A0A077Z0L5_TRITR Loading...

Apple domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z0L5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,094 aa.

						>A0A077Z0L5_TRITR|A0A077Z0L5
MLRAVTILLLSVLSLCPAGILAAKECKGLFHFDLSDKVDNRETFSHRRATSLEECVRICYSKSDFCFSALFIPSPTGSHQCLLSYQAAYMCSKRQLSTVHKLSSKPVIVECIRCTALGDKVLSVSPPEGEAFLQDGLINVTGGMFTQKIETITPDMKLETEPPFQTRPYTKVAIQDGTKTAEQQLESMATSEEHVTTGDVVMFNYGSSTAHLTSPSVDSIQNIEYTEVTTKIVPILEQNEVASTPTAETTSERWRSTIEKLLVTFPTQTDDIRSTDQISTEGQRLATELTPEAATVQEMSSTSFEFPKTTVVSEISTLSSMTTTKPHEGDVSIRQQNPPTDGQPLVTVLTTDVTPTGRQTTEATSKLTTPFSTETTESDQAKKLENILMNEMEFAISGPSETDKVEESTVTFEEQEQKPKVFVTEGAEKVEPLPSTSSDYDYGTTSTIRTGTTHILSVKFEELNYTGGGMINEISGFRQEGTVPLIDFFLPEQEIINETSKGTSMTFAESIERSLAFELDKGQSTSSSGFVETSDNPIEVSEQEVVDSTAAQTSVNPESAKDIDAQKSVTALVGQEESVANAEMSPSKMCPENISFLTNPASSQSGIVYGFEIAANSTEHCAQLCYGKQCSSGVFIKPVISGQLGSCLMAFGEEVCDQTKQRVTSYSGPFPVEISCIRCGIPKKQSIDVKANVATSRIICRRPDAKSDVENLHTATKPLQEISNATIAHRTCLLNVSFEIVEPSFHSKSDFVSHRFATSVAECAKLCYESGCTVAGFTRANVDGEPSFCLLSFKKDTCSGTTRYTHAEPTKEPIQIQCIRCDVTGFEKIQLPSNEEASEFPSTLQPPKNEVSETPGKNEEKKQGCTDTICRQVDAATVSSEKISTVAQIMVPSGKRNCTKRITFQAFQPAENYNVAFTSDHRSSSAADCAKQCYNEGNCQVSAFIAPPKGLSAGVCLLSEEPGFCKTNSEKLVEHSSISPFVISCIACSSKFALLECSFNIRNYIPSVPTAKPATWDSYFDDFEMQVDAKNALECAEKCYSKKCSLAAYSPLTPNGNCLMTIKATRKCDGSDNSDPNVDTSGTLPLLIDCVECA
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	57.3	Low	66.7	Low	200 Å²	200	117 Å²	117	99%	0.985	62%	0.615	S	S	*	*				0	-110.7	0	-58.5	-42	-173.6	0	0	111.5	R3 A4 V5	M1-R3 PolarHBondContact O-N 3Å; M1-R3 VanDerWaalsContact O-N 3.16Å; M1-A4 WeakPolarHBondContact O-CA 3.23Å; M1-A4 WeakPolarHBondContact O-CB 3.48Å; M1-A4 PolarHBondContact O-N 3Å; M1-V5 PolarHBondContact O-N 3.04Å
2	L	65.3	Low	66	Low	146 Å²	146	115 Å²	115	76%	0.764	61%	0.611	S	S	*	*	H	α-helix	trans	-49.1	-52.8	-157.4	-153.2	73.1	0	0	0	115.8	A4 V5 T6	L2-A4 VanDerWaalsContact C-N 3.32Å; L2-A4 PolarHBondContact O-N 3.3Å; L2-V5 PolarHBondContact O-N 3.1Å; L2-V5 VanDerWaalsContact O-N 3.13Å; L2-T6 PolarHBondContact O-N 2.59Å; L2-T6 PolarHBondContact O-OG1 3.49Å; L2-T6 VanDerWaalsContact O-OG1 3.05Å
3	R	66.2	Low	65.1	Low	219 Å²	219	115.9 Å²	115.9	83%	0.826	62%	0.615	S	S	*	*	H	α-helix	trans	-59.2	-36.6	177.3	-77.7	-175.2	174.3	174.7	-2.2	114.2	M1 T6 I7	M1-R3 PolarHBondContact O-N 3Å; M1-R3 VanDerWaalsContact O-N 3.16Å; R3-T6 PolarHBondContact O-N 3.04Å; R3-I7 VanDerWaalsContact O-CG1 3.31Å; R3-I7 WeakPolarHBondContact O-CG1 3.49Å; R3-I7 PolarHBondContact O-N 2.97Å
4	A	71.4	Confident	64.1	Low	62 Å²	62	114.9 Å²	114.9	51%	0.512	62%	0.621	S	S	.	*	H	α-helix	trans	-68.7	-38.4	177	0	0	0	0	0	111.3	M1 L2 I7 L8	M1-A4 WeakPolarHBondContact O-CA 3.23Å; M1-A4 WeakPolarHBondContact O-CB 3.48Å; M1-A4 PolarHBondContact O-N 3Å; L2-A4 VanDerWaalsContact C-N 3.32Å; L2-A4 PolarHBondContact O-N 3.3Å; A4-I7 PolarHBondContact O-N 3.17Å; A4-L8 WeakPolarHBondContact O-CB 3.5Å; A4-L8 PolarHBondContact O-N 3.29Å
5	V	79.5	Confident	62.6	Low	79 Å²	79	116.3 Å²	116.3	48%	0.479	63%	0.627	S	S	.	*	H	α-helix	trans	-65.7	-38.5	173.9	176.8	0	0	0	0	111.1	M1 L2 L8 L9	M1-V5 PolarHBondContact O-N 3.04Å; L2-V5 PolarHBondContact O-N 3.1Å; L2-V5 VanDerWaalsContact O-N 3.13Å; V5-L8 PolarHBondContact O-N 2.86Å; V5-L9 HydrophobicContact CG1-CD1 4.06Å; V5-L9 WeakPolarHBondContact O-CB 3.34Å; V5-L9 PolarHBondContact O-N 3.21Å
