1-CZ 3.66Å; F909-I922 HydrophobicContact CD2-CD1 4.36Å; F909-I922 HydrophobicContact CE2-CD1 4.15Å
910	E	90.6	Very high	85.5	Confident	40 Å²	40	55 Å²	55	19%	0.187	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	140.2	175.1	-178.3	176.9	153.2	0	0	109.1	K841 D842 I870 N871 V873	K841-E910 HydrophobicContact CB-CG 3.9Å; K841-E910 WeakPolarHBondContact CB-OE1 3.4Å; K841-E910 WeakPolarHBondContact CD-OE1 3.44Å; K841-E910 VanDerWaalsContact CE-OE1 3.27Å; K841-E910 WeakPolarHBondContact CE-OE1 3.17Å; K841-E910 HydrophobicContact CG-CG 4.43Å; K841-E910 WeakPolarHBondContact CG-OE1 3.26Å; K841-E910 IonicContact NZ-OE1 3.52Å; K841-E910 PolarHBondContact NZ-OE1 2.9Å; D842-E910 WeakPolarHBondContact O-CA 3.44Å; I870-E910 CarbonylContact C-O 3.32Å; I870-E910 WeakPolarHBondContact CA-O 3.46Å; N871-E910 PolarHBondContact N-O 2.98Å; N871-E910 PolarHBondContact O-N 2.88Å; V873-E910 HydrophobicContact CG2-CB 3.48Å; V873-E910 VanDerWaalsContact CG2-CB 3.48Å
911	T	87.4	Confident	85.8	Confident	9 Å²	9	52.6 Å²	52.6	6%	0.055	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	146.7	-175.9	53.1	0	0	0	0	114.1	M834 I836 D842 I870	M834-T911 HydrophobicContact CE-CG2 3.04Å; M834-T911 HydrophobicContact SD-CG2 4.48Å; I836-T911 HydrophobicContact CD1-CG2 3.77Å; I836-T911 HydrophobicContact CG1-CG2 3.85Å; D842-T911 HydrophobicContact CB-CG2 4.22Å; D842-T911 PolarHBondContact N-OG1 2.69Å; D842-T911 PolarHBondContact O-N 3.03Å; D842-T911 PolarHBondContact O-OG1 3.42Å; I870-T911 HydrophobicContact CG2-CG2 4.27Å
912	D	81.7	Confident	86.1	Confident	35 Å²	35	51.1 Å²	51.1	19%	0.187	25%	0.251	C	S	.	.			trans	-120.4	109.2	173.8	-172.1	-5.4	0	0	0	110.4	N869 S914 H915	N869-D912 PolarHBondContact O-N 2.88Å; D912-S914 PolarHBondContact O-N 3.04Å; D912-S914 VanDerWaalsContact OD1-CB 3.27Å; D912-S914 WeakPolarHBondContact OD1-CB 3.27Å; D912-S914 PolarHBondContact OD1-N 3.33Å; D912-S914 PolarHBondContact OD1-OG 3.41Å; D912-S914 PolarHBondContact OD2-OG 2.86Å; D912-H915 IonicContact OD2-CE1 2.66Å; D912-H915 IonicContact OD2-ND1 2.72Å; D912-H915 PolarHBondContact OD2-ND1 3.26Å
913	S	72.7	Confident	86.2	Confident	38 Å²	38	45.5 Å²	45.5	27%	0.266	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-4.2	179.3	58.8	0	0	0	0	113.8
914	S	70.8	Confident	86.4	Confident	78 Å²	78	42.3 Å²	42.3	55%	0.545	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-23.3	176.1	69.4	0	0	0	0	113.3	D912	D912-S914 PolarHBondContact O-N 3.04Å; D912-S914 VanDerWaalsContact OD1-CB 3.27Å; D912-S914 WeakPolarHBondContact OD1-CB 3.27Å; D912-S914 PolarHBondContact OD1-N 3.33Å; D912-S914 PolarHBondContact OD1-OG 3.41Å; D912-S914 PolarHBondContact OD2-OG 2.86Å
915	H	74.6	Confident	86.5	Confident	87 Å²	87	41.5 Å²	41.5	40%	0.403	21%	0.207	S	C	.	.	S	Bend	trans	-113	108.7	178.9	-63	94.6	0	0	0	110.2	P868 N869 D912	P868-H915 HydrophobicContact CB-CB 4.21Å; P868-H915 HydrophobicContact CG-CB 4.26Å; P868-H915 PolarHBondContact O-ND1 3.23Å; N869-H915 HydrophobicContact CB-CB 4.48Å; N869-H915 WeakPolarHBondContact CB-O 3.5Å; D912-H915 IonicContact OD2-CE1 2.66Å; D912-H915 IonicContact OD2-ND1 2.72Å; D912-H915 PolarHBondContact OD2-ND1 3.26Å
916	I	75.8	Confident	86.4	Confident	57 Å²	57	41.3 Å²	41.3	29%	0.292	21%	0.207	S	C	.	.			trans	-94.1	112.1	-173.6	-53.7	-175.4	0	0	0	110.3	Y950 L1000 F1112	I916-Y950 HydrophobicContact CG2-CD2 3.94Å; I916-Y950 HydrophobicContact CG2-CE2 3.76Å; I916-L1000 HydrophobicContact CD1-CB 3.78Å; I916-F1112 HydrophobicContact CD1-CE1 4.09Å; I916-F1112 HydrophobicContact CD1-CZ 3.68Å; I916-F1112 HydrophobicContact CG2-CZ 4.18Å
917	H	78.8	Confident	86.2	Confident	76 Å²	76	40.6 Å²	40.6	35%	0.352	21%	0.208	S	C	.	.			trans	-128.2	141.9	174.1	-79.3	-83.5	0	0	0	111.4	N869 N919 Y950	N869-H917 HydrophobicContact CB-CB 4.47Å; H917-N919 VanDerWaalsContact C-N 3.27Å; H917-N919 PolarHBondContact O-N 3.37Å; H917-Y950 PolarHBondContact N-OH 3.1Å; H917-Y950 VanDerWaalsContact O-CE2 3.22Å; H917-Y950 WeakPolarHBondContact O-CE2 3.4Å; H917-Y950 PolarHBondContact O-OH 2.89Å
918	E	81.3	Confident	85.8	Confident	96 Å²	96	41.9 Å²	41.9	45%	0.449	22%	0.217	S	C	.	.	S	Bend	trans	-61.3	-35.9	176.6	-179.7	167.2	-152.9	0	0	112.9	V948 H1110 L1111	E918-V948 PolarHBondContact O-N 3.07Å; E918-H1110 IonicContact OE1-CD2 3.36Å; E918-H1110 PolarHBondContact OE1-CD2 3.15Å; E918-H1110 IonicContact OE1-CE1 4Å; E918-H1110 IonicContact OE1-NE2 3.83Å; E918-H1110 PolarHBondContact OE1-NE2 3Å; E918-L1111 HydrophobicContact CB-CD2 3.64Å; E918-L1111 HydrophobicContact CG-CD2 3.63Å
919	N	85.4	Confident	85.1	Confident	19 Å²	19	41.8 Å²	41.8	10%	0.102	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	143.1	-177.4	-51.9	-59.3	0	0	0	110.2	H917 Y921 F945 I946 P947	H917-N919 VanDerWaalsContact C-N 3.27Å; H917-N919 PolarHBondContact O-N 3.37Å; N919-Y921 HydrophobicContact CB-CD2 4.32Å; N919-Y921 HydrophobicContact CB-CE2 3.72Å; N919-Y921 PolarHBondContact ND2-OH 3.21Å; N919-F945 HydrophobicContact CB-CD2 3.98Å; N919-F945 HydrophobicContact CB-CE2 3.39Å; N919-F945 HydrophobicContact CB-CZ 3.89Å; N919-F945 VanDerWaalsContact ND2-CE2 3.29Å; N919-F945 WeakPolarHBondContact ND2-CE2 3.32Å; N919-F945 WeakPolarHBondContact ND2-CZ 3.43Å; N919-F945 WeakPolarHBondContact OD1-CZ 3.41Å; N919-I946 CarbonylContact C-O 3.58Å; N919-I946 WeakPolarHBondContact CA-O 3.42Å; N919-P947 WeakPolarHBondContact OD1-CA 3.43Å
920	I	89.1	Confident	84.6	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	124.1	162.8	-65	161.5	0	0	0	107.3	M834 L844 T867 N869 I870 I922 I946 V948	M834-I920 HydrophobicContact CE-CD1 4.35Å; L844-I920 HydrophobicContact CD2-CD1 4.36Å; L844-I920 HydrophobicContact CD2-CG2 4.47Å; T867-I920 WeakPolarHBondContact OG1-CA 3.48Å; N869-I920 WeakPolarHBondContact ND2-CG1 3.32Å; I870-I920 HydrophobicContact CD1-CG2 3.58Å; I870-I920 HydrophobicContact CG1-CG2 4.14Å; I870-I920 HydrophobicContact CG2-CD1 3.65Å; I870-I920 HydrophobicContact CG2-CG1 4.04Å; I870-I920 HydrophobicContact CG2-CG2 4.38Å; I920-I922 HydrophobicContact CG2-CD1 4.06Å; I920-I922 HydrophobicContact CG2-CG1 3.79Å; I920-I946 HydrophobicContact CB-CB 4.24Å; I920-I946 PolarHBondContact N-O 3.16Å; I920-I946 PolarHBondContact O-N 2.91Å; I920-V948 HydrophobicContact CB-CG2 4.47Å; I920-V948 HydrophobicContact CD1-CG2 3.5Å; I920-V948 HydrophobicContact CG1-CG2 3.64Å
921	Y	91	Very high	84.1	Confident	119 Å²	119	44.3 Å²	44.3	47%	0.467	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	129.7	170.2	-62.7	-90.3	0	0	0	108.6	F866 T867 N919 F945	F866-Y921 CarbonylContact C-O 3.08Å; F866-Y921 WeakPolarHBondContact CA-O 3.38Å; T867-Y921 HydrophobicContact CG2-CD2 3.81Å; T867-Y921 HydrophobicContact CG2-CG 4.42Å; T867-Y921 PolarHBondContact N-O 2.97Å; T867-Y921 VanDerWaalsContact N-O 3.13Å; T867-Y921 PolarHBondContact OG1-N 3.24Å; N919-Y921 HydrophobicContact CB-CD2 4.32Å; N919-Y921 HydrophobicContact CB-CE2 3.72Å; N919-Y921 PolarHBondContact ND2-OH 3.21Å; Y921-F945 HydrophobicContact CD1-CD2 4.06Å; Y921-F945 AromaticContact CE1-CD2 3.51Å; Y921-F945 HydrophobicContact CE1-CD2 3.51Å; Y921-F945 AromaticContact CE1-CE2 3.86Å; Y921-F945 HydrophobicContact CE1-CE2 3.86Å; Y921-F945 AromaticContact CZ-CD2 3.97Å; Y921-F945 AromaticContact CZ-CE2 3.86Å
922	I	92.8	Very high	84	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	109.5	172.2	-50.3	176.4	0	0	0	107.3	L844 V846 S865 F866 I870 F909 I920 V924 I944	L844-I922 HydrophobicContact CD2-CD1 3.96Å; V846-I922 HydrophobicContact CG2-CD1 3.7Å; S865-I922 CarbonylContact O-C 3.55Å; S865-I922 WeakPolarHBondContact O-CA 3.21Å; F866-I922 HydrophobicContact CB-CG1 4.13Å; F866-I922 HydrophobicContact CB-CG2 4.49Å; I870-I922 HydrophobicContact CD1-CD1 3.72Å; I870-I922 HydrophobicContact CD1-CG1 3.94Å; F909-I922 HydrophobicContact CD2-CD1 4.36Å; F909-I922 HydrophobicContact CE2-CD1 4.15Å; I920-I922 HydrophobicContact CG2-CD1 4.06Å; I920-I922 HydrophobicContact CG2-CG1 3.79Å; I922-V924 HydrophobicContact CG2-CG2 3.98Å; I922-I944 HydrophobicContact CB-CB 4.22Å; I922-I944 PolarHBondContact N-O 3Å; I922-I944 PolarHBondContact O-N 2.91Å
923	N	92.8	Very high	84	Confident	52 Å²	52	46.8 Å²	46.8	28%	0.278	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	118.4	171.7	-172.6	-0.1	0	0	0	108.7	L864 S865 E943	L864-N923 CarbonylContact C-O 3.17Å; L864-N923 WeakPolarHBondContact CA-O 3.48Å; S865-N923 PolarHBondContact N-O 2.9Å; S865-N923 PolarHBondContact O-N 3.01Å; N923-E943 HydrophobicContact CB-CG 4.42Å
924	V	94.1	Very high	84.6	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	122.5	177.5	-171	0	0	0	0	107.4	L825 A827 I848 V862 L864 I922 S941 K942	L825-V924 HydrophobicContact CD1-CG1 4.14Å; L825-V924 HydrophobicContact CD2-CB 4.01Å; L825-V924 HydrophobicContact CD2-CG1 3.75Å; L825-V924 WeakPolarHBondContact CD2-O 3.32Å; L825-V924 HydrophobicContact CG-CG1 4.48Å; A827-V924 HydrophobicContact CB-CB 4.39Å; A827-V924 HydrophobicContact CB-CG2 4.17Å; I848-V924 HydrophobicContact CD1-CG1 3.87Å; I848-V924 HydrophobicContact CD1-CG2 4.45Å; I848-V924 HydrophobicContact CG1-CG1 4.41Å; I848-V924 HydrophobicContact CG2-CG1 4.33Å; V862-V924 HydrophobicContact CG1-CG1 3.57Å; L864-V924 HydrophobicContact CD2-CG2 4.33Å; L864-V924 HydrophobicContact CG-CG1 4.43Å; L864-V924 HydrophobicContact CG-CG2 4.46Å; I922-V924 HydrophobicContact CG2-CG2 3.98Å; V924-S941 CarbonylContact O-C 3.51Å; V924-S941 VanDerWaalsContact O-CA 3.28Å; V924-S941 WeakPolarHBondContact O-CA 3.38Å; V924-K942 PolarHBondContact N-O 2.88Å; V924-K942 PolarHBondContact O-N 3.41Å
925	T	93.1	Very high	85.1	Confident	40 Å²	40	51.9 Å²	51.9	25%	0.245	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	134	179.2	-57.6	0	0	0	0	109.9	V862 I863 V927 N940	V862-T925 CarbonylContact C-O 3.34Å; V862-T925 WeakPolarHBondContact CA-O 3.49Å; I863-T925 PolarHBondContact N-O 3.42Å; I863-T925 PolarHBondContact O-N 3.01Å; T925-V927 HydrophobicContact CG2-CG1 4.27Å; T925-N940 CarbonylContact C-O 3.46Å; T925-N940 WeakPolarHBondContact CA-O 3.41Å
926	T	91.1	Very high	85.5	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	137.8	172.5	-165.5	0	0	0	0	110.6	L823 L825 K861 N940	L823-T926 HydrophobicContact CB-CG2 3.86Å; L823-T926 HydrophobicContact CD1-CG2 4.07Å; L825-T926 HydrophobicContact CB-CG2 4.09Å; K861-T926 CarbonylContact O-C 3.55Å; K861-T926 WeakPolarHBondContact O-CA 3.33Å; K861-T926 PolarHBondContact O-OG1 3.4Å; T926-N940 HydrophobicContact CG2-CB 3.87Å; T926-N940 PolarHBondContact N-O 3.18Å
927	V	88.6	Confident	86	Confident	61 Å²	61	50.4 Å²	50.4	37%	0.37	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	154.1	178.9	-63.8	0	0	0	0	110.3	T860 K861 I863 T925	T860-V927 CarbonylContact C-O 3.42Å; T860-V927 WeakPolarHBondContact CA-O 3.45Å; K861-V927 HydrophobicContact CB-CG2 4.06Å; K861-V927 PolarHBondContact N-O 3Å; K861-V927 PolarHBondContact O-N 3.12Å; I863-V927 HydrophobicContact CD1-CG1 4.42Å; I863-V927 HydrophobicContact CD1-CG2 3.94Å; I863-V927 HydrophobicContact CG1-CG2 4.47Å; T925-V927 HydrophobicContact CG2-CG1 4.27Å
928	S	86.3	Confident	86.2	Confident	26 Å²	26	53.7 Å²	53.7	18%	0.182	28%	0.28	C	S	.	.			trans	-142.9	162.8	170.3	69.4	0	0	0	0	111.2	S930	S928-S930 VanDerWaalsContact C-N 3.26Å
929	D	77.9	Confident	86.5	Confident	42 Å²	42	50.8 Å²	50.8	23%	0.225	27%	0.267	C	S	.	.	S	Bend	trans	-80.9	-6.5	176.6	-71.4	-30.9	0	0	0	112.8	K678 P809 Y858 N859	K678-D929 WeakPolarHBondContact CE-O 3.05Å; K678-D929 PolarHBondContact NZ-O 3.09Å; P809-D929 HydrophobicContact CB-CB 3.7Å; P809-D929 WeakPolarHBondContact CB-OD2 3.43Å; P809-D929 HydrophobicContact CG-CB 4.15Å; Y858-D929 PolarHBondContact O-N 2.02Å; N859-D929 HydrophobicContact CB-CB 4.44Å; N859-D929 VanDerWaalsContact CB-OD2 3.22Å; N859-D929 WeakPolarHBondContact CB-OD2 3.3Å; N859-D929 PolarHBondContact ND2-OD2 3.22Å
930	S	80.9	Confident	86.7	Confident	10 Å²	10	50.3 Å²	50.3	7%	0.07	27%	0.265	C	S	.	.	S	Bend	trans	-75.2	161.2	173.7	-64.6	0	0	0	0	111.8	T821 N856 Y858 S928	T821-S930 WeakPolarHBondContact OG1-CB 3.5Å; N856-S930 PolarHBondContact O-OG 3.28Å; Y858-S930 PolarHBondContact N-OG 3Å; S928-S930 VanDerWaalsContact C-N 3.26Å
931	E	80.3	Confident	86.8	Confident	82 Å²	82	53.1 Å²	53.1	38%	0.383	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	138	173.7	-72.1	-173.1	-170.3	0	0	109.9	K818 C819 I820 T821	K818-E931 WeakPolarHBondContact CD-OE2 3.33Å; K818-E931 IonicContact NZ-OE1 3.08Å; K818-E931 PolarHBondContact NZ-OE1 3.34Å; K818-E931 IonicContact NZ-OE2 2.82Å; K818-E931 PolarHBondContact NZ-OE2 2.9Å; C819-E931 PolarHBondContact O-N 2.9Å; I820-E931 CarbonylContact C-O 3.49Å; I820-E931 VanDerWaalsContact CA-O 3.26Å; I820-E931 WeakPolarHBondContact CA-O 3.49Å; T821-E931 PolarHBondContact N-O 3.38Å; T821-E931 PolarHBondContact OG1-O 2.82Å
932	E	84.4	Confident	86.8	Confident	33 Å²	33	52.3 Å²	52.3	15%	0.154	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	148.4	175.4	176.9	160	-168.3	0	0	109.8	T821 L823 T936 L937 N940	T821-E932 WeakPolarHBondContact O-CG 3.49Å; L823-E932 PolarHBondContact N-OE1 3.27Å; E932-T936 VanDerWaalsContact CG-OG1 3.28Å; E932-T936 WeakPolarHBondContact CG-OG1 3.4Å; E932-T936 PolarHBondContact OE1-OG1 2.89Å; E932-L937 HydrophobicContact CB-CD2 4.17Å; E932-L937 HydrophobicContact CG-CD2 3.93Å; E932-N940 PolarHBondContact OE2-ND2 2.87Å
933	N	83.3	Confident	86.8	Confident	63 Å²	63	59.3 Å²	59.3	34%	0.337	32%	0.316	S	S	.	.			trans	-68.5	128.8	178.6	-172.2	-21.3	0	0	0	109.9	N935 T936	N933-N935 PolarHBondContact O-N 3.18Å; N933-N935 PolarHBondContact OD1-N 2.87Å; N933-N935 VanDerWaalsContact OD1-N 3.16Å; N933-T936 PolarHBondContact O-N 3.27Å; N933-T936 PolarHBondContact O-OG1 2.9Å; N933-T936 VanDerWaalsContact O-OG1 3.04Å
934	P	83.6	Confident	86.7	Confident	98 Å²	98	57.6 Å²	57.6	64%	0.636	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-27.9	177.2	-29.3	35.5	0	0	0	114.8	T936 L937	P934-T936 VanDerWaalsContact C-N 3.35Å; P934-T936 PolarHBondContact O-N 3.07Å; P934-L937 HydrophobicContact CB-CD1 4.45Å
935	N	82.2	Confident	86.5	Confident	125 Å²	125	62.9 Å²	62.9	67%	0.668	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-23.4	179	-66	-21.1	0	0	0	114	N933 H938	N933-N935 PolarHBondContact O-N 3.18Å; N933-N935 PolarHBondContact OD1-N 2.87Å; N933-N935 VanDerWaalsContact OD1-N 3.16Å; N935-H938 PolarHBondContact O-CE1 3.22Å; N935-H938 PolarHBondContact O-ND1 2.96Å
936	T	83.9	Confident	86.3	Confident	25 Å²	25	61 Å²	61	15%	0.153	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-20.3	179	55.7	0	0	0	0	112.7	E932 N933 P934 H938 D939	E932-T936 VanDerWaalsContact CG-OG1 3.28Å; E932-T936 WeakPolarHBondContact CG-OG1 3.4Å; E932-T936 PolarHBondContact OE1-OG1 2.89Å; N933-T936 PolarHBondContact O-N 3.27Å; N933-T936 PolarHBondContact O-OG1 2.9Å; N933-T936 VanDerWaalsContact O-OG1 3.04Å; P934-T936 VanDerWaalsContact C-N 3.35Å; P934-T936 PolarHBondContact O-N 3.07Å; T936-H938 PolarHBondContact O-N 2.83Å; T936-D939 PolarHBondContact O-N 3.41Å
937	L	85	Confident	86.3	Confident	89 Å²	89	63.6 Å²	63.6	47%	0.466	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-50.7	-20.2	-176.4	-65	177	0	0	0	116.9	E932 P934 D939 N940	E932-L937 HydrophobicContact CB-CD2 4.17Å; E932-L937 HydrophobicContact CG-CD2 3.93Å; P934-L937 HydrophobicContact CB-CD1 4.45Å; L937-D939 VanDerWaalsContact C-N 3.31Å; L937-D939 PolarHBondContact O-N 2.8Å; L937-N940 WeakPolarHBondContact O-CB 3.34Å; L937-N940 PolarHBondContact O-N 2.91Å
938	H	83.8	Confident	86.2	Confident	145 Å²	145	61 Å²	61	67%	0.671	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-69.9	-22.4	179.6	67.2	-81.9	0	0	0	113.8	N935 T936 N940	N935-H938 PolarHBondContact O-CE1 3.22Å; N935-H938 PolarHBondContact O-ND1 2.96Å; T936-H938 PolarHBondContact O-N 2.83Å; H938-N940 VanDerWaalsContact C-N 3.33Å
939	D	86.9	Confident	86.1	Confident	35 Å²	35	64.7 Å²	64.7	19%	0.187	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-93.1	7.6	176.5	78.3	-25	0	0	0	113.5	S824 L825 K853 T936 L937	S824-D939 VanDerWaalsContact CB-OD2 3.26Å; S824-D939 WeakPolarHBondContact CB-OD2 3.34Å; S824-D939 PolarHBondContact OG-OD2 3.21Å; L825-D939 PolarHBondContact N-O 2.93Å; K853-D939 IonicContact NZ-OD2 3.68Å; K853-D939 PolarHBondContact NZ-OD2 2.97Å; T936-D939 PolarHBondContact O-N 3.41Å; L937-D939 VanDerWaalsContact C-N 3.31Å; L937-D939 PolarHBondContact O-N 2.8Å
940	N	89.1	Confident	86.3	Confident	9 Å²	9	63 Å²	63	5%	0.048	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-87.4	-7.4	174.4	-71.9	-17.3	0	0	0	114.1	L823 L825 T925 T926 E932 L937 H938	L823-N940 WeakPolarHBondContact CB-OD1 3.4Å; L823-N940 PolarHBondContact O-OD1 2.95Å; L825-N940 WeakPolarHBondContact CD2-O 3.23Å; T925-N940 CarbonylContact C-O 3.46Å; T925-N940 WeakPolarHBondContact CA-O 3.41Å; T926-N940 HydrophobicContact CG2-CB 3.87Å; T926-N940 PolarHBondContact N-O 3.18Å; E932-N940 PolarHBondContact OE2-ND2 2.87Å; L937-N940 WeakPolarHBondContact O-CB 3.34Å; L937-N940 PolarHBondContact O-N 2.91Å; H938-N940 VanDerWaalsContact C-N 3.33Å