6	T	73.7	Confident	61	Low	75 Å²	75	115.1 Å²	115.1	46%	0.46	63%	0.629	S	S	.	*	H	α-helix	trans	-64	-42.5	173.6	-45.4	0	0	0	0	112.2	L2 R3 L9 L10	L2-T6 PolarHBondContact O-N 2.59Å; L2-T6 PolarHBondContact O-OG1 3.49Å; L2-T6 VanDerWaalsContact O-OG1 3.05Å; R3-T6 PolarHBondContact O-N 3.04Å; T6-L9 PolarHBondContact O-N 3.5Å; T6-L10 HydrophobicContact CG2-CD1 4.14Å; T6-L10 WeakPolarHBondContact O-CB 3.33Å; T6-L10 VanDerWaalsContact O-CG 3.32Å; T6-L10 WeakPolarHBondContact O-CG 3.22Å; T6-L10 PolarHBondContact O-N 2.98Å
7	I	71.7	Confident	59.9	Low	117 Å²	117	115.5 Å²	115.5	60%	0.6	64%	0.639	S	S	*	*	H	α-helix	trans	-65.1	-41.8	176.6	-68.9	164.1	0	0	0	110.7	R3 A4 L10 S11	R3-I7 VanDerWaalsContact O-CG1 3.31Å; R3-I7 WeakPolarHBondContact O-CG1 3.49Å; R3-I7 PolarHBondContact O-N 2.97Å; A4-I7 PolarHBondContact O-N 3.17Å; I7-L10 PolarHBondContact O-N 3.44Å; I7-S11 PolarHBondContact O-N 3.16Å; I7-S11 PolarHBondContact O-OG 2.9Å
8	L	67.4	Low	58.7	Low	118 Å²	118	115.2 Å²	115.2	62%	0.618	65%	0.654	S	S	*	*	H	α-helix	trans	-65.3	-39.7	177.5	-149.2	80	0	0	0	112.4	A4 V5 S11 V12	A4-L8 WeakPolarHBondContact O-CB 3.5Å; A4-L8 PolarHBondContact O-N 3.29Å; V5-L8 PolarHBondContact O-N 2.86Å; L8-S11 PolarHBondContact O-N 2.86Å; L8-S11 PolarHBondContact O-OG 2.81Å; L8-V12 WeakPolarHBondContact O-CB 3.44Å; L8-V12 VanDerWaalsContact O-CG2 3.28Å; L8-V12 WeakPolarHBondContact O-CG2 3.27Å; L8-V12 PolarHBondContact O-N 3.34Å
9	L	62.3	Low	57.4	Low	100 Å²	100	112.2 Å²	112.2	52%	0.524	65%	0.651	S	S	.	*	H	α-helix	trans	-66.5	-38.5	173.7	-89.2	158.8	0	0	0	112.2	V5 T6 L13	V5-L9 HydrophobicContact CG1-CD1 4.06Å; V5-L9 WeakPolarHBondContact O-CB 3.34Å; V5-L9 PolarHBondContact O-N 3.21Å; T6-L9 PolarHBondContact O-N 3.5Å; L9-L13 VanDerWaalsContact O-CB 3.32Å; L9-L13 WeakPolarHBondContact O-CB 3.27Å; L9-L13 VanDerWaalsContact O-CG 3.3Å; L9-L13 WeakPolarHBondContact O-CG 3.33Å; L9-L13 PolarHBondContact O-N 2.74Å
10	L	63.3	Low	56.4	Low	115 Å²	115	114.8 Å²	114.8	60%	0.602	66%	0.66	S	S	*	*	H	α-helix	trans	-67.9	-37.7	175.6	-75.6	166.3	0	0	0	112.3	T6 I7 S14	T6-L10 HydrophobicContact CG2-CD1 4.14Å; T6-L10 WeakPolarHBondContact O-CB 3.33Å; T6-L10 VanDerWaalsContact O-CG 3.32Å; T6-L10 WeakPolarHBondContact O-CG 3.22Å; T6-L10 PolarHBondContact O-N 2.98Å; I7-L10 PolarHBondContact O-N 3.44Å; L10-S14 WeakPolarHBondContact O-CB 3.33Å; L10-S14 PolarHBondContact O-N 2.7Å
11	S	55.9	Low	55.6	Low	56 Å²	56	115.3 Å²	115.3	39%	0.392	66%	0.66	S	S	.	*	H	α-helix	trans	-71.8	-36.7	175.1	61.4	0	0	0	0	112.6	I7 L8 S14 L15	I7-S11 PolarHBondContact O-N 3.16Å; I7-S11 PolarHBondContact O-OG 2.9Å; L8-S11 PolarHBondContact O-N 2.86Å; L8-S11 PolarHBondContact O-OG 2.81Å; S11-S14 PolarHBondContact O-N 2.65Å; S11-L15 WeakPolarHBondContact O-CG 3.17Å; S11-L15 PolarHBondContact O-N 3.25Å
12	V	58.3	Low	54.7	Low	93 Å²	93	109.6 Å²	109.6	56%	0.564	65%	0.645	S	S	*	*	H	α-helix	trans	-68.5	-39.6	174.3	170.5	0	0	0	0	111.7	L8 S14 L15	L8-V12 WeakPolarHBondContact O-CB 3.44Å; L8-V12 VanDerWaalsContact O-CG2 3.28Å; L8-V12 WeakPolarHBondContact O-CG2 3.27Å; L8-V12 PolarHBondContact O-N 3.34Å; V12-S14 PolarHBondContact O-N 2.68Å; V12-L15 PolarHBondContact O-N 3.41Å; V12-L15 VanDerWaalsContact O-N 3.14Å
13	L	54.6	Low	53.7	Low	127 Å²	127	105.7 Å²	105.7	67%	0.665	63%	0.634	S	S	*	*	H	α-helix	trans	-68	-23	172.7	-74.8	165.9	0	0	0	112.9	L9 L15	L9-L13 VanDerWaalsContact O-CB 3.32Å; L9-L13 WeakPolarHBondContact O-CB 3.27Å; L9-L13 VanDerWaalsContact O-CG 3.3Å; L9-L13 WeakPolarHBondContact O-CG 3.33Å; L9-L13 PolarHBondContact O-N 2.74Å; L13-L15 VanDerWaalsContact C-N 3.29Å
14	S	50.7	Low	53.6	Low	101 Å²	101	100.6 Å²	100.6	71%	0.706	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	1.7	172.6	-168.4	0	0	0	0	114	L10 S11 V12	L10-S14 WeakPolarHBondContact O-CB 3.33Å; L10-S14 PolarHBondContact O-N 2.7Å; S11-S14 PolarHBondContact O-N 2.65Å; V12-S14 PolarHBondContact O-N 2.68Å
15	L	42	Very low	53.7	Low	136 Å²	136	104.5 Å²	104.5	71%	0.712	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	14.2	-179	-82.7	164.3	0	0	0	113.8	S11 V12 L13 P17	S11-L15 WeakPolarHBondContact O-CG 3.17Å; S11-L15 PolarHBondContact O-N 3.25Å; V12-L15 PolarHBondContact O-N 3.41Å; V12-L15 VanDerWaalsContact O-N 3.14Å; L13-L15 VanDerWaalsContact C-N 3.29Å; L15-P17 WeakPolarHBondContact O-CD 2.96Å
16	C	36.7	Very low	53.9	Low	98 Å²	98	102.1 Å²	102.1	66%	0.662	61%	0.612	S	S	*	*	S	Bend	trans	-74.4	116.6	162.7	-66.6	0	0	0	0	109	A18	C16-A18 PolarHBondContact O-N 2.83Å
17	P	41.3	Very low	54.2	Low	121 Å²	121	106.5 Å²	106.5	79%	0.786	62%	0.624	S	S	*	*			trans	-65	128.6	173.7	27.3	-33.1	0	0	0	109.3	L15 G19	L15-P17 WeakPolarHBondContact O-CD 2.96Å; P17-G19 PolarHBondContact O-N 3.31Å
18	A	38.8	Very low	54.8	Low	111 Å²	111	102 Å²	102	92%	0.917	61%	0.607	S	S	*	*			trans	-75.8	59.4	177.5	0	0	0	0	0	111.3	C16	C16-A18 PolarHBondContact O-N 2.83Å
19	G	33.9	Very low	55.7	Low	57 Å²	57	101 Å²	101	59%	0.588	60%	0.602	S	S	*	*			trans	-95.2	18	-167.3	0	0	0	0	0	116.2	P17 L21	P17-G19 PolarHBondContact O-N 3.31Å; G19-L21 VanDerWaalsContact C-N 3.34Å; G19-L21 PolarHBondContact O-N 3.11Å
20	I	38.7	Very low	57.1	Low	165 Å²	165	97.3 Å²	97.3	85%	0.846	58%	0.582	S	S	*	*			trans	-86.7	80.5	172	-53.2	179.5	0	0	0	108.2	A22	I20-A22 PolarHBondContact O-N 2.69Å
21	L	38.2	Very low	58.4	Low	125 Å²	125	92.7 Å²	92.7	65%	0.654	56%	0.557	S	S	*	*			trans	-74.6	77.6	173.1	-84.8	169.9	0	0	0	110.2	G19 A23 Q604	G19-L21 VanDerWaalsContact C-N 3.34Å; G19-L21 PolarHBondContact O-N 3.11Å; L21-A23 PolarHBondContact O-N 2.72Å; L21-Q604 PolarHBondContact O-NE2 2.03Å; L21-Q604 PolarHBondContact O-OE1 2.79Å
22	A	38	Very low	60.1	Low	80 Å²	80	90.1 Å²	90.1	66%	0.661	54%	0.539	S	S	*	.			trans	-45.4	138.1	169.2	0	0	0	0	0	110.6	I20 K24	I20-A22 PolarHBondContact O-N 2.69Å; A22-K24 PolarHBondContact O-N 3.21Å
23	A	45.2	Very low	61.7	Low	65 Å²	65	86.9 Å²	86.9	54%	0.537	52%	0.518	S	S	.	.			trans	-46.7	140.6	-177.5	0	0	0	0	0	111.2	L21 E25	L21-A23 PolarHBondContact O-N 2.72Å; A23-E25 PolarHBondContact O-N 3.07Å
24	K	63.9	Low	63.4	Low	112 Å²	112	82.5 Å²	82.5	49%	0.487	50%	0.495	S	S	.	.			trans	-66.8	75.8	-171.9	-74.6	-176	174.8	177.2	0	112.7	A22 C26 Y60 S61	A22-K24 PolarHBondContact O-N 3.21Å; K24-C26 PolarHBondContact O-N 2.87Å; K24-C26 VanDerWaalsContact O-N 3.1Å; K24-Y60 HydrophobicContact CB-CD1 4.33Å; K24-Y60 HydrophobicContact CB-CE1 3.79Å; K24-Y60 WeakPolarHBondContact O-CD1 3.03Å; K24-Y60 WeakPolarHBondContact O-CE1 3.06Å; K24-S61 VanDerWaalsContact O-CB 3.26Å; K24-S61 WeakPolarHBondContact O-CB 3.29Å