941	S	90.8	Very high	86.3	Confident	58 Å²	58	65.1 Å²	65.1	41%	0.406	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	141.5	-178	60.2	0	0	0	0	112.3	V924	V924-S941 CarbonylContact O-C 3.51Å; V924-S941 VanDerWaalsContact O-CA 3.28Å; V924-S941 WeakPolarHBondContact O-CA 3.38Å
942	K	92.9	Very high	85.9	Confident	102 Å²	102	61.4 Å²	61.4	44%	0.443	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	126	175	-175.6	64.3	176.4	-178	0	110.2	L825 A827 V924	L825-K942 HydrophobicContact CD2-CB 4.3Å; A827-K942 HydrophobicContact CB-CB 4.29Å; A827-K942 HydrophobicContact CB-CG 4.15Å; V924-K942 PolarHBondContact N-O 2.88Å; V924-K942 PolarHBondContact O-N 3.41Å
943	E	91	Very high	85.4	Confident	150 Å²	150	60.4 Å²	60.4	70%	0.701	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	134.3	172	-64.8	-177.1	167.9	0	0	110.7	N923	N923-E943 HydrophobicContact CB-CG 4.42Å
944	I	91.5	Very high	85.2	Confident	15 Å²	15	58 Å²	58	8%	0.077	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	134.5	174.7	-58.5	174.2	0	0	0	108	A827 A829 V846 I922 I946	A827-I944 HydrophobicContact CB-CD1 4Å; A829-I944 HydrophobicContact CB-CG2 3.85Å; V846-I944 HydrophobicContact CG1-CD1 3.5Å; V846-I944 VanDerWaalsContact CG1-CD1 3.5Å; V846-I944 HydrophobicContact CG2-CD1 4.39Å; I922-I944 HydrophobicContact CB-CB 4.22Å; I922-I944 PolarHBondContact N-O 3Å; I922-I944 PolarHBondContact O-N 2.91Å; I944-I946 HydrophobicContact CG2-CD1 4.24Å; I944-I946 HydrophobicContact CG2-CG1 4.03Å
945	F	89.7	Confident	85.1	Confident	112 Å²	112	57.6 Å²	57.6	49%	0.491	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	123.6	-179.2	175.4	-94.2	0	0	0	109.5	N919 Y921 P947	N919-F945 HydrophobicContact CB-CD2 3.98Å; N919-F945 HydrophobicContact CB-CE2 3.39Å; N919-F945 HydrophobicContact CB-CZ 3.89Å; N919-F945 VanDerWaalsContact ND2-CE2 3.29Å; N919-F945 WeakPolarHBondContact ND2-CE2 3.32Å; N919-F945 WeakPolarHBondContact ND2-CZ 3.43Å; N919-F945 WeakPolarHBondContact OD1-CZ 3.41Å; Y921-F945 HydrophobicContact CD1-CD2 4.06Å; Y921-F945 AromaticContact CE1-CD2 3.51Å; Y921-F945 HydrophobicContact CE1-CD2 3.51Å; Y921-F945 AromaticContact CE1-CE2 3.86Å; Y921-F945 HydrophobicContact CE1-CE2 3.86Å; Y921-F945 AromaticContact CZ-CD2 3.97Å; Y921-F945 AromaticContact CZ-CE2 3.86Å; F945-P947 HydrophobicContact CE1-CB 4.48Å
946	I	90.1	Very high	85.3	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	113.4	178.7	-51.4	171.1	0	0	0	108.8	A829 L844 N919 I920 I944	A829-I946 HydrophobicContact CB-CD1 3.73Å; A829-I946 HydrophobicContact CB-CG1 4.4Å; L844-I946 HydrophobicContact CD1-CD1 3.69Å; L844-I946 HydrophobicContact CD2-CD1 3.57Å; L844-I946 HydrophobicContact CG-CD1 4.26Å; N919-I946 CarbonylContact C-O 3.58Å; N919-I946 WeakPolarHBondContact CA-O 3.42Å; I920-I946 HydrophobicContact CB-CB 4.24Å; I920-I946 PolarHBondContact N-O 3.16Å; I920-I946 PolarHBondContact O-N 2.91Å; I944-I946 HydrophobicContact CG2-CD1 4.24Å; I944-I946 HydrophobicContact CG2-CG1 4.03Å
947	P	89.1	Confident	85.3	Confident	55 Å²	55	52.9 Å²	52.9	36%	0.357	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	137.9	173.3	28.1	-34.1	0	0	0	111.3	K832 S833 M834 N919 F945	K832-P947 VanDerWaalsContact O-CD 3.31Å; K832-P947 WeakPolarHBondContact O-CD 3.42Å; S833-P947 WeakPolarHBondContact CA-O 3.32Å; M834-P947 PolarHBondContact N-O 2.78Å; M834-P947 VanDerWaalsContact N-O 3.1Å; N919-P947 WeakPolarHBondContact OD1-CA 3.43Å; F945-P947 HydrophobicContact CE1-CB 4.48Å
948	V	87.4	Confident	85.4	Confident	6 Å²	6	50.5 Å²	50.5	4%	0.036	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	140.8	-173.8	-179.7	0	0	0	0	111.9	M834 I836 E918 I920 Y950	M834-V948 WeakPolarHBondContact O-CA 3.28Å; I836-V948 HydrophobicContact CB-CG1 4.44Å; I836-V948 HydrophobicContact CD1-CG1 3.43Å; I836-V948 VanDerWaalsContact CD1-CG1 3.43Å; I836-V948 HydrophobicContact CG1-CG1 3.65Å; E918-V948 PolarHBondContact O-N 3.07Å; I920-V948 HydrophobicContact CB-CG2 4.47Å; I920-V948 HydrophobicContact CD1-CG2 3.5Å; I920-V948 HydrophobicContact CG1-CG2 3.64Å; V948-Y950 HydrophobicContact CG1-CD2 4.45Å; V948-Y950 HydrophobicContact CG1-CE1 4.41Å; V948-Y950 HydrophobicContact CG1-CE2 3.9Å
949	K	85	Confident	85.3	Confident	104 Å²	104	46.6 Å²	46.6	45%	0.452	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	153.6	165	-68	-176.4	176.4	-178.6	0	110.2	M834 L835 I836 L1111	M834-K949 PolarHBondContact O-N 2.82Å; L835-K949 CarbonylContact C-O 3.41Å; L835-K949 WeakPolarHBondContact CA-O 3.41Å; L835-K949 HydrophobicContact CD1-CB 3.77Å; I836-K949 PolarHBondContact N-O 3.39Å; K949-L1111 CarbonylContact C-O 3.58Å; K949-L1111 WeakPolarHBondContact CA-O 3.44Å
950	Y	81.9	Confident	84.9	Confident	7 Å²	7	49.1 Å²	49.1	3%	0.027	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	134.3	179.4	-60	-96.7	0	0	0	109.7	I836 N869 I916 H917 V948 L1111 F1112 E1113	I836-Y950 HydrophobicContact CB-CD1 4.01Å; I836-Y950 HydrophobicContact CB-CE1 4.28Å; I836-Y950 HydrophobicContact CD1-CD1 4.3Å; I836-Y950 HydrophobicContact CD1-CE1 3.69Å; I836-Y950 HydrophobicContact CG2-CD1 4.2Å; I836-Y950 HydrophobicContact CG2-CE1 4.43Å; N869-Y950 PolarHBondContact ND2-OH 3.49Å; I916-Y950 HydrophobicContact CG2-CD2 3.94Å; I916-Y950 HydrophobicContact CG2-CE2 3.76Å; H917-Y950 PolarHBondContact N-OH 3.1Å; H917-Y950 VanDerWaalsContact O-CE2 3.22Å; H917-Y950 WeakPolarHBondContact O-CE2 3.4Å; H917-Y950 PolarHBondContact O-OH 2.89Å; V948-Y950 HydrophobicContact CG1-CD2 4.45Å; V948-Y950 HydrophobicContact CG1-CE1 4.41Å; V948-Y950 HydrophobicContact CG1-CE2 3.9Å; Y950-L1111 PolarHBondContact N-O 3.18Å; Y950-F1112 CarbonylContact O-C 3.54Å; Y950-F1112 VanDerWaalsContact O-CA 3.25Å; Y950-F1112 WeakPolarHBondContact O-CA 3.31Å; Y950-E1113 PolarHBondContact O-N 2.71Å
951	E	79.3	Confident	83.8	Confident	53 Å²	53	52.7 Å²	52.7	25%	0.248	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	136	167	-171	174.1	-163.9	0	0	109.1	I836 H837 V838 E1113 G1115	I836-E951 PolarHBondContact O-N 3.45Å; H837-E951 IonicContact CE1-OE2 3.9Å; H837-E951 IonicContact CG-OE2 3.7Å; H837-E951 IonicContact ND1-OE2 3.58Å; H837-E951 PolarHBondContact ND1-OE2 3.46Å; V838-E951 WeakPolarHBondContact CG2-O 3.44Å; E951-E1113 CarbonylContact C-O 3.52Å; E951-E1113 VanDerWaalsContact CA-O 3.3Å; E951-E1113 WeakPolarHBondContact CA-O 2.93Å; E951-G1115 WeakPolarHBondContact OE1-CA 3.4Å
952	A	73.2	Confident	82.5	Confident	4 Å²	4	54.6 Å²	54.6	3%	0.033	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	123.2	171.7	0	0	0	0	0	110.3	V954 F1106 F1112 E1113 L1114	A952-V954 HydrophobicContact CB-CG2 4.08Å; A952-V954 PolarHBondContact O-N 3.49Å; A952-F1106 HydrophobicContact CB-CE1 4.22Å; A952-F1106 HydrophobicContact CB-CE2 4.47Å; A952-F1106 HydrophobicContact CB-CZ 3.51Å; A952-F1112 HydrophobicContact CB-CD1 4.42Å; A952-E1113 PolarHBondContact N-O 2.98Å; A952-L1114 HydrophobicContact CB-CD2 4.42Å
953	G	72.9	Confident	81.2	Confident	12 Å²	12	53 Å²	53	12%	0.124	28%	0.283	C	S	.	.			trans	-74.1	70.4	178.5	0	0	0	0	0	112.3	A996	G953-A996 VanDerWaalsContact O-CB 3.31Å; G953-A996 WeakPolarHBondContact O-CB 3.34Å; G953-A996 PolarHBondContact O-N 3.15Å
954	V	78.9	Confident	80.2	Confident	14 Å²	14	51.7 Å²	51.7	9%	0.085	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	127.9	-177.3	-178.8	0	0	0	0	110.3	A952 V993 T1001 L1004 L1104 L1114 A1118	A952-V954 HydrophobicContact CB-CG2 4.08Å; A952-V954 PolarHBondContact O-N 3.49Å; V954-V993 HydrophobicContact CG1-CG1 3.56Å; V954-T1001 HydrophobicContact CG2-CG2 3.89Å; V954-L1004 HydrophobicContact CG1-CD1 4.2Å; V954-L1004 HydrophobicContact CG2-CD1 4.2Å; V954-L1104 HydrophobicContact CG1-CD1 4.44Å; V954-L1114 HydrophobicContact CB-CD2 4.35Å; V954-L1114 HydrophobicContact CG2-CD2 4.38Å; V954-A1118 WeakPolarHBondContact O-CB 3.47Å
955	I	81.7	Confident	79.3	Confident	89 Å²	89	51.2 Å²	51.2	46%	0.456	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	110.7	173.4	-57.2	174.1	0	0	0	107.9	E994 A996	I955-E994 HydrophobicContact CB-CB 4.41Å; I955-E994 PolarHBondContact N-O 2.88Å; I955-E994 PolarHBondContact O-N 3Å; I955-A996 HydrophobicContact CD1-CB 4.16Å; I955-A996 HydrophobicContact CG1-CB 4.18Å
956	F	86.5	Confident	78.3	Confident	3 Å²	3	48.3 Å²	48.3	1%	0.013	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	115.9	175.1	-175.9	-148.8	0	0	0	110.5	V958 Y991 V993 L1006 A1102 L1104 R1121	F956-V958 HydrophobicContact CE2-CG2 4.28Å; F956-V958 HydrophobicContact CZ-CG2 4.28Å; F956-Y991 HydrophobicContact CE2-CD1 4.1Å; F956-Y991 HydrophobicContact CZ-CD1 4.04Å; F956-V993 HydrophobicContact CD2-CG2 4.03Å; F956-V993 HydrophobicContact CE2-CG2 4.4Å; F956-L1006 HydrophobicContact CE2-CD1 4.05Å; F956-L1006 HydrophobicContact CZ-CD1 3.76Å; F956-A1102 HydrophobicContact CE1-CB 4.41Å; F956-A1102 HydrophobicContact CZ-CB 3.89Å; F956-L1104 HydrophobicContact CB-CD1 3.62Å; F956-L1104 HydrophobicContact CD1-CD1 3.72Å; F956-L1104 HydrophobicContact CD1-CG 4.04Å; F956-L1104 HydrophobicContact CD2-CD1 3.79Å; F956-L1104 HydrophobicContact CD2-CG 4.38Å; F956-L1104 HydrophobicContact CE1-CD1 4.31Å; F956-L1104 HydrophobicContact CE1-CG 4.16Å; F956-L1104 HydrophobicContact CE2-CD1 4.38Å; F956-L1104 HydrophobicContact CE2-CG 4.5Å; F956-L1104 HydrophobicContact CG-CD1 3.44Å; F956-L1104 VanDerWaalsContact CG-CD1 3.44Å; F956-L1104 HydrophobicContact CG-CG 4.17Å; F956-L1104 HydrophobicContact CZ-CG 4.4Å; F956-R1121 HydrophobicContact CD1-CB 4.18Å; F956-R1121 HydrophobicContact CD1-CG 3.32Å; F956-R1121 HydrophobicContact CE1-CB 3.59Å; F956-R1121 HydrophobicContact CE1-CG 3.25Å; F956-R1121 HydrophobicContact CE2-CG 4.47Å; F956-R1121 HydrophobicContact CG-CG 3.98Å; F956-R1121 HydrophobicContact CZ-CB 3.99Å; F956-R1121 HydrophobicContact CZ-CG 3.87Å; F956-R1121 VanDerWaalsContact O-CZ 3.23Å; F956-R1121 PolarHBondContact O-NE 3.28Å; F956-R1121 PolarHBondContact O-NH2 3.4Å
957	S	85.2	Confident	77.3	Confident	48 Å²	48	48.7 Å²	48.7	34%	0.336	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	152	-179.9	60.9	0	0	0	0	111.8	T992	S957-T992 PolarHBondContact N-O 3.19Å; S957-T992 PolarHBondContact O-N 2.91Å; S957-T992 WeakPolarHBondContact OG-CB 3.44Å; S957-T992 PolarHBondContact OG-O 2.89Å
958	V	86.8	Confident	76	Confident	39 Å²	39	54.6 Å²	54.6	24%	0.236	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	132.1	-179.8	-178.9	0	0	0	0	109.3	F956 I989 S990 Y991 R1121 V1123	F956-V958 HydrophobicContact CE2-CG2 4.28Å; F956-V958 HydrophobicContact CZ-CG2 4.28Å; V958-I989 HydrophobicContact CG1-CG2 3.71Å; V958-S990 WeakPolarHBondContact CA-O 3.27Å; V958-Y991 HydrophobicContact CG1-CD1 4.23Å; V958-Y991 HydrophobicContact CG1-CE1 4.1Å; V958-Y991 HydrophobicContact CG2-CD1 3.59Å; V958-Y991 HydrophobicContact CG2-CE1 3.92Å; V958-R1121 HydrophobicContact CG2-CB 3.48Å; V958-R1121 VanDerWaalsContact CG2-CB 3.48Å; V958-R1121 HydrophobicContact CG2-CG 3.71Å; V958-V1123 HydrophobicContact CG1-CG2 3.47Å; V958-V1123 VanDerWaalsContact CG1-CG2 3.47Å
959	S	81.5	Confident	74.2	Confident	63 Å²	63	59.7 Å²	59.7	44%	0.441	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	151.7	173.3	61.1	0	0	0	0	110.8	S990	S959-S990 PolarHBondContact N-O 3.04Å; S959-S990 PolarHBondContact O-N 3.02Å; S959-S990 WeakPolarHBondContact OG-CB 3.34Å
960	H	78.8	Confident	72.7	Confident	88 Å²	88	58.1 Å²	58.1	41%	0.407	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	143.5	-179.6	53.2	-88.1	0	0	0	110.2	N988	H960-N988 WeakPolarHBondContact CA-O 3.41Å
961	S	64.7	Low	70.7	Confident	83 Å²	83	64.6 Å²	64.6	58%	0.58	36%	0.357	S	S	*	.	S	Bend	trans	-85.7	-37	-175	56.8	0	0	0	0	113.6	N988	S961-N988 PolarHBondContact N-O 2.82Å
962	Q	64.1	Low	69.1	Low	99 Å²	99	71.5 Å²	71.5	46%	0.463	39%	0.389	S	S	.	.			trans	-147.6	133.5	177.2	-75.8	177.4	-35.5	0	0	108.6
963	N	65.3	Low	67.5	Low	69 Å²	69	75 Å²	75	37%	0.369	41%	0.413	S	S	.	.			trans	-117.6	9.9	-179.6	65.5	-9.6	0	0	0	113.3	L1126	N963-L1126 PolarHBondContact O-N 3.24Å
964	Y	70.8	Confident	66	Low	122 Å²	122	79.8 Å²	79.8	48%	0.478	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	137.9	176.2	67.8	-86.9	0	0	0	110.6	L1126	Y964-L1126 CarbonylContact C-O 3.49Å; Y964-L1126 VanDerWaalsContact CA-O 3.22Å; Y964-L1126 WeakPolarHBondContact CA-O 3.47Å
965	I	72.3	Confident	64.2	Low	4 Å²	4	85 Å²	85	2%	0.021	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	129	175.1	-63.2	175.1	0	0	0	107	I967 E985 V987 A1083 I1125 L1126 I1127 S1128	I965-I967 HydrophobicContact CG2-CG1 4.45Å; I965-E985 WeakPolarHBondContact CA-OE2 3.12Å; I965-E985 HydrophobicContact CG2-CB 4.32Å; I965-E985 VanDerWaalsContact CG2-OE2 3.28Å; I965-E985 WeakPolarHBondContact CG2-OE2 3.5Å; I965-V987 HydrophobicContact CD1-CG2 3.8Å; I965-V987 HydrophobicContact CG1-CG2 3.96Å; I965-A1083 HydrophobicContact CD1-CB 3.67Å; I965-I1125 HydrophobicContact CD1-CG2 4.25Å; I965-L1126 PolarHBondContact N-O 2.95Å; I965-I1127 HydrophobicContact CB-CG1 4.21Å; I965-I1127 HydrophobicContact CD1-CG1 4.45Å; I965-I1127 WeakPolarHBondContact O-CA 3Å; I965-S1128 PolarHBondContact O-N 3.07Å
966	T	69.8	Low	62.2	Low	52 Å²	52	89.2 Å²	89.2	32%	0.319	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.2	179.2	-45.4	0	0	0	0	110	E985	T966-E985 PolarHBondContact N-OE2 3.22Å
967	I	68.3	Low	60.3	Low	9 Å²	9	95.7 Å²	95.7	5%	0.046	53%	0.527	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	116.4	178.7	-58.1	177	0	0	0	108.3	I965 F1088 T1089 F1093 I1127 S1128 G1130	I965-I967 HydrophobicContact CG2-CG1 4.45Å; I967-F1088 HydrophobicContact CD1-CB 3.22Å; I967-F1088 HydrophobicContact CD1-CD2 4.27Å; I967-F1088 HydrophobicContact CD1-CG 3.89Å; I967-T1089 HydrophobicContact CG2-CG2 4.25Å; I967-F1093 HydrophobicContact CD1-CZ 4.38Å; I967-I1127 HydrophobicContact CD1-CG2 3.76Å; I967-I1127 HydrophobicContact CG1-CG2 4.29Å; I967-S1128 PolarHBondContact N-O 3.23Å; I967-G1130 PolarHBondContact O-N 2.98Å
968	E	62.3	Low	58	Low	178 Å²	178	98.9 Å²	98.9	83%	0.832	55%	0.549	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	133.8	174.9	-62.6	-172.9	170.7	0	0	110.4	G970	E968-G970 PolarHBondContact O-N 2.71Å
969	D	49.8	Very low	55.9	Low	113 Å²	113	102.8 Å²	102.8	60%	0.604	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	107.2	179.3	-139.1	0.3	0	0	0	109	K1129	D969-K1129 WeakPolarHBondContact OD1-CE 3.36Å; D969-K1129 IonicContact OD1-NZ 2.98Å; D969-K1129 PolarHBondContact OD1-NZ 2.56Å; D969-K1129 WeakPolarHBondContact OD2-CE 3.09Å; D969-K1129 IonicContact OD2-NZ 3.35Å; D969-K1129 PolarHBondContact OD2-NZ 2.79Å
970	G	51.9	Low	54.2	Low	72 Å²	72	105.3 Å²	105.3	74%	0.742	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	158.5	-12.7	174.7	0	0	0	0	0	119.4	E968 Q972	E968-G970 PolarHBondContact O-N 2.71Å; G970-Q972 PolarHBondContact O-N 3.34Å
971	E	41.6	Very low	52.5	Low	142 Å²	142	104.7 Å²	104.7	66%	0.664	59%	0.589	S	S	*	*			trans	-86.4	102.9	179.6	-79.8	-173	140.8	0	0	112.8	S973 M983	E971-S973 PolarHBondContact O-N 3.19Å; E971-S973 VanDerWaalsContact O-N 3.07Å; E971-M983 VanDerWaalsContact CD-CE 3.41Å; E971-M983 WeakPolarHBondContact OE1-CE 3.48Å; E971-M983 WeakPolarHBondContact OE2-CE 3.37Å
972	Q	44.3	Very low	51.4	Low	199 Å²	199	111.3 Å²	111.3	93%	0.93	60%	0.601	S	S	*	*			trans	-70.2	91.4	161.6	-113.8	172.7	-12.5	0	0	109.5	G970 S974	G970-Q972 PolarHBondContact O-N 3.34Å; Q972-S974 PolarHBondContact O-N 2.99Å
973	S	40.4	Very low	50.7	Low	76 Å²	76	110.3 Å²	110.3	53%	0.531	60%	0.598	S	S	.	*			trans	-79.6	98.6	174.9	-30.9	0	0	0	0	110.4	E971 V975	E971-S973 PolarHBondContact O-N 3.19Å; E971-S973 VanDerWaalsContact O-N 3.07Å; S973-V975 PolarHBondContact O-N 3.37Å
974	S	40.7	Very low	49.9	Very low	114 Å²	114	110.5 Å²	110.5	80%	0.797	60%	0.598	S	S	*	*			trans	-64.2	115.7	155.1	64	0	0	0	0	108.3	Q972 K976	Q972-S974 PolarHBondContact O-N 2.99Å; S974-K976 PolarHBondContact O-N 2.7Å
975	V	41.7	Very low	49.4	Very low	122 Å²	122	108.5 Å²	108.5	74%	0.739	59%	0.593	S	S	*	*			trans	-74.6	113.1	-173.2	179	0	0	0	0	109.9	S973	S973-V975 PolarHBondContact O-N 3.37Å
976	K	40.3	Very low	49.5	Very low	179 Å²	179	112.2 Å²	112.2	78%	0.778	61%	0.61	S	S	*	*			trans	-122.6	135.6	155.7	-79.9	-172.3	178	-180	0	109.3	S974 S978	S974-K976 PolarHBondContact O-N 2.7Å; K976-S978 PolarHBondContact O-N 3.11Å
977	D	45.6	Very low	50	Low	139 Å²	139	109.9 Å²	109.9	74%	0.743	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	12.2	-163.8	-118.5	-12.9	0	0	0	116.8	F980	D977-F980 WeakPolarHBondContact OD1-CE2 3.4Å
978	S	37.8	Very low	50.7	Low	114 Å²	114	112.6 Å²	112.6	80%	0.797	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123	2.9	-170.4	42.6	0	0	0	0	116.1	K976	K976-S978 PolarHBondContact O-N 3.11Å
979	D	41.6	Very low	51.9	Low	122 Å²	122	104.2 Å²	104.2	65%	0.652	57%	0.571	S	S	*	*			trans	-117.4	27.4	-180	-118.8	-16.7	0	0	0	113.4	G981	D979-G981 PolarHBondContact O-N 3.21Å; D979-G981 VanDerWaalsContact O-N 3.11Å
980	F	45.7	Very low	53.7	Low	115 Å²	115	99.4 Å²	99.4	50%	0.504	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-10.5	-177.4	-91.5	-85.2	0	0	0	115.2	D977	D977-F980 WeakPolarHBondContact OD1-CE2 3.4Å