25	E	74.1	Confident	65.2	Low	144 Å²	144	78.7 Å²	78.7	67%	0.673	47%	0.468	S	S	*	.			trans	-64.4	106.1	166.6	-72.8	-166.7	148.9	0	0	109.1	A23 K27	A23-E25 PolarHBondContact O-N 3.07Å; E25-K27 PolarHBondContact O-N 2.98Å
26	C	83.2	Confident	67.2	Low	28 Å²	28	77 Å²	77	19%	0.189	46%	0.46	C	S	.	.			trans	-66.5	105.9	168	-177.9	0	0	0	0	109.6	K24 G28 F30 Y60 C114	K24-C26 PolarHBondContact O-N 2.87Å; K24-C26 VanDerWaalsContact O-N 3.1Å; C26-G28 VanDerWaalsContact C-N 3.33Å; C26-F30 HydrophobicContact CB-CD1 4.24Å; C26-F30 HydrophobicContact CB-CE1 3.47Å; C26-F30 VanDerWaalsContact CB-CE1 3.47Å; C26-F30 HydrophobicContact CB-CE2 4.11Å; C26-F30 HydrophobicContact CB-CZ 3.39Å; C26-Y60 HydrophobicContact CB-CD1 4.17Å; C26-Y60 HydrophobicContact CB-CE1 3.98Å; C26-C114 WeakPolarHBondContact CA-SG 3.21Å; C26-C114 HydrophobicContact CB-CB 3.66Å; C26-C114 WeakPolarHBondContact CB-SG 3Å; C26-C114 WeakPolarHBondContact SG-CB 3.37Å; C26-C114 CovalentContact SG-SG 2.03Å; C26-C114 PolarHBondContact SG-SG 2.87Å
27	K	81.2	Confident	69.3	Low	168 Å²	168	80.3 Å²	80.3	73%	0.73	46%	0.463	S	S	*	.			trans	-84.6	-4.8	179.3	-73	177.8	179.7	170.6	0	114	E25 L117	E25-K27 PolarHBondContact O-N 2.98Å; K27-L117 WeakPolarHBondContact O-CD1 3.46Å
28	G	82.6	Confident	70.6	Confident	23 Å²	23	77.4 Å²	77.4	24%	0.237	44%	0.443	C	S	.	.	S	Bend	trans	-124.5	-137.4	175.9	0	0	0	0	0	111.8	C26 T115	C26-G28 VanDerWaalsContact C-N 3.33Å; G28-T115 CarbonylContact C-O 3.59Å; G28-T115 VanDerWaalsContact CA-O 3.23Å; G28-T115 WeakPolarHBondContact CA-O 3.48Å
29	L	86.8	Confident	72.2	Confident	96 Å²	96	75.4 Å²	75.4	50%	0.503	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	143.1	-171.2	-138	73.5	0	0	0	111.7	T98 T115	L29-T98 HydrophobicContact CD2-CG2 3.75Å; L29-T115 PolarHBondContact N-O 3.46Å; L29-T115 PolarHBondContact O-N 3.29Å; L29-T115 PolarHBondContact O-OG1 3.38Å
30	F	91.1	Very high	73.8	Confident	23 Å²	23	77.9 Å²	77.9	10%	0.101	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	129.7	168.5	-75.1	-61.8	0	0	0	110.4	C26 F32 V56 R57 Y60 I112 R113	C26-F30 HydrophobicContact CB-CD1 4.24Å; C26-F30 HydrophobicContact CB-CE1 3.47Å; C26-F30 VanDerWaalsContact CB-CE1 3.47Å; C26-F30 HydrophobicContact CB-CE2 4.11Å; C26-F30 HydrophobicContact CB-CZ 3.39Å; F30-F32 HydrophobicContact CB-CD1 4.12Å; F30-F32 HydrophobicContact CB-CE1 4.24Å; F30-V56 HydrophobicContact CB-CG1 3.86Å; F30-V56 HydrophobicContact CD1-CG1 3.77Å; F30-V56 HydrophobicContact CD2-CG1 4.03Å; F30-V56 HydrophobicContact CE1-CG1 4.29Å; F30-V56 HydrophobicContact CG-CG1 3.62Å; F30-R57 HydrophobicContact CE2-CB 3.94Å; F30-R57 HydrophobicContact CE2-CG 4.22Å; F30-R57 HydrophobicContact CZ-CB 4.22Å; F30-R57 HydrophobicContact CZ-CG 4.32Å; F30-Y60 AromaticContact CE1-CD1 3.66Å; F30-Y60 HydrophobicContact CE1-CD1 3.66Å; F30-Y60 HydrophobicContact CE1-CD2 4.3Å; F30-Y60 HydrophobicContact CE1-CE1 4.36Å; F30-Y60 AromaticContact CE1-CG 3.62Å; F30-Y60 HydrophobicContact CE1-CG 3.62Å; F30-Y60 HydrophobicContact CZ-CD1 4.14Å; F30-Y60 HydrophobicContact CZ-CG 4.35Å; F30-I112 HydrophobicContact CD1-CG2 4.23Å; F30-R113 WeakPolarHBondContact CA-O 3.45Å