981	G	44.5	Very low	55.5	Low	76 Å²	76	96 Å²	96	78%	0.784	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-12.9	-175.8	0	0	0	0	0	115.9	D979	D979-G981 PolarHBondContact O-N 3.21Å; D979-G981 VanDerWaalsContact O-N 3.11Å
982	R	41.3	Very low	57.7	Low	221 Å²	221	89.9 Å²	89.9	83%	0.834	48%	0.484	S	S	*	.	S	Bend	trans	-105.3	5.4	-172.1	-92.1	-175.9	178.7	170.4	0.6	116.2
983	M	49	Very low	59.7	Low	79 Å²	79	80.9 Å²	80.9	39%	0.389	44%	0.442	S	S	.	.	S	Bend	trans	-133.6	58.8	-176.1	-71.5	-171.8	176.7	0	0	113.4	E971 K1085	E971-M983 VanDerWaalsContact CD-CE 3.41Å; E971-M983 WeakPolarHBondContact OE1-CE 3.48Å; E971-M983 WeakPolarHBondContact OE2-CE 3.37Å; M983-K1085 WeakPolarHBondContact O-CE 3.41Å
984	I	49.1	Very low	61.8	Low	73 Å²	73	81 Å²	81	37%	0.374	43%	0.434	S	S	.	.			trans	-144.4	116.5	-179.2	-51.7	178.7	0	0	0	110.9	E986 K1082	I984-E986 HydrophobicContact CG2-CG 3.71Å; I984-K1082 HydrophobicContact CD1-CD 4.08Å; I984-K1082 HydrophobicContact CG2-CB 4.41Å; I984-K1082 HydrophobicContact CG2-CD 3.52Å; I984-K1082 HydrophobicContact CG2-CG 3.87Å
985	E	60.6	Low	63.6	Low	80 Å²	80	77.3 Å²	77.3	37%	0.374	40%	0.404	S	S	.	.			trans	-88.8	123.8	159.4	-69.2	-173.4	159.9	0	0	107.5	I965 T966	I965-E985 WeakPolarHBondContact CA-OE2 3.12Å; I965-E985 HydrophobicContact CG2-CB 4.32Å; I965-E985 VanDerWaalsContact CG2-OE2 3.28Å; I965-E985 WeakPolarHBondContact CG2-OE2 3.5Å; T966-E985 PolarHBondContact N-OE2 3.22Å
986	E	73.5	Confident	64.8	Low	81 Å²	81	73.1 Å²	73.1	38%	0.379	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	133.8	-176	-62.5	-174.4	164.9	0	0	110	I984 T1080 K1082	I984-E986 HydrophobicContact CG2-CG 3.71Å; E986-T1080 HydrophobicContact CB-CG2 3.95Å; E986-T1080 HydrophobicContact CG-CG2 4.25Å; E986-K1082 HydrophobicContact CG-CG 4.33Å; E986-K1082 WeakPolarHBondContact OE1-CE 3.09Å; E986-K1082 IonicContact OE1-NZ 3.57Å; E986-K1082 PolarHBondContact OE1-NZ 3.43Å
987	V	79.2	Confident	66	Low	4 Å²	4	67 Å²	67	2%	0.024	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	114.3	174.5	175.7	0	0	0	0	108.7	I965 I989 F1081 I1125	I965-V987 HydrophobicContact CD1-CG2 3.8Å; I965-V987 HydrophobicContact CG1-CG2 3.96Å; V987-I989 HydrophobicContact CG1-CD1 4.43Å; V987-I989 HydrophobicContact CG1-CG1 4.04Å; V987-F1081 PolarHBondContact N-O 3.13Å; V987-F1081 PolarHBondContact O-N 3.02Å; V987-I1125 HydrophobicContact CB-CD1 4.44Å; V987-I1125 HydrophobicContact CG1-CD1 3.99Å; V987-I1125 HydrophobicContact CG1-CG1 4.23Å; V987-I1125 HydrophobicContact CG2-CG2 4.21Å
988	N	84.6	Confident	66.6	Low	66 Å²	66	68.3 Å²	68.3	35%	0.353	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	118.9	176.9	-67.1	-35.9	0	0	0	109.9	H960 S961 T1080	H960-N988 WeakPolarHBondContact CA-O 3.41Å; S961-N988 PolarHBondContact N-O 2.82Å; N988-T1080 WeakPolarHBondContact OD1-CB 3.19Å; N988-T1080 VanDerWaalsContact OD1-CG2 3.31Å; N988-T1080 WeakPolarHBondContact OD1-CG2 3.49Å; N988-T1080 PolarHBondContact OD1-OG1 2.79Å
989	I	86.8	Confident	67.7	Low	1 Å²	1	63.9 Å²	63.9	1%	0.005	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	126.5	174.3	-54.5	178.5	0	0	0	108.3	V958 V987 Y991 V1079 F1081 V1100 V1123 I1125	V958-I989 HydrophobicContact CG1-CG2 3.71Å; V987-I989 HydrophobicContact CG1-CD1 4.43Å; V987-I989 HydrophobicContact CG1-CG1 4.04Å; I989-Y991 HydrophobicContact CB-CE2 4.22Å; I989-Y991 HydrophobicContact CG2-CD2 4.3Å; I989-Y991 HydrophobicContact CG2-CE1 3.97Å; I989-Y991 HydrophobicContact CG2-CE2 3.66Å; I989-Y991 VanDerWaalsContact CG2-CZ 3.47Å; I989-V1079 PolarHBondContact N-O 2.82Å; I989-V1079 PolarHBondContact O-N 3.28Å; I989-F1081 HydrophobicContact CD1-CD2 3.87Å; I989-F1081 HydrophobicContact CD1-CE2 3.87Å; I989-F1081 HydrophobicContact CG1-CD2 4.23Å; I989-F1081 HydrophobicContact CG1-CE2 4.42Å; I989-V1100 HydrophobicContact CD1-CB 4.47Å; I989-V1100 HydrophobicContact CD1-CG2 4.43Å; I989-V1123 HydrophobicContact CD1-CB 4.12Å; I989-V1123 HydrophobicContact CD1-CG1 3.85Å; I989-V1123 HydrophobicContact CD1-CG2 4.46Å; I989-V1123 HydrophobicContact CG1-CG1 4.39Å; I989-V1123 HydrophobicContact CG2-CG2 4.09Å; I989-I1125 HydrophobicContact CD1-CD1 4.41Å
990	S	88.7	Confident	68.7	Low	13 Å²	13	63.1 Å²	63.1	9%	0.091	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	118.1	178.6	-177.4	0	0	0	0	110.4	V958 S959 Q1076 N1078	V958-S990 WeakPolarHBondContact CA-O 3.27Å; S959-S990 PolarHBondContact N-O 3.04Å; S959-S990 PolarHBondContact O-N 3.02Å; S959-S990 WeakPolarHBondContact OG-CB 3.34Å; S990-Q1076 PolarHBondContact OG-NE2 2.91Å; S990-N1078 WeakPolarHBondContact CB-OD1 3.44Å; S990-N1078 PolarHBondContact OG-OD1 3.07Å
991	Y	89.6	Confident	69.7	Low	1 Å²	1	58.1 Å²	58.1	0%	0.004	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	122.8	175	-59.2	-81.1	0	0	0	108.9	F956 V958 I989 L1006 V1008 Q1076 V1077 V1079 V1100 A1102	F956-Y991 HydrophobicContact CE2-CD1 4.1Å; F956-Y991 HydrophobicContact CZ-CD1 4.04Å; V958-Y991 HydrophobicContact CG1-CD1 4.23Å; V958-Y991 HydrophobicContact CG1-CE1 4.1Å; V958-Y991 HydrophobicContact CG2-CD1 3.59Å; V958-Y991 HydrophobicContact CG2-CE1 3.92Å; I989-Y991 HydrophobicContact CB-CE2 4.22Å; I989-Y991 HydrophobicContact CG2-CD2 4.3Å; I989-Y991 HydrophobicContact CG2-CE1 3.97Å; I989-Y991 HydrophobicContact CG2-CE2 3.66Å; I989-Y991 VanDerWaalsContact CG2-CZ 3.47Å; Y991-L1006 HydrophobicContact CG-CD2 4.24Å; Y991-V1008 HydrophobicContact CE2-CG1 4.39Å; Y991-V1008 HydrophobicContact CE2-CG2 4.05Å; Y991-Q1076 WeakPolarHBondContact O-CA 3.46Å; Y991-V1077 PolarHBondContact N-O 3.37Å; Y991-V1077 PolarHBondContact O-N 2.97Å; Y991-V1079 HydrophobicContact CD2-CG2 4.11Å; Y991-V1079 HydrophobicContact CE2-CB 4.49Å; Y991-V1079 HydrophobicContact CE2-CG2 3.96Å; Y991-V1100 WeakPolarHBondContact OH-CG1 3.3Å; Y991-A1102 HydrophobicContact CD1-CB 3.79Å; Y991-A1102 HydrophobicContact CE1-CB 3.26Å
992	T	87.6	Confident	71.1	Confident	13 Å²	13	55.5 Å²	55.5	8%	0.08	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	125.1	178.5	-57.1	0	0	0	0	109.8	S957 K1074 S1075	S957-T992 PolarHBondContact N-O 3.19Å; S957-T992 PolarHBondContact O-N 2.91Å; S957-T992 WeakPolarHBondContact OG-CB 3.44Å; S957-T992 PolarHBondContact OG-O 2.89Å; T992-K1074 HydrophobicContact CG2-CG 4.26Å; T992-S1075 WeakPolarHBondContact CA-O 3.22Å
993	V	86.4	Confident	73	Confident	9 Å²	9	46.9 Å²	46.9	6%	0.055	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	118.7	174.8	-176.1	0	0	0	0	107.3	V954 F956 L1004 I1069 K1074 S1075 L1104	V954-V993 HydrophobicContact CG1-CG1 3.56Å; F956-V993 HydrophobicContact CD2-CG2 4.03Å; F956-V993 HydrophobicContact CE2-CG2 4.4Å; V993-L1004 HydrophobicContact CG1-CD1 4.03Å; V993-I1069 HydrophobicContact CB-CD1 4.45Å; V993-I1069 HydrophobicContact CG2-CD1 3.81Å; V993-K1074 WeakPolarHBondContact O-CA 3.13Å; V993-S1075 PolarHBondContact N-O 3.43Å; V993-S1075 PolarHBondContact O-N 3.05Å; V993-L1104 HydrophobicContact CG1-CD1 4.49Å; V993-L1104 HydrophobicContact CG2-CD1 4.19Å; V993-L1104 HydrophobicContact CG2-CD2 4.12Å
994	E	83.3	Confident	74.7	Confident	78 Å²	78	43.5 Å²	43.5	36%	0.364	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	142.4	-176.8	-177.3	167.5	-168.4	0	0	110.6	I955	I955-E994 HydrophobicContact CB-CB 4.41Å; I955-E994 PolarHBondContact N-O 2.88Å; I955-E994 PolarHBondContact O-N 3Å
995	K	78.1	Confident	76.5	Confident	38 Å²	38	41.5 Å²	41.5	17%	0.165	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	127.6	178.6	-178.7	172.7	142.1	162.7	0	110.4	G997 N998 T999 T1001 N1073	K995-G997 WeakPolarHBondContact CE-O 3.24Å; K995-G997 WeakPolarHBondContact CG-O 3.47Å; K995-G997 PolarHBondContact O-N 3.36Å; K995-N998 VanDerWaalsContact CE-C 3.48Å; K995-T999 VanDerWaalsContact CD-O 3.32Å; K995-T999 WeakPolarHBondContact CD-O 3.46Å; K995-T999 VanDerWaalsContact CE-N 3.31Å; K995-T999 WeakPolarHBondContact CE-O 3.3Å; K995-T999 PolarHBondContact NZ-O 3.45Å; K995-T1001 HydrophobicContact CD-CG2 4.38Å; K995-T1001 HydrophobicContact CG-CG2 4.23Å; K995-N1073 PolarHBondContact N-O 3.14Å
996	A	67.7	Low	77.8	Confident	34 Å²	34	37.7 Å²	37.7	28%	0.281	22%	0.221	S	C	.	.			trans	-80.9	99.2	173.9	0	0	0	0	0	109.8	G953 I955 T999	G953-A996 VanDerWaalsContact O-CB 3.31Å; G953-A996 WeakPolarHBondContact O-CB 3.34Å; G953-A996 PolarHBondContact O-N 3.15Å; I955-A996 HydrophobicContact CD1-CB 4.16Å; I955-A996 HydrophobicContact CG1-CB 4.18Å; A996-T999 PolarHBondContact O-OG1 2.82Å
997	G	64.8	Low	78.6	Confident	51 Å²	51	35.7 Å²	35.7	53%	0.526	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.4	-150.7	177.8	0	0	0	0	0	114	K995 T999	K995-G997 WeakPolarHBondContact CE-O 3.24Å; K995-G997 WeakPolarHBondContact CG-O 3.47Å; K995-G997 PolarHBondContact O-N 3.36Å; G997-T999 PolarHBondContact O-N 2.55Å
998	N	58.8	Low	79	Confident	165 Å²	165	35.5 Å²	35.5	88%	0.882	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.5	22.1	-174	-80.2	-1.3	0	0	0	114.7	K995	K995-N998 VanDerWaalsContact CE-C 3.48Å
999	T	60.5	Low	79.1	Confident	21 Å²	21	34.6 Å²	34.6	13%	0.129	21%	0.206	C	C	.	.			trans	-74.9	136.6	-172	51.5	0	0	0	0	114.5	V838 K995 A996 G997 T1001	V838-T999 HydrophobicContact CB-CG2 4.41Å; V838-T999 HydrophobicContact CG1-CG2 3.38Å; V838-T999 HydrophobicContact CG2-CG2 4.09Å; K995-T999 VanDerWaalsContact CD-O 3.32Å; K995-T999 WeakPolarHBondContact CD-O 3.46Å; K995-T999 VanDerWaalsContact CE-N 3.31Å; K995-T999 WeakPolarHBondContact CE-O 3.3Å; K995-T999 PolarHBondContact NZ-O 3.45Å; A996-T999 PolarHBondContact O-OG1 2.82Å; G997-T999 PolarHBondContact O-N 2.55Å; T999-T1001 PolarHBondContact O-N 3.35Å
1000	L	62.5	Low	79.1	Confident	107 Å²	107	34.7 Å²	34.7	56%	0.56	21%	0.206	S	C	*	.			trans	-63.1	129.4	172.7	-99.8	105.3	0	0	0	110	I916	I916-L1000 HydrophobicContact CD1-CB 3.78Å
1001	T	67.1	Low	78.9	Confident	9 Å²	9	34.1 Å²	34.1	6%	0.055	20%	0.202	C	C	.	.			trans	-130.5	111.6	-177.7	48.1	0	0	0	0	109.2	V954 K995 T999 E1071	V954-T1001 HydrophobicContact CG2-CG2 3.89Å; K995-T1001 HydrophobicContact CD-CG2 4.38Å; K995-T1001 HydrophobicContact CG-CG2 4.23Å; T999-T1001 PolarHBondContact O-N 3.35Å; T1001-E1071 PolarHBondContact N-OE1 2.94Å; T1001-E1071 WeakPolarHBondContact O-CB 3.36Å; T1001-E1071 WeakPolarHBondContact O-CG 3.29Å
1002	P	73.9	Confident	78.6	Confident	22 Å²	22	35.3 Å²	35.3	14%	0.143	21%	0.207	C	C	.	.			trans	-67.1	166.1	-179.1	27.2	-32.9	0	0	0	111.8	L1004 F1106 N1109 F1112	P1002-L1004 PolarHBondContact O-N 3.46Å; P1002-F1106 HydrophobicContact CB-CD1 4.48Å; P1002-F1106 HydrophobicContact CG-CD1 3.64Å; P1002-F1106 HydrophobicContact CG-CE1 3.62Å; P1002-F1106 HydrophobicContact CG-CG 4.48Å; P1002-F1106 HydrophobicContact CG-CZ 4.46Å; P1002-N1109 HydrophobicContact CB-CB 4.36Å; P1002-N1109 HydrophobicContact CG-CB 4.26Å; P1002-F1112 HydrophobicContact CG-CB 4.24Å; P1002-F1112 HydrophobicContact CG-CD1 4.48Å; P1002-F1112 HydrophobicContact CG-CD2 3.75Å; P1002-F1112 HydrophobicContact CG-CE2 4.14Å; P1002-F1112 HydrophobicContact CG-CG 3.91Å
1003	A	80.6	Confident	78.2	Confident	40 Å²	40	37.7 Å²	37.7	33%	0.331	21%	0.214	S	C	.	.			trans	-56.9	131.3	179.9	0	0	0	0	0	112.2	I1069 K1107	A1003-I1069 WeakPolarHBondContact CA-O 3.43Å; A1003-K1107 PolarHBondContact O-N 3.09Å; A1003-K1107 VanDerWaalsContact O-N 3.12Å
1004	L	85.9	Confident	77.7	Confident	8 Å²	8	37.3 Å²	37.3	4%	0.042	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	145.1	-177.6	-70.6	162.1	0	0	0	109.8	V954 V993 P1002 I1069 T1105 F1106 L1114	V954-L1004 HydrophobicContact CG1-CD1 4.2Å; V954-L1004 HydrophobicContact CG2-CD1 4.2Å; V993-L1004 HydrophobicContact CG1-CD1 4.03Å; P1002-L1004 PolarHBondContact O-N 3.46Å; L1004-I1069 HydrophobicContact CB-CB 4.33Å; L1004-I1069 PolarHBondContact N-O 3.21Å; L1004-I1069 WeakPolarHBondContact O-CA 3.41Å; L1004-I1069 PolarHBondContact O-N 2.83Å; L1004-T1105 CarbonylContact C-O 3.55Å; L1004-T1105 WeakPolarHBondContact CA-O 3.4Å; L1004-F1106 HydrophobicContact CD2-CD1 3.42Å; L1004-F1106 VanDerWaalsContact CD2-CD1 3.42Å; L1004-F1106 HydrophobicContact CD2-CE1 3.31Å; L1004-F1106 HydrophobicContact CD2-CG 4.31Å; L1004-F1106 HydrophobicContact CD2-CZ 4.11Å; L1004-F1106 HydrophobicContact CG-CD1 4.23Å; L1004-F1106 HydrophobicContact CG-CE1 4.13Å; L1004-L1114 HydrophobicContact CD2-CD1 4.46Å; L1004-L1114 HydrophobicContact CD2-CD2 4.21Å
1005	D	86.9	Confident	77.2	Confident	31 Å²	31	37.2 Å²	37.2	17%	0.166	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	120.7	166.1	-73.2	-25.8	0	0	0	108.3	T1066 C1067 S1068 T1105 K1107	D1005-T1066 HydrophobicContact CB-CG2 3.94Å; D1005-C1067 WeakPolarHBondContact CA-O 3.27Å; D1005-S1068 WeakPolarHBondContact OD1-CA 3.37Å; D1005-S1068 WeakPolarHBondContact OD1-CB 3.49Å; D1005-S1068 PolarHBondContact OD1-OG 3.11Å; D1005-T1105 PolarHBondContact N-O 3.17Å; D1005-T1105 PolarHBondContact O-N 2.71Å; D1005-T1105 PolarHBondContact O-OG1 2.93Å; D1005-K1107 WeakPolarHBondContact OD2-CG 3.45Å
1006	L	88.4	Confident	76.9	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	115	171.6	173.7	68.8	0	0	0	108.5	F956 Y991 V1008 T1066 C1067 I1069 V1077 A1102 L1104	F956-L1006 HydrophobicContact CE2-CD1 4.05Å; F956-L1006 HydrophobicContact CZ-CD1 3.76Å; Y991-L1006 HydrophobicContact CG-CD2 4.24Å; L1006-V1008 HydrophobicContact CD1-CG2 4.42Å; L1006-V1008 HydrophobicContact CD2-CG2 4.35Å; L1006-V1008 HydrophobicContact CG-CG2 4.09Å; L1006-T1066 CarbonylContact O-C 3.57Å; L1006-T1066 WeakPolarHBondContact O-CA 3.16Å; L1006-C1067 HydrophobicContact CB-CB 4.32Å; L1006-C1067 PolarHBondContact N-O 2.99Å; L1006-C1067 PolarHBondContact O-N 3.24Å; L1006-I1069 HydrophobicContact CB-CD1 3.84Å; L1006-I1069 HydrophobicContact CD2-CD1 4.44Å; L1006-V1077 HydrophobicContact CD2-CB 4.19Å; L1006-V1077 HydrophobicContact CD2-CG2 4.17Å; L1006-A1102 HydrophobicContact CD1-CB 4.23Å; L1006-L1104 HydrophobicContact CB-CD2 3.9Å; L1006-L1104 HydrophobicContact CD1-CD2 3.77Å; L1006-L1104 HydrophobicContact CD1-CG 4.31Å; L1006-L1104 HydrophobicContact CG-CD2 4.44Å
1007	N	88.4	Confident	77.2	Confident	38 Å²	38	43.3 Å²	43.3	20%	0.203	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	119.9	176.7	-171.5	26.7	0	0	0	110	F1065 A1102 S1103	N1007-F1065 PolarHBondContact OD1-O 2.87Å; N1007-A1102 CarbonylContact O-C 3.59Å; N1007-A1102 WeakPolarHBondContact O-CA 3.22Å; N1007-S1103 PolarHBondContact N-O 3.13Å; N1007-S1103 PolarHBondContact O-N 3.06Å
1008	V	88.4	Confident	77.8	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	119.4	179	-177.4	0	0	0	0	108.9	Y991 L1006 S1064 F1065 F1081 V1100 N1101 A1102	Y991-V1008 HydrophobicContact CE2-CG1 4.39Å; Y991-V1008 HydrophobicContact CE2-CG2 4.05Å; L1006-V1008 HydrophobicContact CD1-CG2 4.42Å; L1006-V1008 HydrophobicContact CD2-CG2 4.35Å; L1006-V1008 HydrophobicContact CG-CG2 4.09Å; V1008-S1064 WeakPolarHBondContact O-CA 3.33Å; V1008-S1064 WeakPolarHBondContact O-CB 3.49Å; V1008-F1065 HydrophobicContact CB-CD1 4.38Å; V1008-F1065 HydrophobicContact CB-CE1 3.74Å; V1008-F1065 HydrophobicContact CB-CE2 3.97Å; V1008-F1065 HydrophobicContact CB-CZ 3.49Å; V1008-F1065 VanDerWaalsContact CB-CZ 3.49Å; V1008-F1065 HydrophobicContact CG1-CE1 3.87Å; V1008-F1065 HydrophobicContact CG1-CZ 3.83Å; V1008-F1065 HydrophobicContact CG2-CE1 4.48Å; V1008-F1065 HydrophobicContact CG2-CE2 3.94Å; V1008-F1065 HydrophobicContact CG2-CZ 3.74Å; V1008-F1065 PolarHBondContact N-O 3.15Å; V1008-F1065 PolarHBondContact O-N 2.95Å; V1008-F1065 VanDerWaalsContact O-N 3.14Å; V1008-F1081 HydrophobicContact CG1-CZ 4.26Å; V1008-V1100 HydrophobicContact CG1-CG1 3.66Å; V1008-N1101 WeakPolarHBondContact CA-O 3.37Å; V1008-A1102 HydrophobicContact CG2-CB 4.04Å
1009	I	87.4	Confident	78.8	Confident	48 Å²	48	33.8 Å²	33.8	25%	0.246	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	130.2	-177.8	-48.1	179.7	0	0	0	108.7	C1057 C1062 N1101	I1009-C1057 HydrophobicContact CG2-CB 4.12Å; I1009-C1057 VanDerWaalsContact CG2-SG 3.5Å; I1009-C1062 HydrophobicContact CG2-CB 3.93Å; I1009-N1101 PolarHBondContact N-O 3.02Å; I1009-N1101 PolarHBondContact O-N 3.39Å
1010	Y	86.4	Confident	79.7	Confident	3 Å²	3	32.8 Å²	32.8	1%	0.012	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	153.2	-177.5	60.8	-86.4	0	0	0	112.4	Y1012 L1021 P1023 C1062 D1063 F1065 F1081	Y1010-Y1012 HydrophobicContact CE2-CD2 4.35Å; Y1010-Y1012 HydrophobicContact CE2-CG 4.48Å; Y1010-Y1012 PolarHBondContact O-N 2.92Å; Y1010-Y1012 VanDerWaalsContact O-N 3.11Å; Y1010-L1021 WeakPolarHBondContact CD2-O 3.18Å; Y1010-L1021 WeakPolarHBondContact CE2-O 3.44Å; Y1010-P1023 HydrophobicContact CE1-CG 4.16Å; Y1010-P1023 VanDerWaalsContact OH-CD 3.23Å; Y1010-P1023 WeakPolarHBondContact OH-CD 3.31Å; Y1010-C1062 VanDerWaalsContact O-CA 3.23Å; Y1010-C1062 WeakPolarHBondContact O-CA 3.16Å; Y1010-C1062 VanDerWaalsContact O-CB 3.23Å; Y1010-C1062 WeakPolarHBondContact O-CB 3.37Å; Y1010-C1062 PolarHBondContact O-SG 3.34Å; Y1010-C1062 VanDerWaalsContact O-SG 3.38Å; Y1010-D1063 WeakPolarHBondContact CD1-O 3.22Å; Y1010-D1063 HydrophobicContact CE1-CB 4.39Å; Y1010-D1063 HydrophobicContact CE2-CB 4.05Å; Y1010-D1063 PolarHBondContact N-O 2.89Å; Y1010-D1063 PolarHBondContact O-N 3.18Å; Y1010-F1065 HydrophobicContact CD1-CD1 4.45Å; Y1010-F1065 HydrophobicContact CD1-CE1 4.41Å; Y1010-F1065 AromaticContact CE1-CD1 3.9Å; Y1010-F1065 HydrophobicContact CE1-CD1 3.9Å; Y1010-F1065 HydrophobicContact CE1-CE1 4.23Å; Y1010-F1081 AromaticContact CD1-CE1 3.83Å; Y1010-F1081 HydrophobicContact CD1-CE1 3.83Å; Y1010-F1081 HydrophobicContact CD1-CZ 4.34Å; Y1010-F1081 HydrophobicContact CD2-CE1 4.25Å; Y1010-F1081 HydrophobicContact CE1-CE1 4.34Å; Y1010-F1081 AromaticContact CG-CE1 3.79Å; Y1010-F1081 HydrophobicContact CG-CE1 3.79Å