31	H	90.6	Very high	75.5	Confident	17 Å²	17	71 Å²	71	8%	0.079	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	126.4	170	-70.9	-105.5	0	0	0	108.1	L96 S97 T98 I112 R113 T115	H31-L96 HydrophobicContact CB-CB 3.88Å; H31-L96 HydrophobicContact CB-CD1 4.06Å; H31-S97 WeakPolarHBondContact CA-O 3.09Å; H31-T98 WeakPolarHBondContact CE1-CG2 3.3Å; H31-T98 VanDerWaalsContact ND1-CG2 3.25Å; H31-T98 WeakPolarHBondContact ND1-CG2 3.47Å; H31-I112 CarbonylContact O-C 3.52Å; H31-I112 WeakPolarHBondContact O-CA 3.39Å; H31-R113 HydrophobicContact CB-CB 4.47Å; H31-R113 PolarHBondContact N-O 2.03Å; H31-R113 PolarHBondContact O-N 2.83Å; H31-T115 VanDerWaalsContact CD2-CG2 3.41Å; H31-T115 WeakPolarHBondContact CD2-CG2 3.45Å; H31-T115 PolarHBondContact CD2-OG1 2.03Å; H31-T115 PolarHBondContact NE2-OG1 2.84Å; H31-T115 VanDerWaalsContact NE2-OG1 3.12Å
32	F	92.9	Very high	77.3	Confident	3 Å²	3	69.1 Å²	69.1	1%	0.013	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	154.2	-178	50	-88.6	0	0	0	110.9	F30 L34 L52 V56 L96 S97 V109 I112	F30-F32 HydrophobicContact CB-CD1 4.12Å; F30-F32 HydrophobicContact CB-CE1 4.24Å; F32-L34 HydrophobicContact CD2-CD1 4.46Å; F32-L34 HydrophobicContact CD2-CD2 3.93Å; F32-L34 HydrophobicContact CD2-CG 3.92Å; F32-L34 HydrophobicContact CE2-CD1 4.01Å; F32-L34 HydrophobicContact CE2-CD2 4Å; F32-L34 HydrophobicContact CE2-CG 3.96Å; F32-L52 HydrophobicContact CE2-CD2 4Å; F32-L52 HydrophobicContact CZ-CD2 4.28Å; F32-V56 HydrophobicContact CD1-CG1 3.97Å; F32-V56 HydrophobicContact CD1-CG2 3.86Å; F32-V56 HydrophobicContact CD2-CG2 4.39Å; F32-V56 HydrophobicContact CE1-CG1 4.37Å; F32-V56 HydrophobicContact CE1-CG2 3.86Å; F32-V56 HydrophobicContact CE2-CG2 4.38Å; F32-V56 HydrophobicContact CG-CG2 4.14Å; F32-V56 HydrophobicContact CZ-CG2 4.12Å; F32-L96 CarbonylContact O-C 3.57Å; F32-S97 PolarHBondContact N-O 3.47Å; F32-S97 PolarHBondContact O-N 2.77Å; F32-V109 HydrophobicContact CB-CG1 3.94Å; F32-V109 HydrophobicContact CD2-CG1 3.97Å; F32-V109 HydrophobicContact CG-CG1 4.07Å; F32-I112 HydrophobicContact CB-CG1 3.97Å
33	D	91.5	Very high	79.4	Confident	25 Å²	25	68.5 Å²	68.5	13%	0.134	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	153	171.2	-170.7	47.1	0	0	0	110.2	R94 L96 E110 C111	D33-R94 HydrophobicContact CB-CB 4.4Å; D33-R94 WeakPolarHBondContact OD2-CD 3.41Å; D33-R94 IonicContact OD2-CZ 2.71Å; D33-R94 IonicContact OD2-NE 3.58Å; D33-R94 IonicContact OD2-NH1 3.07Å; D33-R94 PolarHBondContact OD2-NH1 3.21Å; D33-L96 HydrophobicContact CB-CD2 3.99Å; D33-E110 HydrophobicContact CB-CB 4.34Å; D33-E110 PolarHBondContact N-O 2.85Å; D33-E110 PolarHBondContact O-N 3.11Å; D33-C111 HydrophobicContact CB-CB 4.09Å
34	L	91.1	Very high	81.2	Confident	34 Å²	34	68 Å²	68	18%	0.178	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	128.5	179.1	-72.3	177.4	0	0	0	111.6	F32 L52 H100 V107 I108 V109	F32-L34 HydrophobicContact CD2-CD1 4.46Å; F32-L34 HydrophobicContact CD2-CD2 3.93Å; F32-L34 HydrophobicContact CD2-CG 3.92Å; F32-L34 HydrophobicContact CE2-CD1 4.01Å; F32-L34 HydrophobicContact CE2-CD2 4Å; F32-L34 HydrophobicContact CE2-CG 3.96Å; L34-L52 HydrophobicContact CD1-CD2 4.21Å; L34-L52 HydrophobicContact CD2-CD2 4.36Å; L34-H100 HydrophobicContact CD1-CB 3.56Å; L34-H100 WeakPolarHBondContact CD1-ND1 3.49Å; L34-V107 HydrophobicContact CD2-CG2 4.25Å; L34-I108 WeakPolarHBondContact CA-O 3.46Å; L34-V109 HydrophobicContact CD2-CB 4.39Å; L34-V109 HydrophobicContact CD2-CG2 3.89Å