1011	P	84.9	Confident	80.6	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	101.6	178.4	28.6	-33.2	0	0	0	111.1	L1021 C1062 M1098 M1099	P1011-L1021 WeakPolarHBondContact O-CB 3.33Å; P1011-L1021 PolarHBondContact O-N 2.71Å; P1011-C1062 VanDerWaalsContact CA-SG 3.51Å; P1011-M1098 HydrophobicContact CG-CB 3.95Å; P1011-M1098 HydrophobicContact CG-CG 4.35Å; P1011-M1098 HydrophobicContact CG-SD 4.45Å; P1011-M1099 WeakPolarHBondContact CD-O 3.41Å
1012	Y	81.9	Confident	81.3	Confident	27 Å²	27	28.3 Å²	28.3	11%	0.106	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	-40.7	-178.1	177.1	-133.3	0	0	0	112.5	Y1010 V1019 L1020 L1021 F1022 P1040 L1061 D1063	Y1010-Y1012 HydrophobicContact CE2-CD2 4.35Å; Y1010-Y1012 HydrophobicContact CE2-CG 4.48Å; Y1010-Y1012 PolarHBondContact O-N 2.92Å; Y1010-Y1012 VanDerWaalsContact O-N 3.11Å; Y1012-V1019 HydrophobicContact CD2-CG1 4.46Å; Y1012-V1019 HydrophobicContact CE2-CG1 4.03Å; Y1012-L1020 PolarHBondContact O-N 2.77Å; Y1012-L1021 WeakPolarHBondContact CD2-O 3.2Å; Y1012-F1022 HydrophobicContact CD2-CB 4.29Å; Y1012-F1022 HydrophobicContact CE2-CB 4.12Å; Y1012-P1040 WeakPolarHBondContact OH-CA 3.43Å; Y1012-L1061 PolarHBondContact N-O 2.83Å; Y1012-D1063 HydrophobicContact CD1-CB 4.18Å; Y1012-D1063 HydrophobicContact CG-CB 4.1Å
1013	R	80.4	Confident	81.7	Confident	63 Å²	63	28 Å²	28	24%	0.238	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	144.1	-176.1	-68.9	178.7	-175	-167.7	-1.9	113.7	N1018 L1061	R1013-N1018 CarbonylContact C-O 3.57Å; R1013-N1018 WeakPolarHBondContact CA-O 3.18Å; R1013-L1061 HydrophobicContact CB-CB 3.85Å; R1013-L1061 HydrophobicContact CB-CD1 4.46Å; R1013-L1061 PolarHBondContact N-O 2.85Å; R1013-L1061 PolarHBondContact O-N 3.2Å; R1013-L1061 VanDerWaalsContact O-N 3.07Å
1014	S	75.8	Confident	81.6	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.151	C	C	.	.			trans	-70.4	166.6	169.9	81.4	0	0	0	0	111.7	L1016 F1017 N1018 E1048	S1014-L1016 PolarHBondContact O-N 3.14Å; S1014-L1016 VanDerWaalsContact O-N 3.16Å; S1014-L1016 PolarHBondContact OG-N 3.38Å; S1014-F1017 PolarHBondContact O-N 3.33Å; S1014-N1018 PolarHBondContact N-O 3.48Å; S1014-N1018 VanDerWaalsContact OG-CB 3.31Å; S1014-N1018 WeakPolarHBondContact OG-CB 3.39Å; S1014-N1018 PolarHBondContact OG-N 2.7Å; S1014-N1018 VanDerWaalsContact OG-N 3.15Å; S1014-E1048 WeakPolarHBondContact CB-OE2 3.4Å; S1014-E1048 PolarHBondContact OG-OE2 2.93Å
1015	P	72.5	Confident	81.3	Confident	77 Å²	77	37 Å²	37	50%	0.5	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-31.1	173.4	-28.2	36.4	0	0	0	114.5	F1017 E1048	P1015-F1017 VanDerWaalsContact C-N 3.33Å; P1015-E1048 WeakPolarHBondContact CD-OE1 3.28Å
1016	L	72.2	Confident	81.1	Confident	79 Å²	79	36.8 Å²	36.8	41%	0.414	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	16.9	174.8	-70.8	178.3	0	0	0	115	S1014 N1018 E1048	S1014-L1016 PolarHBondContact O-N 3.14Å; S1014-L1016 VanDerWaalsContact O-N 3.16Å; S1014-L1016 PolarHBondContact OG-N 3.38Å; L1016-N1018 VanDerWaalsContact C-N 3.3Å; L1016-N1018 PolarHBondContact O-N 3.15Å; L1016-E1048 HydrophobicContact CD1-CB 3.94Å; L1016-E1048 HydrophobicContact CD1-CG 3.83Å; L1016-E1048 HydrophobicContact CG-CG 4.39Å; L1016-E1048 PolarHBondContact N-OE1 3.33Å
1017	F	74	Confident	80.8	Confident	120 Å²	120	39.8 Å²	39.8	53%	0.526	20%	0.196	S	C	.	.			trans	65	23.7	-179.5	-60.1	-87	0	0	0	115.1	S1014 P1015 L1061	S1014-F1017 PolarHBondContact O-N 3.33Å; P1015-F1017 VanDerWaalsContact C-N 3.33Å; F1017-L1061 HydrophobicContact CD1-CD1 3.59Å; F1017-L1061 HydrophobicContact CE1-CD1 3.32Å; F1017-L1061 HydrophobicContact CG-CD1 4.46Å; F1017-L1061 HydrophobicContact CZ-CD1 4Å
1018	N	77.7	Confident	80.7	Confident	8 Å²	8	42.4 Å²	42.4	4%	0.043	20%	0.203	C	C	.	.			trans	-75.7	139.3	170.5	-66	-44.8	0	0	0	110.2	R1013 S1014 L1016 P1045 K1046 E1048 T1087	R1013-N1018 CarbonylContact C-O 3.57Å; R1013-N1018 WeakPolarHBondContact CA-O 3.18Å; S1014-N1018 PolarHBondContact N-O 3.48Å; S1014-N1018 VanDerWaalsContact OG-CB 3.31Å; S1014-N1018 WeakPolarHBondContact OG-CB 3.39Å; S1014-N1018 PolarHBondContact OG-N 2.7Å; S1014-N1018 VanDerWaalsContact OG-N 3.15Å; L1016-N1018 VanDerWaalsContact C-N 3.3Å; L1016-N1018 PolarHBondContact O-N 3.15Å; N1018-P1045 WeakPolarHBondContact OD1-CA 3.3Å; N1018-K1046 PolarHBondContact ND2-O 3Å; N1018-K1046 PolarHBondContact OD1-N 2.98Å; N1018-E1048 PolarHBondContact ND2-OE2 2.79Å; N1018-T1087 HydrophobicContact CB-CG2 3.53Å
1019	V	78.1	Confident	80.3	Confident	9 Å²	9	44.4 Å²	44.4	6%	0.055	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-72	130.4	177.2	-179.3	0	0	0	0	109.3	Y1012 F1022 W1084 T1087	Y1012-V1019 HydrophobicContact CD2-CG1 4.46Å; Y1012-V1019 HydrophobicContact CE2-CG1 4.03Å; V1019-F1022 HydrophobicContact CG1-CD1 3.97Å; V1019-W1084 HydrophobicContact CB-CB 4.17Å; V1019-W1084 HydrophobicContact CB-CG 4.1Å; V1019-W1084 HydrophobicContact CG1-CB 3.95Å; V1019-W1084 HydrophobicContact CG1-CG 4.22Å; V1019-W1084 WeakPolarHBondContact O-CB 3.47Å; V1019-T1087 VanDerWaalsContact O-CB 3.28Å; V1019-T1087 WeakPolarHBondContact O-CB 3.48Å; V1019-T1087 PolarHBondContact O-OG1 2.62Å
1020	L	79.4	Confident	79.4	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.248	C	C	.	.			trans	-107.2	-78.9	-179.8	-64.3	175.1	0	0	0	110.5	Y1012 L1055 A1083 W1084 T1087 F1088 M1098	Y1012-L1020 PolarHBondContact O-N 2.77Å; L1020-L1055 HydrophobicContact CD1-CD1 4.25Å; L1020-A1083 WeakPolarHBondContact O-CA 3.34Å; L1020-W1084 PolarHBondContact O-N 3.28Å; L1020-T1087 HydrophobicContact CD2-CG2 3.86Å; L1020-F1088 HydrophobicContact CB-CZ 4.31Å; L1020-F1088 HydrophobicContact CD2-CE1 3.84Å; L1020-F1088 HydrophobicContact CD2-CZ 3.74Å; L1020-M1098 HydrophobicContact CB-SD 4.3Å
1021	L	82.8	Confident	78.8	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	132.8	-175.5	-165.9	74.8	0	0	0	110	Y1010 P1011 Y1012 F1081 A1083 M1098 V1100 I1125	Y1010-L1021 WeakPolarHBondContact CD2-O 3.18Å; Y1010-L1021 WeakPolarHBondContact CE2-O 3.44Å; P1011-L1021 WeakPolarHBondContact O-CB 3.33Å; P1011-L1021 PolarHBondContact O-N 2.71Å; Y1012-L1021 WeakPolarHBondContact CD2-O 3.2Å; L1021-F1081 HydrophobicContact CD1-CB 3.89Å; L1021-F1081 HydrophobicContact CD2-CB 4.21Å; L1021-F1081 HydrophobicContact CD2-CD1 3.76Å; L1021-F1081 HydrophobicContact CD2-CE1 4.34Å; L1021-F1081 HydrophobicContact CD2-CG 4.08Å; L1021-F1081 HydrophobicContact CG-CB 4.05Å; L1021-F1081 HydrophobicContact CG-CD1 3.89Å; L1021-F1081 HydrophobicContact CG-CG 4.28Å; L1021-A1083 HydrophobicContact CD1-CB 4.49Å; L1021-M1098 HydrophobicContact CB-CE 4.38Å; L1021-M1098 HydrophobicContact CB-SD 4.5Å; L1021-M1098 HydrophobicContact CD1-CE 4.06Å; L1021-V1100 HydrophobicContact CD2-CG2 3.89Å; L1021-I1125 HydrophobicContact CD1-CD1 4.27Å; L1021-I1125 HydrophobicContact CD2-CD1 3.76Å
1022	F	81.1	Confident	78.7	Confident	22 Å²	22	54.7 Å²	54.7	10%	0.096	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	141	174.6	61.1	-80.4	0	0	0	111.5	Y1012 V1019 T1024 P1040 K1082 W1084	Y1012-F1022 HydrophobicContact CD2-CB 4.29Å; Y1012-F1022 HydrophobicContact CE2-CB 4.12Å; V1019-F1022 HydrophobicContact CG1-CD1 3.97Å; F1022-T1024 HydrophobicContact CD2-CG2 3.72Å; F1022-T1024 HydrophobicContact CE2-CG2 3.42Å; F1022-T1024 VanDerWaalsContact CE2-CG2 3.42Å; F1022-T1024 HydrophobicContact CZ-CG2 4.48Å; F1022-P1040 HydrophobicContact CD2-CG 3.99Å; F1022-P1040 HydrophobicContact CE2-CG 4.2Å; F1022-P1040 HydrophobicContact CG-CG 4.45Å; F1022-K1082 WeakPolarHBondContact CD1-O 3.4Å; F1022-K1082 HydrophobicContact CE1-CB 4.15Å; F1022-K1082 HydrophobicContact CE2-CB 4.12Å; F1022-K1082 HydrophobicContact CZ-CB 3.83Å; F1022-K1082 PolarHBondContact N-O 3.35Å; F1022-K1082 PolarHBondContact O-N 3.07Å; F1022-W1084 HydrophobicContact CE1-CB 4.1Å; F1022-W1084 AromaticContact CE1-CE3 3.78Å; F1022-W1084 HydrophobicContact CE1-CE3 3.78Å; F1022-W1084 HydrophobicContact CZ-CE3 4.01Å
1023	P	82.5	Confident	78.8	Confident	15 Å²	15	61.3 Å²	61.3	10%	0.097	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	141.9	172.9	30.6	-34.9	0	0	0	110.2	Y1010 P1037 V1079 T1080 F1081	Y1010-P1023 HydrophobicContact CE1-CG 4.16Å; Y1010-P1023 VanDerWaalsContact OH-CD 3.23Å; Y1010-P1023 WeakPolarHBondContact OH-CD 3.31Å; P1023-P1037 HydrophobicContact CB-CG 4.28Å; P1023-P1037 HydrophobicContact CG-CB 4.13Å; P1023-P1037 HydrophobicContact CG-CG 3.36Å; P1023-V1079 HydrophobicContact CB-CG1 4.13Å; P1023-T1080 WeakPolarHBondContact CA-O 3.32Å; P1023-F1081 HydrophobicContact CB-CD1 4.15Å; P1023-F1081 HydrophobicContact CB-CE1 4.06Å; P1023-F1081 HydrophobicContact CG-CE1 4.46Å
1024	T	78.3	Confident	79	Confident	68 Å²	68	59 Å²	59	42%	0.417	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	-32.5	177.7	48.7	0	0	0	0	113.7	F1022 T1080 K1082	F1022-T1024 HydrophobicContact CD2-CG2 3.72Å; F1022-T1024 HydrophobicContact CE2-CG2 3.42Å; F1022-T1024 VanDerWaalsContact CE2-CG2 3.42Å; F1022-T1024 HydrophobicContact CZ-CG2 4.48Å; T1024-T1080 PolarHBondContact N-O 3.01Å; T1024-T1080 PolarHBondContact OG1-O 3.44Å; T1024-K1082 HydrophobicContact CG2-CB 4.31Å; T1024-K1082 HydrophobicContact CG2-CD 3.56Å; T1024-K1082 HydrophobicContact CG2-CG 3.86Å; T1024-K1082 WeakPolarHBondContact OG1-CE 3.49Å
1025	R	79	Confident	79.2	Confident	168 Å²	168	66.8 Å²	66.8	63%	0.634	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.6	128.7	179.5	-164.9	-178.4	179.8	-166.4	-1.2	109.3	V1027 T1080	R1025-V1027 HydrophobicContact CG-CG2 3.94Å; R1025-T1080 PolarHBondContact O-N 2.71Å
1026	I	83.5	Confident	78.9	Confident	27 Å²	27	71 Å²	71	14%	0.138	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	114	172.2	-51.4	179.3	0	0	0	106.3	Y1028 C1034 P1037 F1065 V1077 N1078 V1079	I1026-Y1028 HydrophobicContact CG2-CD1 3.99Å; I1026-C1034 HydrophobicContact CG2-CB 4.27Å; I1026-P1037 HydrophobicContact CD1-CG 4.38Å; I1026-F1065 HydrophobicContact CD1-CD1 4.42Å; I1026-F1065 HydrophobicContact CD1-CD2 3.91Å; I1026-F1065 HydrophobicContact CD1-CE2 4.04Å; I1026-F1065 HydrophobicContact CD1-CG 4.13Å; I1026-F1065 HydrophobicContact CD1-CZ 4.37Å; I1026-V1077 HydrophobicContact CG2-CG1 4.04Å; I1026-N1078 WeakPolarHBondContact CA-O 3.21Å; I1026-V1079 HydrophobicContact CG1-CG1 4.4Å; I1026-V1079 HydrophobicContact CG2-CG2 4.36Å
1027	V	82.4	Confident	78.7	Confident	63 Å²	63	68.6 Å²	68.6	38%	0.382	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	126.5	176.3	-177.1	0	0	0	0	107.8	R1025 N1078	R1025-V1027 HydrophobicContact CG-CG2 3.94Å; V1027-N1078 HydrophobicContact CB-CB 4.44Å; V1027-N1078 PolarHBondContact N-O 3.4Å; V1027-N1078 PolarHBondContact O-N 3.36Å
1028	Y	85.3	Confident	78.1	Confident	93 Å²	93	67.6 Å²	67.6	37%	0.365	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	161.9	-175	49.5	-94.3	0	0	0	111	I1026 V1032 C1034 Q1076	I1026-Y1028 HydrophobicContact CG2-CD1 3.99Å; Y1028-V1032 HydrophobicContact CD2-CB 3.98Å; Y1028-V1032 HydrophobicContact CD2-CG1 4.3Å; Y1028-V1032 WeakPolarHBondContact CD2-O 3.45Å; Y1028-V1032 WeakPolarHBondContact CE2-O 3.44Å; Y1028-V1032 HydrophobicContact CG-CB 4.33Å; Y1028-V1032 HydrophobicContact CG-CG1 4.29Å; Y1028-C1034 HydrophobicContact CD1-CB 4.06Å; Y1028-C1034 HydrophobicContact CE1-CB 3.95Å; Y1028-Q1076 WeakPolarHBondContact CA-O 3.5Å
1029	S	81.7	Confident	77.3	Confident	42 Å²	42	71.4 Å²	71.4	29%	0.294	37%	0.372	S	S	.	.			trans	-65.2	154.6	178.7	-55.1	0	0	0	0	111.3	E1031 V1032 Q1076	S1029-E1031 PolarHBondContact O-N 2.85Å; S1029-V1032 PolarHBondContact O-N 3.18Å; S1029-Q1076 PolarHBondContact N-O 3.04Å; S1029-Q1076 PolarHBondContact OG-N 3.31Å; S1029-Q1076 PolarHBondContact OG-O 3.42Å
1030	T	68.3	Low	76.6	Confident	144 Å²	144	72.5 Å²	72.5	88%	0.883	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-20.2	-168.5	41.9	0	0	0	0	116.1
1031	E	73.8	Confident	75.7	Confident	121 Å²	121	80.2 Å²	80.2	57%	0.565	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	-13.4	-174.4	-63.8	169.1	167.2	0	0	112.8	S1029 P1070 T1072	S1029-E1031 PolarHBondContact O-N 2.85Å; E1031-P1070 HydrophobicContact CB-CG 3.68Å; E1031-P1070 WeakPolarHBondContact O-CD 3.36Å; E1031-P1070 WeakPolarHBondContact O-CG 3.15Å; E1031-T1072 HydrophobicContact CB-CG2 4.26Å; E1031-T1072 WeakPolarHBondContact OE2-CG2 3.19Å
1032	V	82.4	Confident	74.6	Confident	2 Å²	2	85.8 Å²	85.8	1%	0.012	44%	0.438	C	S	.	.			trans	-80.3	144.5	178.6	177.3	0	0	0	0	110.5	Y1028 S1029 C1067 S1068 I1069 V1077	Y1028-V1032 HydrophobicContact CD2-CB 3.98Å; Y1028-V1032 HydrophobicContact CD2-CG1 4.3Å; Y1028-V1032 WeakPolarHBondContact CD2-O 3.45Å; Y1028-V1032 WeakPolarHBondContact CE2-O 3.44Å; Y1028-V1032 HydrophobicContact CG-CB 4.33Å; Y1028-V1032 HydrophobicContact CG-CG1 4.29Å; S1029-V1032 PolarHBondContact O-N 3.18Å; V1032-C1067 HydrophobicContact CG1-CB 4.14Å; V1032-S1068 WeakPolarHBondContact CA-O 3.45Å; V1032-I1069 HydrophobicContact CG1-CG1 4.23Å; V1032-I1069 HydrophobicContact CG2-CG1 4.29Å; V1032-I1069 HydrophobicContact CG2-CG2 4.41Å; V1032-V1077 HydrophobicContact CG1-CG2 4.01Å
1033	K	83.3	Confident	73.8	Confident	166 Å²	166	90 Å²	90	72%	0.722	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.5	110.7	174	-68.2	-176.2	-179.2	179.6	0	111	C1067 S1068	K1033-C1067 WeakPolarHBondContact O-CA 3.33Å; K1033-S1068 PolarHBondContact N-O 2.77Å; K1033-S1068 PolarHBondContact O-N 2.81Å
1034	C	84.6	Confident	73	Confident	16 Å²	16	98.8 Å²	98.8	11%	0.108	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	137.9	176.2	-63.5	0	0	0	0	111.7	I1026 Y1028 C1067	I1026-C1034 HydrophobicContact CG2-CB 4.27Å; Y1028-C1034 HydrophobicContact CD1-CB 4.06Å; Y1028-C1034 HydrophobicContact CE1-CB 3.95Å; C1034-C1067 HydrophobicContact CB-CB 4.08Å; C1034-C1067 WeakPolarHBondContact CB-SG 3.16Å; C1034-C1067 WeakPolarHBondContact SG-CB 3.46Å; C1034-C1067 CovalentContact SG-SG 2.04Å; C1034-C1067 PolarHBondContact SG-SG 2.94Å
1035	K	80	Confident	72.5	Confident	163 Å²	163	97.4 Å²	97.4	71%	0.709	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-79	119.1	165.6	-70.2	-178.2	-179.8	176.7	0	108.3	T1066	K1035-T1066 PolarHBondContact N-O 3.15Å
1036	E	67.1	Low	72.2	Confident	164 Å²	164	95.7 Å²	95.7	77%	0.766	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-68.5	135.5	178.3	-70.3	-176.2	176	0	0	110.8
1037	P	67.2	Low	71.6	Confident	29 Å²	29	101.1 Å²	101.1	19%	0.188	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-70.8	148.7	174.7	25.3	-28	0	0	0	110.7	P1023 I1026	P1023-P1037 HydrophobicContact CB-CG 4.28Å; P1023-P1037 HydrophobicContact CG-CB 4.13Å; P1023-P1037 HydrophobicContact CG-CG 3.36Å; I1026-P1037 HydrophobicContact CD1-CG 4.38Å
1038	P	61.6	Low	71.1	Confident	100 Å²	100	99.2 Å²	99.2	65%	0.649	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-62.8	143.1	-179.4	24.7	-32.4	0	0	0	111.9
1039	A	60.2	Low	70.3	Confident	88 Å²	88	99.3 Å²	99.3	73%	0.727	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-57.3	138.4	178	0	0	0	0	0	111.7	K1041	A1039-K1041 PolarHBondContact O-N 2.91Å
1040	P	63.4	Low	69.6	Low	31 Å²	31	98 Å²	98	20%	0.201	50%	0.497	C	S	.	.	P	Polyproline II helix	trans	-65.5	132.5	-175.6	25	-32.6	0	0	0	111.5	Y1012 F1022	Y1012-P1040 WeakPolarHBondContact OH-CA 3.43Å; F1022-P1040 HydrophobicContact CD2-CG 3.99Å; F1022-P1040 HydrophobicContact CE2-CG 4.2Å; F1022-P1040 HydrophobicContact CG-CG 4.45Å
1041	K	60.8	Low	69.3	Low	163 Å²	163	95.3 Å²	95.3	71%	0.709	48%	0.481	S	S	*	.			trans	-83.7	113	169.8	-71.3	-174.3	179	-179.1	0	108.9	A1039 N1043	A1039-K1041 PolarHBondContact O-N 2.91Å; K1041-N1043 PolarHBondContact O-N 3.16Å
1042	H	61.4	Low	68.4	Low	116 Å²	116	93.6 Å²	93.6	54%	0.537	48%	0.48	S	S	.	.			trans	-77.5	113	-177	-57.4	-66.1	0	0	0	111.4	W1084	H1042-W1084 AromaticContact CE1-CH2 3.57Å; H1042-W1084 AromaticContact CE1-CZ3 3.5Å; H1042-W1084 AromaticContact CG-CH2 3.99Å; H1042-W1084 AromaticContact ND1-CH2 3.09Å; H1042-W1084 WeakPolarHBondContact ND1-CH2 3.46Å; H1042-W1084 AromaticContact ND1-CZ2 3.69Å; H1042-W1084 AromaticContact ND1-CZ3 3.43Å; H1042-W1084 WeakPolarHBondContact ND1-CZ3 3.49Å
1043	N	62.7	Low	67.2	Low	111 Å²	111	100.6 Å²	100.6	59%	0.594	51%	0.511	S	S	*	.			trans	-112.3	152.1	170.3	-70	-16.3	0	0	0	109.6	K1041	K1041-N1043 PolarHBondContact O-N 3.16Å
1044	K	67	Low	65.9	Low	199 Å²	199	95.4 Å²	95.4	87%	0.865	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-63	129.6	172.8	-73.8	-174.8	178	-178.4	0	110