35	S	87.3	Confident	82.2	Confident	21 Å²	21	63.7 Å²	63.7	15%	0.147	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	115.1	176.2	175.9	0	0	0	0	110.7	K37 I108	S35-K37 PolarHBondContact O-N 3.32Å; S35-K37 WeakPolarHBondContact OG-CB 3.35Å; S35-K37 PolarHBondContact OG-N 3.34Å; S35-K37 VanDerWaalsContact OG-N 3.12Å; S35-K37 PolarHBondContact OG-O 2.74Å; S35-I108 PolarHBondContact N-O 3.1Å; S35-I108 PolarHBondContact O-N 3.1Å
36	D	83.8	Confident	82.9	Confident	100 Å²	100	61 Å²	61	54%	0.535	31%	0.313	S	S	.	.	S	Bend	trans	-66.9	-12.8	164.9	-81.4	17.4	0	0	0	112.2	V38	D36-V38 PolarHBondContact O-N 3.33Å
37	K	80.5	Confident	83.3	Confident	169 Å²	169	64.3 Å²	64.3	74%	0.735	32%	0.322	S	S	*	.			trans	-79	102.7	171	-53.5	179.7	-178.8	-178.9	0	107.9	S35	S35-K37 PolarHBondContact O-N 3.32Å; S35-K37 WeakPolarHBondContact OG-CB 3.35Å; S35-K37 PolarHBondContact OG-N 3.34Å; S35-K37 VanDerWaalsContact OG-N 3.12Å; S35-K37 PolarHBondContact OG-O 2.74Å
38	V	70.3	Confident	83.8	Confident	60 Å²	60	63.5 Å²	63.5	36%	0.364	31%	0.314	S	S	.	.			trans	-72	129.8	164.8	-175.3	0	0	0	0	108.2	D36 L70 P106	D36-V38 PolarHBondContact O-N 3.33Å; V38-L70 HydrophobicContact CG1-CD1 4.21Å; V38-L70 HydrophobicContact CG1-CD2 4.38Å; V38-L70 HydrophobicContact CG2-CD1 4.09Å; V38-P106 HydrophobicContact CG2-CB 4.03Å
39	D	71.6	Confident	84.2	Confident	68 Å²	68	62.6 Å²	62.6	36%	0.364	30%	0.304	S	S	.	.			trans	-122.2	168.5	173.4	59.4	25.9	0	0	0	110.6	R41 I108	D39-R41 PolarHBondContact O-N 2.79Å; D39-R41 WeakPolarHBondContact OD1-CB 3.45Å; D39-R41 WeakPolarHBondContact OD1-CG 3.41Å; D39-R41 IonicContact OD1-CZ 2.69Å; D39-R41 PolarHBondContact OD1-N 2.98Å; D39-R41 IonicContact OD1-NE 2.74Å; D39-R41 PolarHBondContact OD1-NE 3.15Å; D39-R41 IonicContact OD1-NH2 3.52Å; D39-R41 PolarHBondContact OD1-NH2 2.9Å; D39-R41 IonicContact OD2-CZ 3.43Å; D39-R41 IonicContact OD2-NE 3.35Å; D39-R41 IonicContact OD2-NH2 3.96Å; D39-R41 PolarHBondContact OD2-NH2 3.47Å; D39-I108 VanDerWaalsContact OD1-CD1 3.32Å; D39-I108 WeakPolarHBondContact OD1-CD1 3.48Å
40	N	67	Low	84.5	Confident	109 Å²	109	63.2 Å²	63.2	58%	0.583	31%	0.312	S	S	*	.			trans	-80.3	38.8	-176	-60.3	-14.3	0	0	0	112	I1005	N40-I1005 VanDerWaalsContact ND2-CG2 3.31Å; N40-I1005 WeakPolarHBondContact ND2-CG2 3.49Å
41	R	75.8	Confident	84.5	Confident	21 Å²	21	63.5 Å²	63.5	8%	0.079	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-67.7	137.1	177.3	70.2	-178.4	61.6	-153.3	-3.9	111	D39 T43 S68 Q86 E110	D39-R41 PolarHBondContact O-N 2.79Å; D39-R41 WeakPolarHBondContact OD1-CB 3.45Å; D39-R41 WeakPolarHBondContact OD1-CG 3.41Å; D39-R41 IonicContact OD1-CZ 2.69Å; D39-R41 PolarHBondContact OD1-N 2.98Å; D39-R41 IonicContact OD1-NE 2.74Å; D39-R41 PolarHBondContact OD1-NE 3.15Å; D39-R41 IonicContact OD1-NH2 3.52Å; D39-R41 PolarHBondContact OD1-NH2 