1045	P	66.8	Low	65	Low	39 Å²	39	95.5 Å²	95.5	25%	0.253	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-68.3	140	-177.6	27.7	-33.9	0	0	0	111.2	N1018 P1086 V1090	N1018-P1045 WeakPolarHBondContact OD1-CA 3.3Å; P1045-P1086 HydrophobicContact CG-CB 3.98Å; P1045-P1086 WeakPolarHBondContact CG-O 3.22Å; P1045-V1090 HydrophobicContact CG-CG2 4.14Å
1046	K	72.8	Confident	64.2	Low	133 Å²	133	92.5 Å²	92.5	58%	0.578	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-92.7	142.8	173.2	-63.7	178.2	-177.1	175.1	0	109.5	N1018 E1048	N1018-K1046 PolarHBondContact ND2-O 3Å; N1018-K1046 PolarHBondContact OD1-N 2.98Å; K1046-E1048 PolarHBondContact O-N 3.11Å
1047	K	70.4	Confident	64.1	Low	141 Å²	141	87.3 Å²	87.3	61%	0.613	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-63.1	126.6	175.9	-165.9	176.6	-177.1	-169.3	0	110.5	V1090 E1092	K1047-V1090 HydrophobicContact CB-CG1 4.02Å; K1047-V1090 HydrophobicContact CG-CG1 4.3Å; K1047-E1092 WeakPolarHBondContact CE-OE1 3.22Å; K1047-E1092 IonicContact NZ-OE1 2.72Å; K1047-E1092 PolarHBondContact NZ-OE1 3.17Å
1048	E	72.3	Confident	63.6	Low	23 Å²	23	89.6 Å²	89.6	11%	0.107	49%	0.488	C	S	.	.			trans	-144.3	139.2	-175.3	-174.2	169.4	-156.8	0	0	109.2	S1014 P1015 L1016 N1018 K1046 L1050 G1091 E1092	S1014-E1048 WeakPolarHBondContact CB-OE2 3.4Å; S1014-E1048 PolarHBondContact OG-OE2 2.93Å; P1015-E1048 WeakPolarHBondContact CD-OE1 3.28Å; L1016-E1048 HydrophobicContact CD1-CB 3.94Å; L1016-E1048 HydrophobicContact CD1-CG 3.83Å; L1016-E1048 HydrophobicContact CG-CG 4.39Å; L1016-E1048 PolarHBondContact N-OE1 3.33Å; N1018-E1048 PolarHBondContact ND2-OE2 2.79Å; K1046-E1048 PolarHBondContact O-N 3.11Å; E1048-L1050 HydrophobicContact CG-CD2 4Å; E1048-G1091 VanDerWaalsContact O-CA 3.26Å; E1048-G1091 WeakPolarHBondContact O-CA 3.28Å; E1048-E1092 PolarHBondContact O-N 3.45Å
1049	T	69.7	Low	63.5	Low	95 Å²	95	91.2 Å²	91.2	58%	0.583	49%	0.487	S	S	*	.	B	Isolated β-bridge	trans	-88.9	112.8	171.4	-51.4	0	0	0	0	107.8	E1092	T1049-E1092 HydrophobicContact CG2-CB 4.31Å
1050	L	66.9	Low	63.6	Low	13 Å²	13	87.6 Å²	87.6	7%	0.068	46%	0.457	C	S	.	.			trans	-96.2	105.8	179.5	-61.7	171.5	0	0	0	107.5	E1048 F1088 E1092 F1093 L1096	E1048-L1050 HydrophobicContact CG-CD2 4Å; L1050-F1088 HydrophobicContact CD1-CD1 4.39Å; L1050-F1088 HydrophobicContact CD1-CE1 4.48Å; L1050-E1092 PolarHBondContact N-O 2.91Å; L1050-F1093 HydrophobicContact CB-CB 4.1Å; L1050-F1093 HydrophobicContact CD1-CD1 4.24Å; L1050-F1093 WeakPolarHBondContact O-CB 3.31Å; L1050-L1096 HydrophobicContact CB-CD1 4.4Å; L1050-L1096 HydrophobicContact CD1-CD2 4.33Å
1051	T	60.5	Low	64.3	Low	88 Å²	88	90.1 Å²	90.1	54%	0.54	47%	0.468	S	S	.	.			trans	-69.9	154.2	178.1	31.5	0	0	0	0	111.5	F1053	T1051-F1053 PolarHBondContact O-N 3.32Å
1052	P	54.6	Low	65.2	Low	86 Å²	86	84.4 Å²	84.4	56%	0.558	45%	0.448	S	S	*	.	S	Bend	trans	-72	24.9	-174.6	28.3	-34.7	0	0	0	115.3
1053	F	57.9	Low	66.2	Low	149 Å²	149	81 Å²	81	65%	0.654	43%	0.434	S	S	*	.	S	Bend	trans	-80.9	151.1	176.9	-83.8	-84.4	0	0	0	112	T1051 L1055	T1051-F1053 PolarHBondContact O-N 3.32Å; F1053-L1055 PolarHBondContact O-N 3.09Å
1054	L	56	Low	67.3	Low	56 Å²	56	78.4 Å²	78.4	29%	0.293	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	113.1	173.1	-171.5	83.4	0	0	0	109.1	E1056 K1097 M1099 T1124	L1054-E1056 HydrophobicContact CD2-CG 3.58Å; L1054-E1056 WeakPolarHBondContact CD2-OE1 3.45Å; L1054-E1056 HydrophobicContact CG-CG 4.06Å; L1054-E1056 PolarHBondContact O-N 3.11Å; L1054-K1097 WeakPolarHBondContact CA-O 3.41Å; L1054-K1097 HydrophobicContact CD1-CB 3.84Å; L1054-M1099 HydrophobicContact CD1-CB 4.5Å; L1054-M1099 HydrophobicContact CD1-CE 4.14Å; L1054-M1099 HydrophobicContact CD2-CE 3.6Å; L1054-M1099 HydrophobicContact CD2-SD 4.42Å; L1054-M1099 HydrophobicContact CG-CE 4.36Å; L1054-T1124 HydrophobicContact CD1-CG2 4.11Å
1055	L	65.6	Low	68.3	Low	18 Å²	18	69.2 Å²	69.2	9%	0.094	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	92.6	175.3	-79.3	161	0	0	0	109.3	L1020 F1053 L1096 K1097 M1098 M1099	L1020-L1055 HydrophobicContact CD1-CD1 4.25Å; F1053-L1055 PolarHBondContact O-N 3.09Å; L1055-L1096 HydrophobicContact CD1-CD1 3.65Å; L1055-L1096 HydrophobicContact CD1-CD2 3.77Å; L1055-L1096 HydrophobicContact CD1-CG 3.92Å; L1055-L1096 HydrophobicContact CG-CD1 4.34Å; L1055-K1097 PolarHBondContact N-O 3.46Å; L1055-M1098 HydrophobicContact CD1-CG 4.16Å; L1055-M1099 PolarHBondContact O-N 3.11Å
1056	E	63.5	Low	69.2	Low	100 Å²	100	69.7 Å²	69.7	47%	0.467	39%	0.387	S	S	.	.			trans	-91.1	160.6	169.1	-65.8	-174.2	174.4	0	0	111.5	L1054 G1058 Q1059 S1060 M1099	L1054-E1056 HydrophobicContact CD2-CG 3.58Å; L1054-E1056 WeakPolarHBondContact CD2-OE1 3.45Å; L1054-E1056 HydrophobicContact CG-CG 4.06Å; L1054-E1056 PolarHBondContact O-N 3.11Å; E1056-G1058 PolarHBondContact O-N 2.96Å; E1056-Q1059 PolarHBondContact O-N 3.18Å; E1056-Q1059 VanDerWaalsContact O-N 3.1Å; E1056-S1060 PolarHBondContact O-OG 2.46Å; E1056-M1099 HydrophobicContact CG-SD 4.48Å
1057	C	64.3	Low	70	Confident	55 Å²	55	63.3 Å²	63.3	37%	0.372	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	18.2	-177.9	-70.5	0	0	0	0	116.6	I1009 C1062	I1009-C1057 HydrophobicContact CG2-CB 4.12Å; I1009-C1057 VanDerWaalsContact CG2-SG 3.5Å; C1057-C1062 WeakPolarHBondContact CA-SG 3.47Å; C1057-C1062 HydrophobicContact CB-CB 3.69Å; C1057-C1062 WeakPolarHBondContact CB-SG 3.43Å; C1057-C1062 WeakPolarHBondContact SG-CB 3.3Å; C1057-C1062 CovalentContact SG-SG 2.02Å; C1057-C1062 PolarHBondContact SG-SG 3.03Å
1058	G	57.1	Low	70.7	Confident	77 Å²	77	57.8 Å²	57.8	79%	0.794	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	-19.3	166	0	0	0	0	0	114.1	E1056	E1056-G1058 PolarHBondContact O-N 2.96Å
1059	Q	59.8	Low	71.3	Confident	134 Å²	134	56.9 Å²	56.9	63%	0.626	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	-12.5	-175.9	-63.1	-177.9	-0.3	0	0	113.1	E1056	E1056-Q1059 PolarHBondContact O-N 3.18Å; E1056-Q1059 VanDerWaalsContact O-N 3.1Å
1060	S	62.7	Low	71.8	Confident	13 Å²	13	54.7 Å²	54.7	9%	0.091	32%	0.322	C	S	.	.	S	Bend	trans	-130.2	158.7	-177.8	59.5	0	0	0	0	111	E1056 C1062	E1056-S1060 PolarHBondContact O-OG 2.46Å; S1060-C1062 PolarHBondContact O-N 3.05Å; S1060-C1062 VanDerWaalsContact O-N 3.15Å
1061	L	76.5	Confident	72.1	Confident	84 Å²	84	59 Å²	59	44%	0.44	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	97.9	178.3	-82.1	159.4	0	0	0	108.7	Y1012 R1013 F1017	Y1012-L1061 PolarHBondContact N-O 2.83Å; R1013-L1061 HydrophobicContact CB-CB 3.85Å; R1013-L1061 HydrophobicContact CB-CD1 4.46Å; R1013-L1061 PolarHBondContact N-O 2.85Å; R1013-L1061 PolarHBondContact O-N 3.2Å; R1013-L1061 VanDerWaalsContact O-N 3.07Å; F1017-L1061 HydrophobicContact CD1-CD1 3.59Å; F1017-L1061 HydrophobicContact CE1-CD1 3.32Å; F1017-L1061 HydrophobicContact CG-CD1 4.46Å; F1017-L1061 HydrophobicContact CZ-CD1 4Å
1062	C	80.7	Confident	72.5	Confident	43 Å²	43	55.9 Å²	55.9	29%	0.291	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	156.9	178.8	-72.8	0	0	0	0	113.4	I1009 Y1010 P1011 C1057 S1060	I1009-C1062 HydrophobicContact CG2-CB 3.93Å; Y1010-C1062 VanDerWaalsContact O-CA 3.23Å; Y1010-C1062 WeakPolarHBondContact O-CA 3.16Å; Y1010-C1062 VanDerWaalsContact O-CB 3.23Å; Y1010-C1062 WeakPolarHBondContact O-CB 3.37Å; Y1010-C1062 PolarHBondContact O-SG 3.34Å; Y1010-C1062 VanDerWaalsContact O-SG 3.38Å; P1011-C1062 VanDerWaalsContact CA-SG 3.51Å; C1057-C1062 WeakPolarHBondContact CA-SG 3.47Å; C1057-C1062 HydrophobicContact CB-CB 3.69Å; C1057-C1062 WeakPolarHBondContact CB-SG 3.43Å; C1057-C1062 WeakPolarHBondContact SG-CB 3.3Å; C1057-C1062 CovalentContact SG-SG 2.02Å; C1057-C1062 PolarHBondContact SG-SG 3.03Å; S1060-C1062 PolarHBondContact O-N 3.05Å; S1060-C1062 VanDerWaalsContact O-N 3.15Å
1063	D	83	Confident	73.4	Confident	43 Å²	43	57.5 Å²	57.5	23%	0.23	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	162.4	169.8	-160	-1.4	0	0	0	108.6	Y1010 Y1012	Y1010-D1063 WeakPolarHBondContact CD1-O 3.22Å; Y1010-D1063 HydrophobicContact CE1-CB 4.39Å; Y1010-D1063 HydrophobicContact CE2-CB 4.05Å; Y1010-D1063 PolarHBondContact N-O 2.89Å; Y1010-D1063 PolarHBondContact O-N 3.18Å; Y1012-D1063 HydrophobicContact CD1-CB 4.18Å; Y1012-D1063 HydrophobicContact CG-CB 4.1Å
1064	S	85.6	Confident	74.6	Confident	58 Å²	58	56.4 Å²	56.4	41%	0.406	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	144.5	-175.9	63	0	0	0	0	112.1	V1008	V1008-S1064 WeakPolarHBondContact O-CA 3.33Å; V1008-S1064 WeakPolarHBondContact O-CB 3.49Å
1065	F	87.4	Confident	76	Confident	5 Å²	5	53.9 Å²	53.9	2%	0.022	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	152.5	167.6	66.7	-90.5	0	0	0	110.4	N1007 V1008 Y1010 I1026 V1079 F1081	N1007-F1065 PolarHBondContact OD1-O 2.87Å; V1008-F1065 HydrophobicContact CB-CD1 4.38Å; V1008-F1065 HydrophobicContact CB-CE1 3.74Å; V1008-F1065 HydrophobicContact CB-CE2 3.97Å; V1008-F1065 HydrophobicContact CB-CZ 3.49Å; V1008-F1065 VanDerWaalsContact CB-CZ 3.49Å; V1008-F1065 HydrophobicContact CG1-CE1 3.87Å; V1008-F1065 HydrophobicContact CG1-CZ 3.83Å; V1008-F1065 HydrophobicContact CG2-CE1 4.48Å; V1008-F1065 HydrophobicContact CG2-CE2 3.94Å; V1008-F1065 HydrophobicContact CG2-CZ 3.74Å; V1008-F1065 PolarHBondContact N-O 3.15Å; V1008-F1065 PolarHBondContact O-N 2.95Å; V1008-F1065 VanDerWaalsContact O-N 3.14Å; Y1010-F1065 HydrophobicContact CD1-CD1 4.45Å; Y1010-F1065 HydrophobicContact CD1-CE1 4.41Å; Y1010-F1065 AromaticContact CE1-CD1 3.9Å; Y1010-F1065 HydrophobicContact CE1-CD1 3.9Å; Y1010-F1065 HydrophobicContact CE1-CE1 4.23Å; I1026-F1065 HydrophobicContact CD1-CD1 4.42Å; I1026-F1065 HydrophobicContact CD1-CD2 3.91Å; I1026-F1065 HydrophobicContact CD1-CE2 4.04Å; I1026-F1065 HydrophobicContact CD1-CG 4.13Å; I1026-F1065 HydrophobicContact CD1-CZ 4.37Å; F1065-V1079 HydrophobicContact CE1-CG1 4.15Å; F1065-V1079 HydrophobicContact CE2-CG2 4.17Å; F1065-V1079 HydrophobicContact CZ-CB 4.41Å; F1065-V1079 HydrophobicContact CZ-CG1 3.89Å; F1065-V1079 HydrophobicContact CZ-CG2 3.66Å; F1065-F1081 HydrophobicContact CE1-CZ 4.16Å
1066	T	86.9	Confident	77.1	Confident	49 Å²	49	56.7 Å²	56.7	30%	0.301	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	133.5	-177.8	-45.3	0	0	0	0	110.3	D1005 L1006 K1035	D1005-T1066 HydrophobicContact CB-CG2 3.94Å; L1006-T1066 CarbonylContact O-C 3.57Å; L1006-T1066 WeakPolarHBondContact O-CA 3.16Å; K1035-T1066 PolarHBondContact N-O 3.15Å
1067	C	87.8	Confident	78.2	Confident	0 Å²	0	52 Å²	52	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	123.6	174.7	-65.3	0	0	0	0	110.3	D1005 L1006 V1032 K1033 C1034	D1005-C1067 WeakPolarHBondContact CA-O 3.27Å; L1006-C1067 HydrophobicContact CB-CB 4.32Å; L1006-C1067 PolarHBondContact N-O 2.99Å; L1006-C1067 PolarHBondContact O-N 3.24Å; V1032-C1067 HydrophobicContact CG1-CB 4.14Å; K1033-C1067 WeakPolarHBondContact O-CA 3.33Å; C1034-C1067 HydrophobicContact CB-CB 4.08Å; C1034-C1067 WeakPolarHBondContact CB-SG 3.16Å; C1034-C1067 WeakPolarHBondContact SG-CB 3.46Å; C1034-C1067 CovalentContact SG-SG 2.04Å; C1034-C1067 PolarHBondContact SG-SG 2.94Å
1068	S	86.4	Confident	79.3	Confident	25 Å²	25	52 Å²	52	18%	0.175	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	118	175.1	-146.2	0	0	0	0	109.3	D1005 V1032 K1033 K1107	D1005-S1068 WeakPolarHBondContact OD1-CA 3.37Å; D1005-S1068 WeakPolarHBondContact OD1-CB 3.49Å; D1005-S1068 PolarHBondContact OD1-OG 3.11Å; V1032-S1068 WeakPolarHBondContact CA-O 3.45Å; K1033-S1068 PolarHBondContact N-O 2.77Å; K1033-S1068 PolarHBondContact O-N 2.81Å; S1068-K1107 PolarHBondContact OG-NZ 2.78Å
1069	I	84.7	Confident	80.8	Confident	4 Å²	4	48.4 Å²	48.4	2%	0.021	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	113.2	-176.9	-57.3	177.3	0	0	0	107.9	V993 A1003 L1004 L1006 V1032	V993-I1069 HydrophobicContact CB-CD1 4.45Å; V993-I1069 HydrophobicContact CG2-CD1 3.81Å; A1003-I1069 WeakPolarHBondContact CA-O 3.43Å; L1004-I1069 HydrophobicContact CB-CB 4.33Å; L1004-I1069 PolarHBondContact N-O 3.21Å; L1004-I1069 WeakPolarHBondContact O-CA 3.41Å; L1004-I1069 PolarHBondContact O-N 2.83Å; L1006-I1069 HydrophobicContact CB-CD1 3.84Å; L1006-I1069 HydrophobicContact CD2-CD1 4.44Å; V1032-I1069 HydrophobicContact CG1-CG1 4.23Å; V1032-I1069 HydrophobicContact CG2-CG1 4.29Å; V1032-I1069 HydrophobicContact CG2-CG2 4.41Å
1070	P	79.1	Confident	82.1	Confident	48 Å²	48	42.8 Å²	42.8	31%	0.312	23%	0.233	S	C	.	.			trans	-75	173	175.4	31.6	-33.5	0	0	0	112.1	E1031 T1072	E1031-P1070 HydrophobicContact CB-CG 3.68Å; E1031-P1070 WeakPolarHBondContact O-CD 3.36Å; E1031-P1070 WeakPolarHBondContact O-CG 3.15Å; P1070-T1072 HydrophobicContact CG-CG2 3.99Å; P1070-T1072 WeakPolarHBondContact O-CG2 3.37Å; P1070-T1072 PolarHBondContact O-N 3.35Å; P1070-T1072 PolarHBondContact O-OG1 2.89Å; P1070-T1072 VanDerWaalsContact O-OG1 3.11Å
1071	E	74.4	Confident	83.1	Confident	103 Å²	103	42.2 Å²	42.2	48%	0.481	23%	0.229	S	C	.	.	S	Bend	trans	-63.3	100.1	178.9	-173.8	165.3	-150.1	0	0	110.7	T1001	T1001-E1071 PolarHBondContact N-OE1 2.94Å; T1001-E1071 WeakPolarHBondContact O-CB 3.36Å; T1001-E1071 WeakPolarHBondContact O-CG 3.29Å
1072	T	67.6	Low	83.4	Confident	23 Å²	23	39.8 Å²	39.8	14%	0.141	22%	0.215	C	C	.	.			trans	-142.8	147.7	-172.2	54.3	0	0	0	0	110	E1031 P1070 K1074 S1075	E1031-T1072 HydrophobicContact CB-CG2 4.26Å; E1031-T1072 WeakPolarHBondContact OE2-CG2 3.19Å; P1070-T1072 HydrophobicContact CG-CG2 3.99Å; P1070-T1072 WeakPolarHBondContact O-CG2 3.37Å; P1070-T1072 PolarHBondContact O-N 3.35Å; P1070-T1072 PolarHBondContact O-OG1 2.89Å; P1070-T1072 VanDerWaalsContact O-OG1 3.11Å; T1072-K1074 VanDerWaalsContact C-N 3.34Å; T1072-K1074 PolarHBondContact O-N 2.94Å; T1072-S1075 PolarHBondContact OG1-OG 3.02Å
1073	N	75.4	Confident	83.3	Confident	121 Å²	121	38.4 Å²	38.4	65%	0.647	21%	0.207	S	C	*	.	S	Bend	trans	-65.2	-39.3	-178.2	-74.4	-13.3	0	0	0	112.2	K995	K995-N1073 PolarHBondContact N-O 3.14Å
1074	K	82.6	Confident	83.1	Confident	125 Å²	125	38.2 Å²	38.2	54%	0.543	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	124.7	178.6	-173.6	172.7	-175.6	164.7	0	109.7	T992 V993 T1072	T992-K1074 HydrophobicContact CG2-CG 4.26Å; V993-K1074 WeakPolarHBondContact O-CA 3.13Å; T1072-K1074 VanDerWaalsContact C-N 3.34Å; T1072-K1074 PolarHBondContact O-N 2.94Å
1075	S	85.4	Confident	82.5	Confident	3 Å²	3	38.2 Å²	38.2	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	134.1	176.8	-89.2	0	0	0	0	110.2	T992 V993 T1072	T992-S1075 WeakPolarHBondContact CA-O 3.22Å; V993-S1075 PolarHBondContact N-O 3.43Å; V993-S1075 PolarHBondContact O-N 3.05Å; T1072-S1075 PolarHBondContact OG1-OG 3.02Å
1076	Q	87.4	Confident	81.8	Confident	77 Å²	77	40.3 Å²	40.3	36%	0.36	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	131.9	178.5	-164.5	176.9	13.9	0	0	110.8	S990 Y991 Y1028 S1029 N1078	S990-Q1076 PolarHBondContact OG-NE2 2.91Å; Y991-Q1076 WeakPolarHBondContact O-CA 3.46Å; Y1028-Q1076 WeakPolarHBondContact CA-O 3.5Å; S1029-Q1076 PolarHBondContact N-O 3.04Å; S1029-Q1076 PolarHBondContact OG-N 3.31Å; S1029-Q1076 PolarHBondContact OG-O 3.42Å; Q1076-N1078 WeakPolarHBondContact CG-OD1 3.48Å; Q1076-N1078 PolarHBondContact NE2-OD1 3.09Å
1077	V	87.9	Confident	81.2	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.006	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	112.2	174.8	-177	0	0	0	0	108.3	Y991 L1006 I1026 V1032 V1079	Y991-V1077 PolarHBondContact N-O 3.37Å; Y991-V1077 PolarHBondContact O-N 2.97Å; L1006-V1077 HydrophobicContact CD2-CB 4.19Å; L1006-V1077 HydrophobicContact CD2-CG2 4.17Å; I1026-V1077 HydrophobicContact CG2-CG1 4.04Å; V1032-V1077 HydrophobicContact CG1-CG2 4.01Å; V1077-V1079 HydrophobicContact CG1-CG2 4.06Å
1078	N	88.1	Confident	80.5	Confident	56 Å²	56	38.1 Å²	38.1	30%	0.299	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	125.2	179.3	-66.1	-14	0	0	0	109.5	S990 I1026 V1027 Q1076	S990-N1078 WeakPolarHBondContact CB-OD1 3.44Å; S990-N1078 PolarHBondContact OG-OD1 3.07Å; I1026-N1078 WeakPolarHBondContact CA-O 3.21Å; V1027-N1078 HydrophobicContact CB-CB 4.44Å; V1027-N1078 PolarHBondContact N-O 3.4Å; V1027-N1078 PolarHBondContact O-N 3.36Å; Q1076-N1078 WeakPolarHBondContact CG-OD1 3.48Å; Q1076-N1078 PolarHBondContact NE2-OD1 3.09Å
1079	V	87.6	Confident	79.7	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.006	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	123.8	-174.8	-172.4	0	0	0	0	108.6	I989 Y991 P1023 I1026 F1065 V1077 F1081	I989-V1079 PolarHBondContact N-O 2.82Å; I989-V1079 PolarHBondContact O-N 3.28Å; Y991-V1079 HydrophobicContact CD2-CG2 4.11Å; Y991-V1079 HydrophobicContact CE2-CB 4.49Å; Y991-V1079 HydrophobicContact CE2-CG2 3.96Å; P1023-V1079 HydrophobicContact CB-CG1 4.13Å; I1026-V1079 HydrophobicContact CG1-CG1 4.4Å; I1026-V1079 HydrophobicContact CG2-CG2 4.36Å; F1065-V1079 HydrophobicContact CE1-CG1 4.15Å; F1065-V1079 HydrophobicContact CE2-CG2 4.17Å; F1065-V1079 HydrophobicContact CZ-CB 4.41Å; F1065-V1079 HydrophobicContact CZ-CG1 3.89Å; F1065-V1079 HydrophobicContact CZ-CG2 3.66Å; V1077-V1079 HydrophobicContact CG1-CG2 4.06Å; V1079-F1081 HydrophobicContact CB-CD2 4.38Å; V1079-F1081 HydrophobicContact CB-CE2 3.86Å; V1079-F1081 HydrophobicContact CB-CZ 4.45Å; V1079-F1081 HydrophobicContact CG1-CD2 3.86Å; V1079-F1081 HydrophobicContact CG1-CE1 4.23Å; V1079-F1081 HydrophobicContact CG1-CE2 3.37Å; V1079-F1081 HydrophobicContact CG1-CG 4.48Å; V1079-F1081 HydrophobicContact CG1-CZ 3.59Å
1080	T	86.2	Confident	79	Confident	17 Å²	17	43 Å²	43	10%	0.104	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	110.3	175.3	-57.7	0	0	0	0	109.4	E986 N988 P1023 T1024 R1025	E986-T1080 HydrophobicContact CB-CG2 3.95Å; E986-T1080 HydrophobicContact CG-CG2 4.25Å; N988-T1080 WeakPolarHBondContact OD1-CB 3.19Å; N988-T1080 VanDerWaalsContact OD1-CG2 3.31Å; N988-T1080 WeakPolarHBondContact OD1-CG2 3.49Å; N988-T1080 PolarHBondContact OD1-OG1 2.79Å; P1023-T1080 WeakPolarHBondContact CA-O 3.32Å; T1024-T1080 PolarHBondContact N-O 3.01Å; T1024-T1080 PolarHBondContact OG1-O 3.44Å; R1025-T1080 PolarHBondContact O-N 2.71Å
1081	F	84.6	Confident	78.5	Confident	1 Å²	1	40.9 Å²	40.9	0%	0.004	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	141.6	175	-69.8	-83.1	0	0	0	111.3	V987 I989 V1008 Y1010 L1021 P1023 F1065 V1079 V1100	V987-F1081 PolarHBondContact N-O 3.13Å; V987-F1081 PolarHBondContact O-N 3.02Å; I989-F1081 HydrophobicContact CD1-CD2 3.87Å; I989-F1081 HydrophobicContact CD1-CE2 3.87Å; I989-F1081 HydrophobicContact CG1-CD2 4.23Å; I989-F1081 HydrophobicContact CG1-CE2 4.42Å; V1008-F1081 HydrophobicContact CG1-CZ 4.26Å; Y1010-F1081 AromaticContact CD1-CE1 3.83Å; Y1010-F1081 HydrophobicContact CD1-CE1 3.83Å; Y1010-F1081 HydrophobicContact CD1-CZ 4.34Å; Y1010-F1081 HydrophobicContact CD2-CE1 4.25Å; Y1010-F1081 HydrophobicContact CE1-CE1 4.34Å; Y1010-F1081 AromaticContact CG-CE1 3.79Å; Y1010-F1081 HydrophobicContact CG-CE1 3.79Å; L1021-F1081 HydrophobicContact CD1-CB 3.89Å; L1021-F1081 HydrophobicContact CD2-CB 4.21Å; L1021-F1081 HydrophobicContact CD2-CD1 3.76Å; L1021-F1081 HydrophobicContact CD2-CE1 4.34Å; L1021-F1081 HydrophobicContact CD2-CG 4.08Å; L1021-F1081 HydrophobicContact CG-CB 4.05Å; L1021-F1081 HydrophobicContact CG-CD1 3.89Å; L1021-F1081 HydrophobicContact CG-CG 4.28Å; P1023-F1081 HydrophobicContact CB-CD1 4.15Å; P1023-F1081 HydrophobicContact CB-CE1 4.06Å; P1023-F1081 HydrophobicContact CG-CE1 4.46Å; F1065-F1081 HydrophobicContact CE1-CZ 4.16Å; V1079-F1081 HydrophobicContact CB-CD2 4.38Å; V1079-F1081 HydrophobicContact CB-CE2 3.86Å; V1079-F1081 HydrophobicContact CB-CZ 4.45Å; V1079-F1081 HydrophobicContact CG1-CD2 3.86Å; V1079-F1081 HydrophobicContact CG1-CE1 4.23Å; V1079-F1081 HydrophobicContact CG1-CE2 3.37Å; V1079-F1081 HydrophobicContact CG1-CG 4.48Å; V1079-F1081 HydrophobicContact CG1-CZ 3.59Å; F1081-V1100 HydrophobicContact CE2-CG1 4.45Å; F1081-V1100 HydrophobicContact CZ-CG1 4.19Å
1082	K	81.9	Confident	78.3	Confident	33 Å²	33	40.6 Å²	40.6	14%	0.143	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	135.1	173.3	-64.4	-168.4	-178.2	-155.5	0	110.5	I984 E986 F1022 T1024	I984-K1082 HydrophobicContact CD1-CD 4.08Å; I984-K1082 HydrophobicContact CG2-CB 4.41Å; I984-K1082 HydrophobicContact CG2-CD 3.52Å; I984-K1082 HydrophobicContact CG2-CG 3.87Å; E986-K1082 HydrophobicContact CG-CG 4.33Å; E986-K1082 WeakPolarHBondContact OE1-CE 3.09Å; E986-K1082 IonicContact OE1-NZ 3.57Å; E986-K1082 PolarHBondContact OE1-NZ 3.43Å; F1022-K1082 WeakPolarHBondContact CD1-O 3.4Å; F1022-K1082 HydrophobicContact CE1-CB 4.15Å; F1022-K1082 HydrophobicContact CE2-CB 4.12Å; F1022-K1082 HydrophobicContact CZ-CB 3.83Å; F1022-K1082 PolarHBondContact N-O 3.35Å; F1022-K1082 PolarHBondContact O-N 3.07Å; T1024-K1082 HydrophobicContact CG2-CB 4.31Å; T1024-K1082 HydrophobicContact CG2-CD 3.56Å; T1024-K1082 HydrophobicContact CG2-CG 3.86Å; T1024-K1082 WeakPolarHBondContact OG1-CE 3.49Å
1083	A	80.4	Confident	78.5	Confident	14 Å²	14	40.6 Å²	40.6	12%	0.116	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	132.6	171.5	0	0	0	0	0	110.1	I965 L1020 L1021 K1085 F1088 I1127	I965-A1083 HydrophobicContact CD1-CB 3.67Å; L1020-A1083 WeakPolarHBondContact O-CA 3.34Å; L1021-A1083 HydrophobicContact CD1-CB 4.49Å; A1083-K1085 PolarHBondContact O-N 3Å; A1083-F1088 HydrophobicContact CB-CD2 4.46Å; A1083-F1088 HydrophobicContact CB-CE2 3.87Å; A1083-I1127 HydrophobicContact CB-CD1 4.16Å
1084	W	78.8	Confident	78.3	Confident	38 Å²	38	38.8 Å²	38.8	14%	0.144	21%	0.206	C	C	.	.			trans	-79	88.6	179.2	-171.5	-106.3	0	0	0	111.2	V1019 L1020 F1022 H1042 P1086 T1087 F1088	V1019-W1084 HydrophobicContact CB-CB 4.17Å; V1019-W1084 HydrophobicContact CB-CG 4.1Å; V1019-W1084 HydrophobicContact CG1-CB 3.95Å; V1019-W1084 HydrophobicContact CG1-CG 4.22Å; V1019-W1084 WeakPolarHBondContact O-CB 3.47Å; L1020-W1084 PolarHBondContact O-N 3.28Å; F1022-W1084 HydrophobicContact CE1-CB 4.1Å; F1022-W1084 AromaticContact CE1-CE3 3.78Å; F1022-W1084 HydrophobicContact CE1-CE3 3.78Å; F1022-W1084 HydrophobicContact CZ-CE3 4.01Å; H1042-W1084 AromaticContact CE1-CH2 3.57Å; H1042-W1084 AromaticContact CE1-CZ3 3.5Å; H1042-W1084 AromaticContact CG-CH2 3.99Å; H1042-W1084 AromaticContact ND1-CH2 3.09Å; H1042-W1084 WeakPolarHBondContact ND1-CH2 3.46Å; H1042-W1084 AromaticContact ND1-CZ2 3.69Å; H1042-W1084 AromaticContact ND1-CZ3 3.43Å; H1042-W1084 WeakPolarHBondContact ND1-CZ3 3.49Å; W1084-P1086 VanDerWaalsContact C-N 3.31Å; W1084-P1086 HydrophobicContact CD2-CG 4.39Å; W1084-P1086 HydrophobicContact CZ2-CG 4.12Å; W1084-P1086 VanDerWaalsContact O-N 3.12Å; W1084-T1087 PolarHBondContact O-N 3.47Å; W1084-F1088 VanDerWaalsContact O-CD2 3.22Å; W1084-F1088 WeakPolarHBondContact O-CD2 3.37Å
1085	K	71.6	Confident	77.8	Confident	59 Å²	59	35 Å²	35	26%	0.257	20%	0.195	S	C	.	.	H	α-helix	trans	-45.1	-42.1	-177.8	-68.7	-169.2	178.6	-168.3	0	115	M983 A1083 T1087 F1088 T1089	M983-K1085 WeakPolarHBondContact O-CE 3.41Å; A1083-K1085 PolarHBondContact O-N 3Å; K1085-T1087 PolarHBondContact O-N 3.4Å; K1085-T1087 VanDerWaalsContact O-N 3.14Å; K1085-F1088 CarbonylContact O-C 3.58Å; K1085-F1088 PolarHBondContact O-N 3.04Å; K1085-T1089 PolarHBondContact O-N 3.3Å; K1085-T1089 PolarHBondContact O-OG1 3.11Å
1086	P	72.7	Confident	77.5	Confident	48 Å²	48	35 Å²	35	31%	0.312	19%	0.194	S	C	.	.	H	α-helix	trans	-58.5	-28.9	-179.3	-26.7	35.5	0	0	0	114.8	P1045 W1084 T1089 V1090	P1045-P1086 HydrophobicContact CG-CB 3.98Å; P1045-P1086 WeakPolarHBondContact CG-O 3.22Å; W1084-P1086 VanDerWaalsContact C-N 3.31Å; W1084-P1086 HydrophobicContact CD2-CG 4.39Å; W1084-P1086 HydrophobicContact CZ2-CG 4.12Å; W1084-P1086 VanDerWaalsContact O-N 3.12Å; P1086-T1089 WeakPolarHBondContact CA-OG1 3.37Å; P1086-T1089 PolarHBondContact O-OG1 2.96Å; P1086-V1090 WeakPolarHBondContact O-CG2 3.22Å; P1086-V1090 PolarHBondContact O-N 3.45Å
1087	T	74.4	Confident	77.2	Confident	4 Å²	4	36.3 Å²	36.3	3%	0.025	20%	0.199	C	C	.	.	H	α-helix	trans	-71.6	-38.1	174.9	-72.4	0	0	0	0	111.3	N1018 V1019 L1020 W1084 K1085 G1091	N1018-T1087 HydrophobicContact CB-CG2 3.53Å; V1019-T1087 VanDerWaalsContact O-CB 3.28Å; V1019-T1087 WeakPolarHBondContact O-CB 3.48Å; V1019-T1087 PolarHBondContact O-OG1 2.62Å; L1020-T1087 HydrophobicContact CD2-CG2 3.86Å; W1084-T1087 PolarHBondContact O-N 3.47Å; K1085-T1087 PolarHBondContact O-N 3.4Å; K1085-T1087 VanDerWaalsContact O-N 3.14Å; T1087-G1091 PolarHBondContact O-N 2.94Å
1088	F	74.6	Confident	76.9	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-82.9	-19	-178.4	-59.4	-69.1	0	0	0	113.7	I967 L1020 L1050 A1083 W1084 K1085 F1093 L1096 M1098 I1127	I967-F1088 HydrophobicContact CD1-CB 3.22Å; I967-F1088 HydrophobicContact CD1-CD2 4.27Å; I967-F1088 HydrophobicContact CD1-CG 3.89Å; L1020-F1088 HydrophobicContact CB-CZ 4.31Å; L1020-F1088 HydrophobicContact CD2-CE1 3.84Å; L1020-F1088 HydrophobicContact CD2-CZ 3.74Å; L1050-F1088 HydrophobicContact CD1-CD1 4.39Å; L1050-F1088 HydrophobicContact CD1-CE1 4.48Å; A1083-F1088 HydrophobicContact CB-CD2 4.46Å; A1083-F1088 HydrophobicContact CB-CE2 3.87Å; W1084-F1088 VanDerWaalsContact O-CD2 3.22Å; W1084-F1088 WeakPolarHBondContact O-CD2 3.37Å; K1085-F1088 CarbonylContact O-C 3.58Å; K1085-F1088 PolarHBondContact O-N 3.04Å; F1088-F1093 HydrophobicContact CB-CE1 3.85Å; F1088-F1093 HydrophobicContact CB-CZ 3.83Å; F1088-F1093 AromaticContact CD1-CE1 3.9Å; F1088-F1093 HydrophobicContact CD1-CE1 3.9Å; F1088-F1093 AromaticContact CD1-CZ 3.86Å; F1088-F1093 HydrophobicContact CD1-CZ 3.86Å; F1088-F1093 HydrophobicContact CG-CE1 4.38Å; F1088-F1093 HydrophobicContact CG-CZ 4.27Å; F1088-F1093 VanDerWaalsContact O-CE1 3.23Å; F1088-F1093 WeakPolarHBondContact O-CE1 3.34Å; F1088-L1096 HydrophobicContact CD1-CD2 4.41Å; F1088-L1096 HydrophobicContact CE1-CD2 3.7Å; F1088-M1098 HydrophobicContact CZ-SD 4.29Å; F1088-I1127 HydrophobicContact CD1-CD1 4.19Å; F1088-I1127 HydrophobicContact CD1-CG2 4.42Å; F1088-I1127 HydrophobicContact CD2-CD1 4.33Å; F1088-I1127 HydrophobicContact CE1-CD1 3.64Å; F1088-I1127 HydrophobicContact CE2-CD1 3.8Å; F1088-I1127 HydrophobicContact CZ-CD1 3.41Å; F1088-I1127 VanDerWaalsContact CZ-CD1 3.41Å
1089	T	68.6	Low	76.7	Confident	72 Å²	72	35.1 Å²	35.1	44%	0.442	19%	0.192	S	C	.	.	H	α-helix	trans	-79	-35.1	171.8	51.6	0	0	0	0	112.4	I967 K1085 P1086	I967-T1089 HydrophobicContact CG2-CG2 4.25Å; K1085-T1089 PolarHBondContact O-N 3.3Å; K1085-T1089 PolarHBondContact O-OG1 3.11Å; P1086-T1089 WeakPolarHBondContact CA-OG1 3.37Å; P1086-T1089 PolarHBondContact O-OG1 2.96Å
1090	V	70.3	Confident	76.7	Confident	59 Å²	59	35 Å²	35	36%	0.358	19%	0.191	S	C	.	.	H	α-helix	trans	-84.2	-26	178.4	-177.4	0	0	0	0	112	P1045 K1047 P1086	P1045-V1090 HydrophobicContact CG-CG2 4.14Å; K1047-V1090 HydrophobicContact CB-CG1 4.02Å; K1047-V1090 HydrophobicContact CG-CG1 4.3Å; P1086-V1090 WeakPolarHBondContact O-CG2 3.22Å; P1086-V1090 PolarHBondContact O-N 3.45Å
1091	G	68.3	Low	76.8	Confident	4 Å²	4	36.8 Å²	36.8	4%	0.041	20%	0.2	C	C	.	.	S	Bend	trans	-75.2	146.9	179.5	0	0	0	0	0	114.2	E1048 T1087	E1048-G1091 VanDerWaalsContact O-CA 3.26Å; E1048-G1091 WeakPolarHBondContact O-CA 3.28Å; T1087-G1091 PolarHBondContact O-N 2.94Å
1092	E	69.3	Low	76.9	Confident	97 Å²	97	36.8 Å²	36.8	45%	0.453	20%	0.2	S	C	.	.	B	Isolated β-bridge	trans	-95.3	108.4	175	-74.3	174.3	-174.8	0	0	110.3	K1047 E1048 T1049 L1050	K1047-E1092 WeakPolarHBondContact CE-OE1 3.22Å; K1047-E1092 IonicContact NZ-OE1 2.72Å; K1047-E1092 PolarHBondContact NZ-OE1 3.17Å; E1048-E1092 PolarHBondContact O-N 3.45Å; T1049-E1092 HydrophobicContact CG2-CB 4.31Å; L1050-E1092 PolarHBondContact N-O 2.91Å
1093	F	73.3	Confident	77.2	Confident	23 Å²	23	36.3 Å²	36.3	10%	0.101	20%	0.201	C	C	.	.			trans	-159.8	159.9	174.5	67.9	-80.9	0	0	0	112.2	I967 L1050 F1088 L1096 I1127 K1129	I967-F1093 HydrophobicContact CD1-CZ 4.38Å; L1050-F1093 HydrophobicContact CB-CB 4.1Å; L1050-F1093 HydrophobicContact CD1-CD1 4.24Å; L1050-F1093 WeakPolarHBondContact O-CB 3.31Å; F1088-F1093 HydrophobicContact CB-CE1 3.85Å; F1088-F1093 HydrophobicContact CB-CZ 3.83Å; F1088-F1093 AromaticContact CD1-CE1 3.9Å; F1088-F1093 HydrophobicContact CD1-CE1 3.9Å; F1088-F1093 AromaticContact CD1-CZ 3.86Å; F1088-F1093 HydrophobicContact CD1-CZ 3.86Å; F1088-F1093 HydrophobicContact CG-CE1 4.38Å; F1088-F1093 HydrophobicContact CG-CZ 4.27Å; F1088-F1093 VanDerWaalsContact O-CE1 3.23Å; F1088-F1093 WeakPolarHBondContact O-CE1 3.34Å; F1093-L1096 HydrophobicContact CD2-CB 4.16Å; F1093-L1096 HydrophobicContact CE2-CB 4.48Å; F1093-I1127 HydrophobicContact CE2-CG2 3.93Å; F1093-I1127 HydrophobicContact CZ-CG2 4.05Å; F1093-K1129 HydrophobicContact CE2-CB 4.29Å
1094	S	69.9	Low	77.5	Confident	83 Å²	83	36 Å²	36	58%	0.58	20%	0.197	S	C	*	.	S	Bend	trans	-102.8	-46.7	173.9	55.4	0	0	0	0	112.5	K1129	S1094-K1129 PolarHBondContact O-N 3.28Å; S1094-K1129 VanDerWaalsContact O-N 3.09Å
1095	S	73.6	Confident	77.8	Confident	45 Å²	45	37.5 Å²	37.5	32%	0.315	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	143.7	170.9	66.7	0	0	0	0	110.6	I1127	S1095-I1127 CarbonylContact C-O 3.45Å; S1095-I1127 VanDerWaalsContact CA-O 3.3Å; S1095-I1127 WeakPolarHBondContact CA-O 3.11Å
1096	L	79.2	Confident	78.3	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.01	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	134.5	-177.6	-172.4	70.4	0	0	0	109.7	L1050 L1055 F1088 F1093 M1098 L1126 I1127	L1050-L1096 HydrophobicContact CB-CD1 4.4Å; L1050-L1096 HydrophobicContact CD1-CD2 4.33Å; L1055-L1096 HydrophobicContact CD1-CD1 3.65Å; L1055-L1096 HydrophobicContact CD1-CD2 3.77Å; L1055-L1096 HydrophobicContact CD1-CG 3.92Å; L1055-L1096 HydrophobicContact CG-CD1 4.34Å; F1088-L1096 HydrophobicContact CD1-CD2 4.41Å; F1088-L1096 HydrophobicContact CE1-CD2 3.7Å; F1093-L1096 HydrophobicContact CD2-CB 4.16Å; F1093-L1096 HydrophobicContact CE2-CB 4.48Å; L1096-M1098 HydrophobicContact CD2-CG 4.29Å; L1096-M1098 HydrophobicContact CG-CG 4.48Å; L1096-L1126 CarbonylContact O-C 3.55Å; L1096-L1126 WeakPolarHBondContact O-CA 3.38Å; L1096-I1127 HydrophobicContact CB-CB 4.4Å; L1096-I1127 PolarHBondContact N-O 3.17Å; L1096-I1127 PolarHBondContact O-N 3.47Å
1097	K	79.8	Confident	78.1	Confident	106 Å²	106	39.8 Å²	39.8	46%	0.461	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	118.9	176	-67.5	178.1	-176.5	176.5	0	109.6	L1054 L1055 T1124 I1125 L1126	L1054-K1097 WeakPolarHBondContact CA-O 3.41Å; L1054-K1097 HydrophobicContact CD1-CB 3.84Å; L1055-K1097 PolarHBondContact N-O 3.46Å; K1097-T1124 HydrophobicContact CB-CG2 3.9Å; K1097-T1124 HydrophobicContact CD-CG2 4.43Å; K1097-T1124 HydrophobicContact CG-CG2 4.27Å; K1097-I1125 CarbonylContact C-O 3.57Å; K1097-I1125 WeakPolarHBondContact CA-O 3.42Å; K1097-L1126 HydrophobicContact CD-CD1 4.4Å; K1097-L1126 HydrophobicContact CG-CD1 3.56Å
1098	M	82.3	Confident	77.5	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	132.8	176.5	-63.1	-175.7	-57.3	0	0	109.7	P1011 L1020 L1021 L1055 F1088 L1096 T1124 I1125 I1127	P1011-M1098 HydrophobicContact CG-CB 3.95Å; P1011-M1098 HydrophobicContact CG-CG 4.35Å; P1011-M1098 HydrophobicContact CG-SD 4.45Å; L1020-M1098 HydrophobicContact CB-SD 4.3Å; L1021-M1098 HydrophobicContact CB-CE 4.38Å; L1021-M1098 HydrophobicContact CB-SD 4.5Å; L1021-M1098 HydrophobicContact CD1-CE 4.06Å; L1055-M1098 HydrophobicContact CD1-CG 4.16Å; F1088-M1098 HydrophobicContact CZ-SD 4.29Å; L1096-M1098 HydrophobicContact CD2-CG 4.29Å; L1096-M1098 HydrophobicContact CG-CG 4.48Å; M1098-T1124 CarbonylContact O-C 3.32Å; M1098-T1124 WeakPolarHBondContact O-CA 3.26Å; M1098-I1125 HydrophobicContact CE-CB 4.44Å; M1098-I1125 HydrophobicContact CE-CG2 4.21Å; M1098-I1125 PolarHBondContact N-O 3.24Å; M1098-I1125 PolarHBondContact O-N 3.28Å; M1098-I1127 HydrophobicContact CE-CD1 3.31Å; M1098-I1127 HydrophobicContact CE-CG1 3.94Å; M1098-I1127 HydrophobicContact SD-CD1 4.18Å
1099	M	83.3	Confident	76.9	Confident	31 Å²	31	50.8 Å²	50.8	15%	0.153	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	126.6	179.5	-172.5	175.2	-77.8	0	0	111.2	P1011 L1054 L1055 E1056 N1122 V1123	P1011-M1099 WeakPolarHBondContact CD-O 3.41Å; L1054-M1099 HydrophobicContact CD1-CB 4.5Å; L1054-M1099 HydrophobicContact CD1-CE 4.14Å; L1054-M1099 HydrophobicContact CD2-CE 3.6Å; L1054-M1099 HydrophobicContact CD2-SD 4.42Å; L1054-M1099 HydrophobicContact CG-CE 4.36Å; L1055-M1099 PolarHBondContact O-N 3.11Å; E1056-M1099 HydrophobicContact CG-SD 4.48Å; M1099-N1122 HydrophobicContact CE-CB 4.38Å; M1099-N1122 HydrophobicContact CG-CB 4.18Å; M1099-N1122 HydrophobicContact SD-CB 3.92Å; M1099-V1123 WeakPolarHBondContact CA-O 3.23Å
1100	V	87.3	Confident	76.9	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	124.2	169.2	-178.8	0	0	0	0	107.9	I989 Y991 V1008 L1021 F1081 N1122 V1123 I1125	I989-V1100 HydrophobicContact CD1-CB 4.47Å; I989-V1100 HydrophobicContact CD1-CG2 4.43Å; Y991-V1100 WeakPolarHBondContact OH-CG1 3.3Å; V1008-V1100 HydrophobicContact CG1-CG1 3.66Å; L1021-V1100 HydrophobicContact CD2-CG2 3.89Å; F1081-V1100 HydrophobicContact CE2-CG1 4.45Å; F1081-V1100 HydrophobicContact CZ-CG1 4.19Å; V1100-N1122 WeakPolarHBondContact O-CA 2.95Å; V1100-V1123 PolarHBondContact N-O 2.69Å; V1100-V1123 PolarHBondContact O-N 2.82Å; V1100-I1125 HydrophobicContact CG2-CD1 4.05Å
1101	N	88	Confident	76.9	Confident	54 Å²	54	51.6 Å²	51.6	29%	0.289	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	126.8	-178.9	-174.5	-5.4	0	0	0	109.6	V1008 I1009 N1122	V1008-N1101 WeakPolarHBondContact CA-O 3.37Å; I1009-N1101 PolarHBondContact N-O 3.02Å; I1009-N1101 PolarHBondContact O-N 3.39Å; N1101-N1122 VanDerWaalsContact CG-OD1 3.25Å; N1101-N1122 PolarHBondContact OD1-OD1 3.14Å; N1101-N1122 VanDerWaalsContact OD1-OD1 3.07Å
1102	A	88.4	Confident	77.3	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	127.7	174.1	0	0	0	0	0	110.3	F956 Y991 L1006 N1007 V1008 T1120 R1121	F956-A1102 HydrophobicContact CE1-CB 4.41Å; F956-A1102 HydrophobicContact CZ-CB 3.89Å; Y991-A1102 HydrophobicContact CD1-CB 3.79Å; Y991-A1102 HydrophobicContact CE1-CB 3.26Å; L1006-A1102 HydrophobicContact CD1-CB 4.23Å; N1007-A1102 CarbonylContact O-C 3.59Å; N1007-A1102 WeakPolarHBondContact O-CA 3.22Å; V1008-A1102 HydrophobicContact CG2-CB 4.04Å; A1102-T1120 CarbonylContact O-C 3.45Å; A1102-T1120 WeakPolarHBondContact O-CA 3.42Å; A1102-R1121 PolarHBondContact N-O 3.5Å; A1102-R1121 PolarHBondContact O-N 3.4Å