2.9Å; D39-R41 IonicContact OD2-CZ 3.43Å; D39-R41 IonicContact OD2-NE 3.35Å; D39-R41 IonicContact OD2-NH2 3.96Å; D39-R41 PolarHBondContact OD2-NH2 3.47Å; R41-T43 PolarHBondContact O-N 2.94Å; R41-S68 WeakPolarHBondContact CD-OG 3.09Å; R41-S68 PolarHBondContact NH1-OG 3.35Å; R41-Q86 HydrophobicContact CB-CB 4.18Å; R41-Q86 HydrophobicContact CB-CG 4.27Å; R41-Q86 VanDerWaalsContact CB-OE1 3.31Å; R41-E110 IonicContact CZ-OE1 2.67Å; R41-E110 VanDerWaalsContact CZ-OE1 3.22Å; R41-E110 VanDerWaalsContact NH1-CD 3.33Å; R41-E110 IonicContact NH1-OE1 3.97Å; R41-E110 PolarHBondContact NH1-OE1 2.9Å; R41-E110 IonicContact NH2-OE1 3.78Å; R41-E110 PolarHBondContact NH2-OE1 2.95Å; R41-E110 IonicContact NH2-OE2 2.64Å
42	E	74.8	Confident	84.7	Confident	85 Å²	85	62.8 Å²	62.8	40%	0.397	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-74.8	130.6	-171.9	-155	-164	157.5	0	0	111.6	S84 K949	E42-S84 WeakPolarHBondContact O-CA 3.3Å; E42-S84 VanDerWaalsContact O-CB 3.26Å; E42-S84 WeakPolarHBondContact O-CB 3.1Å; E42-S84 PolarHBondContact O-OG 3.03Å; E42-K949 WeakPolarHBondContact OE1-CE 3.21Å; E42-K949 IonicContact OE1-NZ 2.74Å; E42-K949 PolarHBondContact OE1-NZ 2.81Å; E42-K949 VanDerWaalsContact OE2-CE 3.31Å; E42-K949 WeakPolarHBondContact OE2-CE 3.46Å; E42-K949 IonicContact OE2-NZ 2.78Å; E42-K949 PolarHBondContact OE2-NZ 3.11Å
43	T	82.5	Confident	84.6	Confident	67 Å²	67	66 Å²	66	41%	0.411	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	122.1	-175.2	58.6	0	0	0	0	111.3	R41 L82 L83	R41-T43 PolarHBondContact O-N 2.94Å; T43-L82 HydrophobicContact CG2-CB 3.55Å; T43-L82 HydrophobicContact CG2-CD1 4.12Å; T43-L82 HydrophobicContact CG2-CG 4.49Å; T43-L83 CarbonylContact C-O 3.58Å; T43-L83 VanDerWaalsContact CA-O 3.28Å; T43-L83 WeakPolarHBondContact CA-O 3.5Å
44	F	82	Confident	84.6	Confident	54 Å²	54	66.4 Å²	66.4	24%	0.237	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-14.6	-176.1	74.1	-96.1	0	0	0	114.2	S63 C66 L83 Y85	F44-S63 WeakPolarHBondContact CE2-OG 3.5Å; F44-S63 WeakPolarHBondContact CZ-OG 3.06Å; F44-C66 HydrophobicContact CE1-CB 4.34Å; F44-C66 HydrophobicContact CZ-CB 4.03Å; F44-L83 HydrophobicContact CD1-CB 4.26Å; F44-L83 VanDerWaalsContact CD1-O 3.22Å; F44-L83 WeakPolarHBondContact CD1-O 3.44Å; F44-L83 HydrophobicContact CE1-CB 3.68Å; F44-L83 HydrophobicContact CE2-CB 4.17Å; F44-L83 HydrophobicContact CE2-CD1 4.42Å; F44-L83 HydrophobicContact CZ-CB 3.62Å; F44-L83 HydrophobicContact CZ-CD1 4.21Å; F44-L83 PolarHBondContact N-O 3.24Å; F44-Y85 HydrophobicContact CB-CD2 3.96Å; F44-Y85 HydrophobicContact CB-CE1 4.18Å; F44-Y85 HydrophobicContact CB-CE2 3.28Å; F44-Y85 VanDerWaalsContact CB-CZ 3.41Å; F44-Y85 AromaticContact CD1-CD1 3.57Å; F44-Y85 HydrophobicContact CD1-CD1 3.57Å; F44-Y85 AromaticContact CD1-CD2 3.9Å; F44-Y85 HydrophobicContact CD1-CD2 3.9Å; F44-Y85 AromaticContact CD1-CE1 3.53Å; F44-Y85 HydrophobicContact CD1-CE1 3.53Å; F44-Y85 AromaticContact CD1-CE2 3.87Å; F44-Y85 HydrophobicContact CD1-CE2 3.87Å; F44-Y85 AromaticContact CD1-CG 3.76Å; F44-Y85 HydrophobicContact CD1-CG 3.76Å; F44-Y85 AromaticContact CD1-CZ 3.69Å; F44-Y85 AromaticContact CD2-CE1 3.98Å; F44-Y85 HydrophobicContact CD2-CE1 3.98Å; F44-Y85 AromaticContact