1103	S	88.2	Confident	77.7	Confident	24 Å²	24	51.5 Å²	51.5	17%	0.168	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	146	177.8	62.3	0	0	0	0	112	N1007 K1119	N1007-S1103 PolarHBondContact N-O 3.13Å; N1007-S1103 PolarHBondContact O-N 3.06Å; S1103-K1119 WeakPolarHBondContact CA-O 3.2Å
1104	L	86.9	Confident	77.9	Confident	6 Å²	6	51 Å²	51	3%	0.031	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	133.3	174	-73.2	174.5	0	0	0	110	V954 F956 V993 L1006 L1114 K1119	V954-L1104 HydrophobicContact CG1-CD1 4.44Å; F956-L1104 HydrophobicContact CB-CD1 3.62Å; F956-L1104 HydrophobicContact CD1-CD1 3.72Å; F956-L1104 HydrophobicContact CD1-CG 4.04Å; F956-L1104 HydrophobicContact CD2-CD1 3.79Å; F956-L1104 HydrophobicContact CD2-CG 4.38Å; F956-L1104 HydrophobicContact CE1-CD1 4.31Å; F956-L1104 HydrophobicContact CE1-CG 4.16Å; F956-L1104 HydrophobicContact CE2-CD1 4.38Å; F956-L1104 HydrophobicContact CE2-CG 4.5Å; F956-L1104 HydrophobicContact CG-CD1 3.44Å; F956-L1104 VanDerWaalsContact CG-CD1 3.44Å; F956-L1104 HydrophobicContact CG-CG 4.17Å; F956-L1104 HydrophobicContact CZ-CG 4.4Å; V993-L1104 HydrophobicContact CG1-CD1 4.49Å; V993-L1104 HydrophobicContact CG2-CD1 4.19Å; V993-L1104 HydrophobicContact CG2-CD2 4.12Å; L1006-L1104 HydrophobicContact CB-CD2 3.9Å; L1006-L1104 HydrophobicContact CD1-CD2 3.77Å; L1006-L1104 HydrophobicContact CD1-CG 4.31Å; L1006-L1104 HydrophobicContact CG-CD2 4.44Å; L1104-L1114 HydrophobicContact CB-CD1 3.95Å; L1104-L1114 WeakPolarHBondContact O-CD1 3.44Å; L1104-K1119 PolarHBondContact N-O 3.4Å
1105	T	84.6	Confident	78	Confident	71 Å²	71	47.5 Å²	47.5	44%	0.436	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	148.3	177	53.1	0	0	0	0	110.7	L1004 D1005	L1004-T1105 CarbonylContact C-O 3.55Å; L1004-T1105 WeakPolarHBondContact CA-O 3.4Å; D1005-T1105 PolarHBondContact N-O 3.17Å; D1005-T1105 PolarHBondContact O-N 2.71Å; D1005-T1105 PolarHBondContact O-OG1 2.93Å
1106	F	81.8	Confident	77.6	Confident	39 Å²	39	50.1 Å²	50.1	17%	0.171	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	137	172.3	-66.7	-62.9	0	0	0	111.1	A952 P1002 L1004 F1112 L1114	A952-F1106 HydrophobicContact CB-CE1 4.22Å; A952-F1106 HydrophobicContact CB-CE2 4.47Å; A952-F1106 HydrophobicContact CB-CZ 3.51Å; P1002-F1106 HydrophobicContact CB-CD1 4.48Å; P1002-F1106 HydrophobicContact CG-CD1 3.64Å; P1002-F1106 HydrophobicContact CG-CE1 3.62Å; P1002-F1106 HydrophobicContact CG-CG 4.48Å; P1002-F1106 HydrophobicContact CG-CZ 4.46Å; L1004-F1106 HydrophobicContact CD2-CD1 3.42Å; L1004-F1106 VanDerWaalsContact CD2-CD1 3.42Å; L1004-F1106 HydrophobicContact CD2-CE1 3.31Å; L1004-F1106 HydrophobicContact CD2-CG 4.31Å; L1004-F1106 HydrophobicContact CD2-CZ 4.11Å; L1004-F1106 HydrophobicContact CG-CD1 4.23Å; L1004-F1106 HydrophobicContact CG-CE1 4.13Å; F1106-F1112 HydrophobicContact CD2-CB 4.27Å; F1106-F1112 HydrophobicContact CE1-CB 4.5Å; F1106-F1112 HydrophobicContact CE2-CB 3.76Å; F1106-F1112 HydrophobicContact CZ-CB 3.93Å; F1106-L1114 HydrophobicContact CD2-CG 4.39Å; F1106-L1114 HydrophobicContact CE1-CD2 4.33Å; F1106-L1114 HydrophobicContact CE2-CD1 4.37Å; F1106-L1114 HydrophobicContact CE2-CD2 4.13Å; F1106-L1114 HydrophobicContact CE2-CG 3.61Å; F1106-L1114 HydrophobicContact CZ-CD2 3.65Å; F1106-L1114 HydrophobicContact CZ-CG 3.69Å
1107	K	68.8	Low	76.9	Confident	115 Å²	115	56.2 Å²	56.2	50%	0.5	29%	0.289	S	S	.	.	S	Bend	trans	-70.5	-39.8	-179.8	-171.4	172.1	-171.4	172.5	0	112.5	A1003 D1005 S1068	A1003-K1107 PolarHBondContact O-N 3.09Å; A1003-K1107 VanDerWaalsContact O-N 3.12Å; D1005-K1107 WeakPolarHBondContact OD2-CG 3.45Å; S1068-K1107 PolarHBondContact OG-NZ 2.78Å
1108	Q	60.9	Low	76.2	Confident	178 Å²	178	51.4 Å²	51.4	83%	0.832	27%	0.269	S	S	*	.	S	Bend	trans	-164.9	93.2	178.8	-100.3	166	1.1	0	0	108.7
1109	N	62.5	Low	76	Confident	57 Å²	57	55.2 Å²	55.2	31%	0.305	29%	0.285	S	S	.	.			trans	-165.6	124.7	156.8	-141.1	-31.1	0	0	0	111.1	P1002 L1111 F1112	P1002-N1109 HydrophobicContact CB-CB 4.36Å; P1002-N1109 HydrophobicContact CG-CB 4.26Å; N1109-L1111 VanDerWaalsContact C-N 3.3Å; N1109-L1111 PolarHBondContact OD1-N 3.29Å; N1109-F1112 HydrophobicContact CB-CD2 3.97Å; N1109-F1112 VanDerWaalsContact ND2-CD2 3.29Å; N1109-F1112 WeakPolarHBondContact ND2-CD2 3.34Å; N1109-F1112 WeakPolarHBondContact ND2-CE2 3.38Å
1110	H	67.6	Low	76	Confident	121 Å²	121	57.1 Å²	57.1	56%	0.56	30%	0.299	S	S	*	.	S	Bend	trans	-83.5	-10	175	60	-72.3	0	0	0	113.1	E918	E918-H1110 IonicContact OE1-CD2 3.36Å; E918-H1110 PolarHBondContact OE1-CD2 3.15Å; E918-H1110 IonicContact OE1-CE1 4Å; E918-H1110 IonicContact OE1-NE2 3.83Å; E918-H1110 PolarHBondContact OE1-NE2 3Å
1111	L	72.1	Confident	76	Confident	28 Å²	28	61 Å²	61	15%	0.147	31%	0.313	C	S	.	.	S	Bend	trans	-87.4	-17	-175.4	-63.3	177	0	0	0	114.5	E918 K949 Y950 N1109	E918-L1111 HydrophobicContact CB-CD2 3.64Å; E918-L1111 HydrophobicContact CG-CD2 3.63Å; K949-L1111 CarbonylContact C-O 3.58Å; K949-L1111 WeakPolarHBondContact CA-O 3.44Å; Y950-L1111 PolarHBondContact N-O 3.18Å; N1109-L1111 VanDerWaalsContact C-N 3.3Å; N1109-L1111 PolarHBondContact OD1-N 3.29Å
1112	F	75.8	Confident	75.9	Confident	24 Å²	24	62.6 Å²	62.6	11%	0.105	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	140.3	-173.7	-65.8	-95.2	0	0	0	112.2	I916 Y950 A952 P1002 F1106 N1109	I916-F1112 HydrophobicContact CD1-CE1 4.09Å; I916-F1112 HydrophobicContact CD1-CZ 3.68Å; I916-F1112 HydrophobicContact CG2-CZ 4.18Å; Y950-F1112 CarbonylContact O-C 3.54Å; Y950-F1112 VanDerWaalsContact O-CA 3.25Å; Y950-F1112 WeakPolarHBondContact O-CA 3.31Å; A952-F1112 HydrophobicContact CB-CD1 4.42Å; P1002-F1112 HydrophobicContact CG-CB 4.24Å; P1002-F1112 HydrophobicContact CG-CD1 4.48Å; P1002-F1112 HydrophobicContact CG-CD2 3.75Å; P1002-F1112 HydrophobicContact CG-CE2 4.14Å; P1002-F1112 HydrophobicContact CG-CG 3.91Å; F1106-F1112 HydrophobicContact CD2-CB 4.27Å; F1106-F1112 HydrophobicContact CE1-CB 4.5Å; F1106-F1112 HydrophobicContact CE2-CB 3.76Å; F1106-F1112 HydrophobicContact CZ-CB 3.93Å; N1109-F1112 HydrophobicContact CB-CD2 3.97Å; N1109-F1112 VanDerWaalsContact ND2-CD2 3.29Å; N1109-F1112 WeakPolarHBondContact ND2-CD2 3.34Å; N1109-F1112 WeakPolarHBondContact ND2-CE2 3.38Å
1113	E	78.3	Confident	75.8	Confident	75 Å²	75	63 Å²	63	35%	0.35	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	137.6	171.2	-171.2	165	-180	0	0	110.5	L835 Y950 E951 A952 K1119	L835-E1113 HydrophobicContact CD1-CB 4.34Å; Y950-E1113 PolarHBondContact O-N 2.71Å; E951-E1113 CarbonylContact C-O 3.52Å; E951-E1113 VanDerWaalsContact CA-O 3.3Å; E951-E1113 WeakPolarHBondContact CA-O 2.93Å; A952-E1113 PolarHBondContact N-O 2.98Å; E1113-K1119 IonicContact OE1-NZ 3.84Å; E1113-K1119 PolarHBondContact OE1-NZ 3.43Å
1114	L	77.4	Confident	75.5	Confident	12 Å²	12	64.5 Å²	64.5	6%	0.063	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	137.5	174.4	-74.4	165.8	0	0	0	109.7	A952 V954 L1004 L1104 F1106 K1119	A952-L1114 HydrophobicContact CB-CD2 4.42Å; V954-L1114 HydrophobicContact CB-CD2 4.35Å; V954-L1114 HydrophobicContact CG2-CD2 4.38Å; L1004-L1114 HydrophobicContact CD2-CD1 4.46Å; L1004-L1114 HydrophobicContact CD2-CD2 4.21Å; L1104-L1114 HydrophobicContact CB-CD1 3.95Å; L1104-L1114 WeakPolarHBondContact O-CD1 3.44Å; F1106-L1114 HydrophobicContact CD2-CG 4.39Å; F1106-L1114 HydrophobicContact CE1-CD2 4.33Å; F1106-L1114 HydrophobicContact CE2-CD1 4.37Å; F1106-L1114 HydrophobicContact CE2-CD2 4.13Å; F1106-L1114 HydrophobicContact CE2-CG 3.61Å; F1106-L1114 HydrophobicContact CZ-CD2 3.65Å; F1106-L1114 HydrophobicContact CZ-CG 3.69Å; L1114-K1119 HydrophobicContact CB-CG 3.88Å; L1114-K1119 WeakPolarHBondContact O-CE 3.45Å
1115	G	70.6	Confident	75.3	Confident	10 Å²	10	64.2 Å²	64.2	10%	0.103	33%	0.331	C	S	.	.			trans	-56.9	147.5	168.9	0	0	0	0	0	111.7	E951 N1117 A1118	E951-G1115 WeakPolarHBondContact OE1-CA 3.4Å; G1115-N1117 PolarHBondContact O-N 3.28Å; G1115-N1117 VanDerWaalsContact O-N 3.12Å; G1115-A1118 PolarHBondContact O-N 3.05Å
1116	S	66.2	Low	75.1	Confident	99 Å²	99	63.5 Å²	63.5	69%	0.692	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-53.4	-35.7	-177.9	53.2	0	0	0	0	113	A1118	S1116-A1118 VanDerWaalsContact C-N 3.33Å; S1116-A1118 PolarHBondContact O-N 3.35Å
1117	N	65.5	Low	74.9	Confident	130 Å²	130	61.6 Å²	61.6	70%	0.695	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-73.4	-17.4	178.4	-72.7	-22.5	0	0	0	114.2	G1115 R1121	G1115-N1117 PolarHBondContact O-N 3.28Å; G1115-N1117 VanDerWaalsContact O-N 3.12Å; N1117-R1121 PolarHBondContact O-NH1 3.21Å; N1117-R1121 PolarHBondContact O-NH2 2.95Å
1118	A	65	Low	75.3	Confident	5 Å²	5	57.7 Å²	57.7	4%	0.041	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-100.3	-6.8	-176.2	0	0	0	0	0	113.8	V954 G1115 S1116	V954-A1118 WeakPolarHBondContact O-CB 3.47Å; G1115-A1118 PolarHBondContact O-N 3.05Å; S1116-A1118 VanDerWaalsContact C-N 3.33Å; S1116-A1118 PolarHBondContact O-N 3.35Å
1119	K	76.9	Confident	75.7	Confident	81 Å²	81	51.3 Å²	51.3	35%	0.352	27%	0.272	S	S	.	.	S	Bend	trans	-72.9	-44.1	-171.8	-73.3	-177.4	-176.4	-179.4	0	114.4	S1103 L1104 E1113 L1114	S1103-K1119 WeakPolarHBondContact CA-O 3.2Å; L1104-K1119 PolarHBondContact N-O 3.4Å; E1113-K1119 IonicContact OE1-NZ 3.84Å; E1113-K1119 PolarHBondContact OE1-NZ 3.43Å; L1114-K1119 HydrophobicContact CB-CG 3.88Å; L1114-K1119 WeakPolarHBondContact O-CE 3.45Å
1120	T	83.8	Confident	75.5	Confident	70 Å²	70	50.1 Å²	50.1	43%	0.429	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	149.2	-172.7	57	0	0	0	0	113.8	A1102	A1102-T1120 CarbonylContact O-C 3.45Å; A1102-T1120 WeakPolarHBondContact O-CA 3.42Å
1121	R	86.4	Confident	74.7	Confident	82 Å²	82	50 Å²	50	31%	0.309	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	130.6	174.9	-68.8	-72.9	178.5	-96.5	0.9	110.4	F956 V958 A1102 N1117	F956-R1121 HydrophobicContact CD1-CB 4.18Å; F956-R1121 HydrophobicContact CD1-CG 3.32Å; F956-R1121 HydrophobicContact CE1-CB 3.59Å; F956-R1121 HydrophobicContact CE1-CG 3.25Å; F956-R1121 HydrophobicContact CE2-CG 4.47Å; F956-R1121 HydrophobicContact CG-CG 3.98Å; F956-R1121 HydrophobicContact CZ-CB 3.99Å; F956-R1121 HydrophobicContact CZ-CG 3.87Å; F956-R1121 VanDerWaalsContact O-CZ 3.23Å; F956-R1121 PolarHBondContact O-NE 3.28Å; F956-R1121 PolarHBondContact O-NH2 3.4Å; V958-R1121 HydrophobicContact CG2-CB 3.48Å; V958-R1121 VanDerWaalsContact CG2-CB 3.48Å; V958-R1121 HydrophobicContact CG2-CG 3.71Å; A1102-R1121 PolarHBondContact N-O 3.5Å; A1102-R1121 PolarHBondContact O-N 3.4Å; N1117-R1121 PolarHBondContact O-NH1 3.21Å; N1117-R1121 PolarHBondContact O-NH2 2.95Å
1122	N	86.9	Confident	73.4	Confident	88 Å²	88	56.9 Å²	56.9	47%	0.471	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	136.4	-178.5	-62.5	-11.7	0	0	0	110.2	M1099 V1100 N1101	M1099-N1122 HydrophobicContact CE-CB 4.38Å; M1099-N1122 HydrophobicContact CG-CB 4.18Å; M1099-N1122 HydrophobicContact SD-CB 3.92Å; V1100-N1122 WeakPolarHBondContact O-CA 2.95Å; N1101-N1122 VanDerWaalsContact CG-OD1 3.25Å; N1101-N1122 PolarHBondContact OD1-OD1 3.14Å; N1101-N1122 VanDerWaalsContact OD1-OD1 3.07Å
1123	V	85.1	Confident	71.7	Confident	8 Å²	8	64.2 Å²	64.2	5%	0.048	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	127.6	173.9	-176.5	0	0	0	0	109	V958 I989 M1099 V1100	V958-V1123 HydrophobicContact CG1-CG2 3.47Å; V958-V1123 VanDerWaalsContact CG1-CG2 3.47Å; I989-V1123 HydrophobicContact CD1-CB 4.12Å; I989-V1123 HydrophobicContact CD1-CG1 3.85Å; I989-V1123 HydrophobicContact CD1-CG2 4.46Å; I989-V1123 HydrophobicContact CG1-CG1 4.39Å; I989-V1123 HydrophobicContact CG2-CG2 4.09Å; M1099-V1123 WeakPolarHBondContact CA-O 3.23Å; V1100-V1123 PolarHBondContact N-O 2.69Å; V1100-V1123 PolarHBondContact O-N 2.82Å
1124	T	83.2	Confident	70	Confident	55 Å²	55	63.6 Å²	63.6	34%	0.337	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.9	178.3	-52	0	0	0	0	110	L1054 K1097 M1098	L1054-T1124 HydrophobicContact CD1-CG2 4.11Å; K1097-T1124 HydrophobicContact CB-CG2 3.9Å; K1097-T1124 HydrophobicContact CD-CG2 4.43Å; K1097-T1124 HydrophobicContact CG-CG2 4.27Å; M1098-T1124 CarbonylContact O-C 3.32Å; M1098-T1124 WeakPolarHBondContact O-CA 3.26Å
1125	I	82.4	Confident	69	Low	0 Å²	0	68.9 Å²	68.9	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	121.9	174.5	-56.3	174.1	0	0	0	108.1	I965 V987 I989 L1021 K1097 M1098 V1100	I965-I1125 HydrophobicContact CD1-CG2 4.25Å; V987-I1125 HydrophobicContact CB-CD1 4.44Å; V987-I1125 HydrophobicContact CG1-CD1 3.99Å; V987-I1125 HydrophobicContact CG1-CG1 4.23Å; V987-I1125 HydrophobicContact CG2-CG2 4.21Å; I989-I1125 HydrophobicContact CD1-CD1 4.41Å; L1021-I1125 HydrophobicContact CD1-CD1 4.27Å; L1021-I1125 HydrophobicContact CD2-CD1 3.76Å; K1097-I1125 CarbonylContact C-O 3.57Å; K1097-I1125 WeakPolarHBondContact CA-O 3.42Å; M1098-I1125 HydrophobicContact CE-CB 4.44Å; M1098-I1125 HydrophobicContact CE-CG2 4.21Å; M1098-I1125 PolarHBondContact N-O 3.24Å; M1098-I1125 PolarHBondContact O-N 3.28Å; V1100-I1125 HydrophobicContact CG2-CD1 4.05Å
1126	L	79.8	Confident	68.4	Low	56 Å²	56	71.9 Å²	71.9	29%	0.293	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	130.7	176.6	-175.8	71.4	0	0	0	109.7	N963 Y964 I965 L1096 K1097	N963-L1126 PolarHBondContact O-N 3.24Å; Y964-L1126 CarbonylContact C-O 3.49Å; Y964-L1126 VanDerWaalsContact CA-O 3.22Å; Y964-L1126 WeakPolarHBondContact CA-O 3.47Å; I965-L1126 PolarHBondContact N-O 2.95Å; L1096-L1126 CarbonylContact O-C 3.55Å; L1096-L1126 WeakPolarHBondContact O-CA 3.38Å; K1097-L1126 HydrophobicContact CD-CD1 4.4Å; K1097-L1126 HydrophobicContact CG-CD1 3.56Å
1127	I	78.7	Confident	68	Low	0 Å²	0	73.5 Å²	73.5	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	122.3	169.3	-55.7	-174.3	0	0	0	107.7	I965 I967 A1083 F1088 F1093 S1095 L1096 M1098	I965-I1127 HydrophobicContact CB-CG1 4.21Å; I965-I1127 HydrophobicContact CD1-CG1 4.45Å; I965-I1127 WeakPolarHBondContact O-CA 3Å; I967-I1127 HydrophobicContact CD1-CG2 3.76Å; I967-I1127 HydrophobicContact CG1-CG2 4.29Å; A1083-I1127 HydrophobicContact CB-CD1 4.16Å; F1088-I1127 HydrophobicContact CD1-CD1 4.19Å; F1088-I1127 HydrophobicContact CD1-CG2 4.42Å; F1088-I1127 HydrophobicContact CD2-CD1 4.33Å; F1088-I1127 HydrophobicContact CE1-CD1 3.64Å; F1088-I1127 HydrophobicContact CE2-CD1 3.8Å; F1088-I1127 HydrophobicContact CZ-CD1 3.41Å; F1088-I1127 VanDerWaalsContact CZ-CD1 3.41Å; F1093-I1127 HydrophobicContact CE2-CG2 3.93Å; F1093-I1127 HydrophobicContact CZ-CG2 4.05Å; S1095-I1127 CarbonylContact C-O 3.45Å; S1095-I1127 VanDerWaalsContact CA-O 3.3Å; S1095-I1127 WeakPolarHBondContact CA-O 3.11Å; L1096-I1127 HydrophobicContact CB-CB 4.4Å; L1096-I1127 PolarHBondContact N-O 3.17Å; L1096-I1127 PolarHBondContact O-N 3.47Å; M1098-I1127 HydrophobicContact CE-CD1 3.31Å; M1098-I1127 HydrophobicContact CE-CG1 3.94Å; M1098-I1127 HydrophobicContact SD-CD1 4.18Å
1128	S	75.3	Confident	68.2	Low	32 Å²	32	75.6 Å²	75.6	22%	0.224	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	146.2	176.3	56.2	0	0	0	0	111.3	I965 I967	I965-S1128 PolarHBondContact O-N 3.07Å; I967-S1128 PolarHBondContact N-O 3.23Å
1129	K	71.2	Confident	68.5	Low	45 Å²	45	78.6 Å²	78.6	20%	0.196	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	116.4	172.9	-162.6	172.8	-176.5	-165.5	0	108.3	D969 F1093 S1094 T1131	D969-K1129 WeakPolarHBondContact OD1-CE 3.36Å; D969-K1129 IonicContact OD1-NZ 2.98Å; D969-K1129 PolarHBondContact OD1-NZ 2.56Å; D969-K1129 WeakPolarHBondContact OD2-CE 3.09Å; D969-K1129 IonicContact OD2-NZ 3.35Å; D969-K1129 PolarHBondContact OD2-NZ 2.79Å; F1093-K1129 HydrophobicContact CE2-CB 4.29Å; S1094-K1129 PolarHBondContact O-N 3.28Å; S1094-K1129 VanDerWaalsContact O-N 3.09Å; K1129-T1131 PolarHBondContact O-N 2.72Å
1130	G	57.2	Low	68.1	Low	32 Å²	32	79.3 Å²	79.3	33%	0.33	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	110	-170.6	0	0	0	0	0	112.3	I967	I967-G1130 PolarHBondContact O-N 2.98Å
1131	T	50.2	Low	67.6	Low	118 Å²	118	80.9 Å²	80.9	72%	0.724	43%	0.434	S	S	*	.			trans	-93.5	118	162	49.9	0	0	0	0	108.8	K1129 E1133	K1129-T1131 PolarHBondContact O-N 2.72Å; T1131-E1133 PolarHBondContact O-N 3.47Å
1132	I	44.9	Very low	67.3	Low	173 Å²	173	82 Å²	82	89%	0.887	45%	0.445	S	S	*	.			trans	-69.4	92.7	173.5	-57.8	170.7	0	0	0	108.2
1133	E	40.8	Very low	66.8	Low	178 Å²	178	83.2 Å²	83.2	83%	0.832	45%	0.451	S	S	*	.			trans	-102	89.7	160.5	-75.5	-166	166.9	0	0	108.6	T1131 I1135	T1131-E1133 PolarHBondContact O-N 3.47Å; E1133-I1135 PolarHBondContact O-N 2.95Å
1134	G	42.8	Very low	66.6	Low	62 Å²	62	86.6 Å²	86.6	64%	0.639	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-65.1	128.9	168.2	0	0	0	0	0	110.2	P1136	G1134-P1136 WeakPolarHBondContact O-CD 3.29Å
1135	I	56.1	Low	66.5	Low	123 Å²	123	87.8 Å²	87.8	63%	0.631	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-60.5	121.4	174.7	-59.4	170.4	0	0	0	108	E1133 L1137 I1139	E1133-I1135 PolarHBondContact O-N 2.95Å; I1135-L1137 PolarHBondContact O-N 3.42Å; I1135-I1139 HydrophobicContact CG2-CB 4.24Å; I1135-I1139 HydrophobicContact CG2-CD1 4.28Å; I1135-I1139 HydrophobicContact CG2-CG2 4.45Å
1136	P	58.8	Low	66.6	Low	72 Å²	72	93.1 Å²	93.1	47%	0.468	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-67.3	133	-174.4	25.8	-33.8	0	0	0	111	G1134 W1138 I1139	G1134-P1136 WeakPolarHBondContact O-CD 3.29Å; P1136-W1138 VanDerWaalsContact CG-NE1 3.33Å; P1136-W1138 PolarHBondContact O-N 3.38Å; P1136-I1139 HydrophobicContact CG-CD1 4.08Å; P1136-I1139 PolarHBondContact O-N 3.22Å
1137	L	56.6	Low	66.7	Low	134 Å²	134	93 Å²	93	70%	0.702	52%	0.518	S	S	*	.	H	α-helix	trans	-50	-27.4	-170.2	-108.9	117.2	0	0	0	115.5	I1135 I1139 I1140 I1141	I1135-L1137 PolarHBondContact O-N 3.42Å; L1137-I1139 VanDerWaalsContact C-N 3.28Å; L1137-I1139 PolarHBondContact O-N 3.42Å; L1137-I1140 PolarHBondContact O-N 3.43Å; L1137-I1141 WeakPolarHBondContact O-CG1 3.46Å; L1137-I1141 PolarHBondContact O-N 3.42Å
1138	W	69.5	Low	67	Low	174 Å²	174	94.9 Å²	94.9	66%	0.659	54%	0.537	S	S	*	.	H	α-helix	trans	-60.6	-33	177.3	74.1	-53.1	0	0	0	113.6	P1136 I1141 L1142	P1136-W1138 VanDerWaalsContact CG-NE1 3.33Å; P1136-W1138 PolarHBondContact O-N 3.38Å; W1138-I1141 PolarHBondContact O-N 2.9Å; W1138-L1142 WeakPolarHBondContact O-CB 3.41Å; W1138-L1142 PolarHBondContact O-N 2.96Å
1139	I	72.3	Confident	67.5	Low	67 Å²	67	98.8 Å²	98.8	34%	0.344	56%	0.555	S	S	.	*	H	α-helix	trans	-68.3	-38.3	179.8	-63.9	177.1	0	0	0	110.7	I1135 P1136 L1137 L1142 L1143	I1135-I1139 HydrophobicContact CG2-CB 4.24Å; I1135-I1139 HydrophobicContact CG2-CD1 4.28Å; I1135-I1139 HydrophobicContact CG2-CG2 4.45Å; P1136-I1139 HydrophobicContact CG-CD1 4.08Å; P1136-I1139 PolarHBondContact O-N 3.22Å; L1137-I1139 VanDerWaalsContact C-N 3.28Å; L1137-I1139 PolarHBondContact O-N 3.42Å; I1139-L1142 PolarHBondContact O-N 2.91Å; I1139-L1143 HydrophobicContact CG2-CD1 3.98Å; I1139-L1143 WeakPolarHBondContact O-CB 3.5Å; I1139-L1143 WeakPolarHBondContact O-CG 3.47Å; I1139-L1143 PolarHBondContact O-N 2.98Å
1140	I	68.7	Low	68.2	Low	96 Å²	96	102.1 Å²	102.1	49%	0.492	57%	0.574	S	S	.	*	H	α-helix	trans	-69.1	-41.1	179	-61.2	174.8	0	0	0	110.7	L1137 S1144	L1137-I1140 PolarHBondContact O-N 3.43Å; I1140-S1144 WeakPolarHBondContact O-CB 3.4Å; I1140-S1144 PolarHBondContact O-N 3.37Å; I1140-S1144 PolarHBondContact O-OG 2.97Å
1141	I	73.9	Confident	69.7	Low	103 Å²	103	105.6 Å²	105.6	53%	0.528	58%	0.584	S	S	.	*	H	α-helix	trans	-64.7	-41.9	176.8	-64.9	169.8	0	0	0	110.6	L1137 W1138 S1144 T1145	L1137-I1141 WeakPolarHBondContact O-CG1 3.46Å; L1137-I1141 PolarHBondContact O-N 3.42Å; W1138-I1141 PolarHBondContact O-N 2.9Å; I1141-S1144 PolarHBondContact O-N 3.23Å; I1141-T1145 WeakPolarHBondContact O-CG2 3.39Å; I1141-T1145 PolarHBondContact O-N 3.38Å; I1141-T1145 PolarHBondContact O-OG1 3.22Å
1142	L	78.7	Confident	71.4	Confident	105 Å²	105	104.5 Å²	104.5	55%	0.55	57%	0.573	S	S	.	*	H	α-helix	trans	-69.6	-39.5	-177.9	-153.2	130.3	0	0	0	111.8	W1138 I1139 T1145 L1146	W1138-L1142 WeakPolarHBondContact O-CB 3.41Å; W1138-L1142 PolarHBondContact O-N 2.96Å; I1139-L1142 PolarHBondContact O-N 2.91Å; L1142-T1145 WeakPolarHBondContact CA-OG1 3.34Å; L1142-T1145 PolarHBondContact O-OG1 3.31Å; L1142-L1146 WeakPolarHBondContact O-CB 3.4Å; L1142-L1146 PolarHBondContact O-N 3.02Å; L1142-L1146 VanDerWaalsContact O-N 3.16Å
1143	L	77.9	Confident	73.3	Confident	114 Å²	114	99 Å²	99	60%	0.597	55%	0.553	S	S	*	*	H	α-helix	trans	-69	-37.9	175.2	-76	167	0	0	0	112.8	I1139 A1147	I1139-L1143 HydrophobicContact CG2-CD1 3.98Å; I1139-L1143 WeakPolarHBondContact O-CB 3.5Å; I1139-L1143 WeakPolarHBondContact O-CG 3.47Å; I1139-L1143 PolarHBondContact O-N 2.98Å; L1143-A1147 WeakPolarHBondContact O-CB 3.43Å; L1143-A1147 PolarHBondContact O-N 2.97Å
1144	S	79.3	Confident	75.4	Confident	80 Å²	80	95.3 Å²	95.3	56%	0.559	54%	0.539	S	S	*	.	H	α-helix	trans	-68.8	-38.6	178.1	-71.6	0	0	0	0	112.9	I1140 I1141 G1148	I1140-S1144 WeakPolarHBondContact O-CB 3.4Å; I1140-S1144 PolarHBondContact O-N 3.37Å; I1140-S1144 PolarHBondContact O-OG 2.97Å; I1141-S1144 PolarHBondContact O-N 3.23Å; S1144-G1148 PolarHBondContact O-N 3.41Å
1145	T	81.4	Confident	77.5	Confident	79 Å²	79	95.8 Å²	95.8	49%	0.485	53%	0.526	S	S	.	.	H	α-helix	trans	-68.4	-39.8	176.9	47.7	0	0	0	0	111.9	I1141 L1142 G1148 L1149	I1141-T1145 WeakPolarHBondContact O-CG2 3.39Å; I1141-T1145 PolarHBondContact O-N 3.38Å; I1141-T1145 PolarHBondContact O-OG1 3.22Å; L1142-T1145 WeakPolarHBondContact CA-OG1 3.34Å; L1142-T1145 PolarHBondContact O-OG1 3.31Å; T1145-G1148 PolarHBondContact O-N 3.28Å; T1145-L1149 PolarHBondContact O-N 3.45Å; T1145-L1149 VanDerWaalsContact O-N 3.07Å
1146	L	84.1	Confident	78.7	Confident	113 Å²	113	94.4 Å²	94.4	59%	0.592	52%	0.519	S	S	*	.	H	α-helix	trans	-64.3	-43.4	175.6	-143.2	93.9	0	0	0	111.9	L1142 L1149 L1150	L1142-L1146 WeakPolarHBondContact O-CB 3.4Å; L1142-L1146 PolarHBondContact O-N 3.02Å; L1142-L1146 VanDerWaalsContact O-N 3.16Å; L1146-L1149 PolarHBondContact O-N 2.99Å; L1146-L1150 PolarHBondContact O-N 3.19Å
1147	A	82.1	Confident	79.9	Confident	53 Å²	53	96 Å²	96	44%	0.438	52%	0.524	S	S	.	.	H	α-helix	trans	-64.5	-41.3	176.6	0	0	0	0	0	112.1	L1143 L1150 I1151	L1143-A1147 WeakPolarHBondContact O-CB 3.43Å; L1143-A1147 PolarHBondContact O-N 2.97Å; A1147-L1150 PolarHBondContact O-N 3.4Å; A1147-I1151 WeakPolarHBondContact O-CG1 3.36Å; A1147-I1151 PolarHBondContact O-N 3.36Å; A1147-I1151 VanDerWaalsContact O-N 3.09Å
1148	G	84.7	Confident	81.2	Confident	39 Å²	39	93.5 Å²	93.5	40%	0.402	51%	0.51	S	S	.	.	H	α-helix	trans	-62.2	-43.1	177.1	0	0	0	0	0	113.3	S1144 T1145 L1150 I1151 L1152	S1144-G1148 PolarHBondContact O-N 3.41Å; T1145-G1148 PolarHBondContact O-N 3.28Å; G1148-L1150 VanDerWaalsContact C-N 3.33Å; G1148-L1150 PolarHBondContact O-N 3.15Å; G1148-I1151 PolarHBondContact O-N 3.02Å; G1148-L1152 PolarHBondContact O-N 3.09Å
1149	L	87.5	Confident	81.7	Confident	114 Å²	114	89.5 Å²	89.5	60%	0.597	50%	0.497	S	S	*	.	H	α-helix	trans	-64	-37.7	176.1	-84.5	166.5	0	0	0	112.4	T1145 L1146 L1152 A1153	T1145-L1149 PolarHBondContact O-N 3.45Å; T1145-L1149 VanDerWaalsContact O-N 3.07Å; L1146-L1149 PolarHBondContact O-N 2.99Å; L1149-L1152 PolarHBondContact O-N 3.46Å; L1149-A1153 PolarHBondContact O-N 3.31Å
1150	L	85.8	Confident	81.9	Confident	116 Å²	116	94.9 Å²	94.9	61%	0.607	51%	0.513	S	S	*	.	H	α-helix	trans	-67.8	-39.2	179.7	-157.9	141.6	0	0	0	111.6	L1146 A1147 G1148 L1154	L1146-L1150 PolarHBondContact O-N 3.19Å; A1147-L1150 PolarHBondContact O-N 3.4Å; G1148-L1150 VanDerWaalsContact C-N 3.33Å; G1148-L1150 PolarHBondContact O-N 3.15Å; L1150-L1154 WeakPolarHBondContact O-CB 3.46Å; L1150-L1154 PolarHBondContact O-N 2.96Å; L1150-L1154 VanDerWaalsContact O-N 3.15Å
1151	I	86.9	Confident	82.4	Confident	104 Å²	104	98.9 Å²	98.9	53%	0.533	53%	0.527	S	S	.	.	H	α-helix	trans	-65.2	-44.2	173.2	-67.9	169.2	0	0	0	111	A1147 G1148 A1153 L1154 I1155	A1147-I1151 WeakPolarHBondContact O-CG1 3.36Å; A1147-I1151 PolarHBondContact O-N 3.36Å; A1147-I1151 VanDerWaalsContact O-N 3.09Å; G1148-I1151 PolarHBondContact O-N 3.02Å; I1151-A1153 PolarHBondContact O-N 3.18Å; I1151-L1154 PolarHBondContact O-N 3.4Å; I1151-I1155 HydrophobicContact CG2-CD1 3.87Å; I1151-I1155 HydrophobicContact CG2-CG1 4.46Å; I1151-I1155 WeakPolarHBondContact O-CG1 3.41Å; I1151-I1155 PolarHBondContact O-N 3.05Å
1152	L	87	Confident	82.6	Confident	95 Å²	95	99.9 Å²	99.9	50%	0.497	53%	0.533	S	S	.	.	H	α-helix	trans	-60.5	-45	178.5	-174.8	72.1	0	0	0	111.7	G1148 L1149 L1154 I1155 I1156	G1148-L1152 PolarHBondContact O-N 3.09Å; L1149-L1152 PolarHBondContact O-N 3.46Å; L1152-L1154 VanDerWaalsContact C-N 3.28Å; L1152-L1154 PolarHBondContact O-N 3.49Å; L1152-I1155 PolarHBondContact O-N 3.03Å; L1152-I1156 HydrophobicContact CG-CD1 4.2Å; L1152-I1156 WeakPolarHBondContact O-CG1 3.39Å; L1152-I1156 PolarHBondContact O-N 3.03Å
1153	A	84.8	Confident	82	Confident	57 Å²	57	96.6 Å²	96.6	47%	0.471	53%	0.525	S	S	.	.	H	α-helix	trans	-60.1	-40.3	176.6	0	0	0	0	0	111.8	L1149 I1151 I1156 L1157	L1149-A1153 PolarHBondContact O-N 3.31Å; I1151-A1153 PolarHBondContact O-N 3.18Å; A1153-I1156 PolarHBondContact O-N 2.88Å; A1153-L1157 WeakPolarHBondContact O-CB 3.5Å; A1153-L1157 PolarHBondContact O-N 3.16Å
1154	L	85.7	Confident	81.5	Confident	102 Å²	102	98.8 Å²	98.8	53%	0.534	53%	0.53	S	S	.	.	H	α-helix	trans	-67.3	-38.7	179.2	-154.1	140.4	0	0	0	111.7	L1150 I1151 L1152 L1157 I1158	L1150-L1154 WeakPolarHBondContact O-CB 3.46Å; L1150-L1154 PolarHBondContact O-N 2.96Å; L1150-L1154 VanDerWaalsContact O-N 3.15Å; I1151-L1154 PolarHBondContact O-N 3.4Å; L1152-L1154 VanDerWaalsContact C-N 3.28Å; L1152-L1154 PolarHBondContact O-N 3.49Å; L1154-L1157 PolarHBondContact O-N 3.07Å; L1154-I1158 HydrophobicContact CD2-CD1 3.72Å; L1154-I1158 HydrophobicContact CD2-CG1 4.45Å; L1154-I1158 VanDerWaalsContact O-CG1 3.29Å; L1154-I1158 WeakPolarHBondContact O-CG1 3.36Å; L1154-I1158 PolarHBondContact O-N 3.4Å
1155	I	85	Confident	80.9	Confident	71 Å²	71	101.8 Å²	101.8	36%	0.364	53%	0.533	S	S	.	.	H	α-helix	trans	-64.6	-44	173.7	-69.1	169.6	0	0	0	111.6	I1151 L1152 L1157 I1158 F1159	I1151-I1155 HydrophobicContact CG2-CD1 3.87Å; I1151-I1155 HydrophobicContact CG2-CG1 4.46Å; I1151-I1155 WeakPolarHBondContact O-CG1 3.41Å; I1151-I1155 PolarHBondContact O-N 3.05Å; L1152-I1155 PolarHBondContact O-N 3.03Å; I1155-L1157 VanDerWaalsContact C-N 3.29Å; I1155-L1157 PolarHBondContact O-N 3.17Å; I1155-I1158 PolarHBondContact O-N 3.44Å; I1155-F1159 HydrophobicContact CG2-CD2 3.58Å; I1155-F1159 HydrophobicContact CG2-CE2 3.32Å; I1155-F1159 HydrophobicContact CG2-CZ 4.33Å; I1155-F1159 WeakPolarHBondContact O-CD2 3.38Å; I1155-F1159 PolarHBondContact O-N 3Å
1156	I	83.1	Confident	79.7	Confident	94 Å²	94	107 Å²	107	48%	0.482	55%	0.549	S	S	.	.	H	α-helix	trans	-60.6	-42.3	176.6	-68.6	168.4	0	0	0	110.4	L1152 A1153 F1159 W1160	L1152-I1156 HydrophobicContact CG-CD1 4.2Å; L1152-I1156 WeakPolarHBondContact O-CG1 3.39Å; L1152-I1156 PolarHBondContact O-N 3.03Å; A1153-I1156 PolarHBondContact O-N 2.88Å; I1156-F1159 PolarHBondContact O-N 3.45Å; I1156-W1160 WeakPolarHBondContact O-CB 3.45Å; I1156-W1160 PolarHBondContact O-N 3.22Å
1157	L	83.4	Confident	78.2	Confident	107 Å²	107	113.4 Å²	113.4	56%	0.56	57%	0.565	S	S	*	*	H	α-helix	trans	-64.6	-40.1	178	-141.4	161.5	0	0	0	111.3	A1153 L1154 I1155 W1160 K1161	A1153-L1157 WeakPolarHBondContact O-CB 3.5Å; A1153-L1157 PolarHBondContact O-N 3.16Å; L1154-L1157 PolarHBondContact O-N 3.07Å; I1155-L1157 VanDerWaalsContact C-N 3.29Å; I1155-L1157 PolarHBondContact O-N 3.17Å; L1157-W1160 PolarHBondContact O-N 3.29Å; L1157-K1161 WeakPolarHBondContact O-CB 3.47Å; L1157-K1161 PolarHBondContact O-N 3.34Å
1158	I	82.5	Confident	76.3	Confident	81 Å²	81	120.5 Å²	120.5	42%	0.415	59%	0.586	S	S	.	*	H	α-helix	trans	-61.3	-48.6	172.9	-71.8	168.4	0	0	0	110.9	L1154 I1155 W1160 K1161 L1162	L1154-I1158 HydrophobicContact CD2-CD1 3.72Å; L1154-I1158 HydrophobicContact CD2-CG1 4.45Å; L1154-I1158 VanDerWaalsContact O-CG1 3.29Å; L1154-I1158 WeakPolarHBondContact O-CG1 3.36Å; L1154-I1158 PolarHBondContact O-N 3.4Å; I1155-I1158 PolarHBondContact O-N 3.44Å; I1158-W1160 VanDerWaalsContact C-N 3.33Å; I1158-W1160 PolarHBondContact O-N 3.05Å; I1158-K1161 PolarHBondContact O-N 2.97Å; I1158-L1162 HydrophobicContact CG2-CD1 3.6Å; I1158-L1162 HydrophobicContact CG2-CG 4.31Å; I1158-L1162 WeakPolarHBondContact O-CB 3.42Å; I1158-L1162 WeakPolarHBondContact O-CG 3.37Å; I1158-L1162 PolarHBondContact O-N 3.46Å
1159	F	80.9	Confident	74.4	Confident	89 Å²	89	125.6 Å²	125.6	39%	0.39	61%	0.61	S	S	.	*	H	α-helix	trans	-65.2	-34.5	178.9	-75.9	-50.5	0	0	0	113.2	I1155 I1156 G1163 F1164 F1165	I1155-F1159 HydrophobicContact CG2-CD2 3.58Å; I1155-F1159 HydrophobicContact CG2-CE2 3.32Å; I1155-F1159 HydrophobicContact CG2-CZ 4.33Å; I1155-F1159 WeakPolarHBondContact O-CD2 3.38Å; I1155-F1159 PolarHBondContact O-N 3Å; I1156-F1159 PolarHBondContact O-N 3.45Å; F1159-G1163 PolarHBondContact O-N 2.93Å; F1159-F1164 HydrophobicContact CB-CB 4.45Å; F1159-F1164 HydrophobicContact CD1-CG 4.47Å; F1159-F1164 WeakPolarHBondContact O-CB 3.5Å; F1159-F1164 PolarHBondContact O-N 3.44Å; F1159-F1165 HydrophobicContact CB-CE2 3.74Å; F1159-F1165 HydrophobicContact CB-CZ 4.49Å
1160	W	77.6	Confident	72	Confident	181 Å²	181	129 Å²	129	69%	0.686	63%	0.625	S	S	*	*	H	α-helix	trans	-65.4	-43.9	172.7	-176.4	66.9	0	0	0	112	I1156 L1157 I1158 G1163 F1165	I1156-W1160 WeakPolarHBondContact O-CB 3.45Å; I1156-W1160 PolarHBondContact O-N 3.22Å; L1157-W1160 PolarHBondContact O-N 3.29Å; I1158-W1160 VanDerWaalsContact C-N 3.33Å; I1158-W1160 PolarHBondContact O-N 3.05Å; W1160-G1163 PolarHBondContact O-N 3.2Å; W1160-F1165 HydrophobicContact CB-CD2 4.46Å
1161	K	78.3	Confident	69.8	Low	179 Å²	179	130.5 Å²	130.5	78%	0.778	63%	0.634	S	S	*	*	H	α-helix	trans	-70.5	-30.6	179.4	-141.7	-171.2	-174.4	-172.8	0	113.2	L1157 I1158 G1163	L1157-K1161 WeakPolarHBondContact O-CB 3.47Å; L1157-K1161 PolarHBondContact O-N 3.34Å; I1158-K1161 PolarHBondContact O-N 2.97Å; K1161-G1163 PolarHBondContact O-N 3.37Å
1162	L	77.4	Confident	67.4	Low	124 Å²	124	136.1 Å²	136.1	65%	0.649	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	4.6	174.5	-69.5	172.9	0	0	0	113.6	I1158 F1164	I1158-L1162 HydrophobicContact CG2-CD1 3.6Å; I1158-L1162 HydrophobicContact CG2-CG 4.31Å; I1158-L1162 WeakPolarHBondContact O-CB 3.42Å; I1158-L1162 WeakPolarHBondContact O-CG 3.37Å; I1158-L1162 PolarHBondContact O-N 3.46Å; L1162-F1164 VanDerWaalsContact C-N 3.35Å; L1162-F1164 PolarHBondContact O-N 3.03Å
1163	G	66.8	Low	65	Low	37 Å²	37	136.2 Å²	136.2	38%	0.381	66%	0.658	S	S	.	*	T	Hydrogen-bonded Turn	trans	78	13.7	170.2	0	0	0	0	0	115.3	F1159 W1160 K1161 F1165 K1166	F1159-G1163 PolarHBondContact O-N 2.93Å; W1160-G1163 PolarHBondContact O-N 3.2Å; K1161-G1163 PolarHBondContact O-N 3.37Å; G1163-F1165 PolarHBondContact O-N 3.23Å; G1163-K1166 PolarHBondContact O-N 2.89Å
1164	F	67.1	Low	62.7	Low	160 Å²	160	141.6 Å²	141.6	70%	0.702	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-19	-177	-121.5	-97.2	0	0	0	114	F1159 L1162	F1159-F1164 HydrophobicContact CB-CB 4.45Å; F1159-F1164 HydrophobicContact CD1-CG 4.47Å; F1159-F1164 WeakPolarHBondContact O-CB 3.5Å; F1159-F1164 PolarHBondContact O-N 3.44Å; L1162-F1164 VanDerWaalsContact C-N 3.35Å; L1162-F1164 PolarHBondContact O-N 3.03Å
1165	F	66.9	Low	60.4	Low	143 Å²	143	143 Å²	143	63%	0.627	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	13.2	-178.9	-62.8	-74.1	0	0	0	114.6	F1159 W1160 G1163	F1159-F1165 HydrophobicContact CB-CE2 3.74Å; F1159-F1165 HydrophobicContact CB-CZ 4.49Å; W1160-F1165 HydrophobicContact CB-CD2 4.46Å; G1163-F1165 PolarHBondContact O-N 3.23Å
1166	K	56.7	Low	58.4	Low	188 Å²	188	148 Å²	148	82%	0.817	70%	0.696	S	S	*	*			trans	-98.9	90	174.4	-73.4	-173.3	178.1	-179.3	0	111	G1163	G1163-K1166 PolarHBondContact O-N 2.89Å
1167	R	52.9	Low	56.1	Low	247 Å²	247	151.5 Å²	151.5	93%	0.932	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-96.5	126.1	166.9	-158.3	174.5	-174.1	-177.3	1	110.2
1168	K	42.3	Very low	54.1	Low	202 Å²	202	150.5 Å²	150.5	88%	0.878	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-61	129.4	179	-77.7	174.7	171	178	0	111.8
1169	T	43.4	Very low	52	Low	147 Å²	147	158.1 Å²	158.1	90%	0.902	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-71.3	134.8	155.9	35.6	0	0	0	0	109.3
1170	M	37	Very low	50.5	Low	185 Å²	185	161.6 Å²	161.6	91%	0.911	78%	0.775	S	S	*	*			trans	-127.7	113.6	170.5	-127.3	-178	82	0	0	107
1171	D	40	Very low	49.1	Very low	148 Å²	148	160.6 Å²	160.6	79%	0.791	78%	0.78	S	S	*	*			trans	-75.3	139.1	163.7	-95.9	-37.8	0	0	0	109.5
1172	Y	37.4	Very low	47.5	Very low	221 Å²	221	159.6 Å²	159.6	87%	0.867	78%	0.78	S	S	*	*				-176.7	143.8	117.5	-108.7	-80.2	0	0	0	111.6
1173	S	36.2	Very low	45.7	Very low	98 Å²	98	161.6 Å²	161.6	69%	0.685	79%	0.787	S	S	*	*			trans	-78.2	155.6	179.9	42.4	0	0	0	0	115.6
1174	K	36	Very low	44.4	Very low	170 Å²	170	169.4 Å²	169.4	74%	0.739	81%	0.813	S	S	*	*			trans	169.9	138.7	143.7	-97	-177.6	171.6	-111.3	0	106.5
1175	E	38.1	Very low	42.9	Very low	132 Å²	132	170.1 Å²	170.1	62%	0.617	82%	0.82	S	S	*	*			cis	-172.4	131.7	8.3	-114.4	157.8	-173.7	0	0	102.4
1176	E	41.5	Very low	41.2	Very low	174 Å²	174	172 Å²	172	81%	0.813	83%	0.834	S	S	*	*				129.1	168.2	77.8	-113.9	-174.4	179.1	0	0	110.7
1177	M	36.4	Very low	40	Very low	168 Å²	168	170.8 Å²	170.8	83%	0.828	84%	0.835	S	S	*	*			trans	87.9	101.4	175.2	-69.3	-179	68.9	0	0	117.2
1178	S	41.1	Very low	38.9	Very low	86 Å²	86	164.4 Å²	164.4	60%	0.601	83%	0.827	S	S	*	*				77.8	92	75.2	78.1	0	0	0	0	113.4
1179	D	37.1	Very low	38.6	Very low	242 Å²	242	161 Å²	161	100%	1.294	82%	0.823	S	S	*	*				169.2	0	125.7	-88.9	-15	0	0	0	110.5

Retrieved 1,179 of 1,179 residues in 285.2 ms (Link to these results)

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