CD2-CZ 3.85Å; F44-Y85 AromaticContact CE1-CD1 3.73Å; F44-Y85 HydrophobicContact CE1-CD1 3.73Å; F44-Y85 AromaticContact CE1-CE1 3.81Å; F44-Y85 HydrophobicContact CE1-CE1 3.81Å; F44-Y85 HydrophobicContact CE1-CG 4.26Å; F44-Y85 HydrophobicContact CE2-CE1 4.24Å; F44-Y85 HydrophobicContact CG-CD1 4.16Å; F44-Y85 HydrophobicContact CG-CD2 4.19Å; F44-Y85 AromaticContact CG-CE1 3.64Å; F44-Y85 HydrophobicContact CG-CE1 3.64Å; F44-Y85 AromaticContact CG-CE2 3.69Å; F44-Y85 HydrophobicContact CG-CE2 3.69Å; F44-Y85 HydrophobicContact CG-CG 4.41Å; F44-Y85 AromaticContact CG-CZ 3.37Å; F44-Y85 HydrophobicContact CZ-CD1 4.43Å; F44-Y85 HydrophobicContact CZ-CE1 4.16Å
45	S	85.5	Confident	84.8	Confident	22 Å²	22	64.8 Å²	64.8	15%	0.154	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	123.4	178	-157.8	0	0	0	0	111.3	R47 L83	S45-R47 PolarHBondContact OG-NE 2.89Å; S45-R47 PolarHBondContact OG-NH2 2.99Å; S45-L83 PolarHBondContact O-N 3.34Å
46	H	89.8	Confident	85.1	Confident	89 Å²	89	63.8 Å²	63.8	41%	0.412	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	119.3	170.2	179.7	-177.9	0	0	0	109	Q80 L82	H46-Q80 WeakPolarHBondContact NE2-CG 3.34Å; H46-L82 HydrophobicContact CB-CD2 3.73Å; H46-L82 WeakPolarHBondContact CD2-CD2 3.47Å; H46-L82 VanDerWaalsContact CG-CD2 3.46Å
47	R	90.9	Very high	85.6	Confident	96 Å²	96	63.9 Å²	63.9	36%	0.362	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	153.9	174.6	-56	-63.3	179.3	155.4	4.1	110.2	S45 I58 C81 L83	S45-R47 PolarHBondContact OG-NE 2.89Å; S45-R47 PolarHBondContact OG-NH2 2.99Å; R47-I58 HydrophobicContact CB-CD1 4.29Å; R47-I58 HydrophobicContact CB-CG2 3.94Å; R47-I58 HydrophobicContact CG-CG2 3.78Å; R47-C81 HydrophobicContact CB-CB 4.5Å; R47-C81 PolarHBondContact N-O 2.04Å; R47-C81 PolarHBondContact O-N 2.92Å; R47-L83 HydrophobicContact CG-CD1 4.35Å
48	R	91.9	Very high	86.1	Confident	151 Å²	151	56.1 Å²	56.1	57%	0.57	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	142.2	168.2	-60	-177.2	-171	-148.7	12.6	109.2	I58 S78 H79 V639	R48-I58 WeakPolarHBondContact O-CD1 3.32Å; R48-S78 PolarHBondContact NH1-OG 2.82Å; R48-H79 WeakPolarHBondContact CA-O 3.41Å; R48-V639 PolarHBondContact NH2-O 2.83Å
49	A	91.6	Very high	87.3	Confident	4 Å²	4	53.2 Å²	53.2	3%	0.033	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	146	175.1	0	0	0	0	0	110.2	E54 C55 I58 F71 H79 C81	A49-E54 HydrophobicContact CB-CB 4.34Å; A49-E54 HydrophobicContact CB-CG 4.36Å; A49-C55 HydrophobicContact CB-CB 3.91Å; A49-I58 HydrophobicContact CB-CD1 4.14Å; A49-F71 HydrophobicContact CB-CE2 4.43Å; A49-H79 PolarHBondContact N-O 3.14Å; A49-H79 WeakPolarHBondContact O-CB 3.32Å; A49-H79 PolarHBondContact O-CD2 3.47Å; A49-H79 PolarHBondContact O-N 2.95Å; A49-C81 HydrophobicContact CB-CB 4.12Å
50	T	91.8	Very high	88.2	Confident	110 Å²	110	53 Å²	53	68%	0.675	25%	0.251	S	S	*	.	S	Bend	trans	-86.7	-14	175.2	47.6	0	0	0	0	113.1
51	S	92.2	Very high	89.1	Confident	28 Å²	28	49.2 Å²	49.2	20%	0.196	23%	0.233	C	C	.	.	S	Bend	trans	-160	173.5	175.6	79.4	0	0	0	0	110.8	E53 E54 C55 F71	S51-E53 VanDerWaalsContact C-N 3.29Å; S51-E53 WeakPolarHBondContact CB-OE2 3.44Å; S51-E53 PolarHBondContact O-N 3.14Å; S51-E53 PolarHBondContact OG-N 2.9Å; S51-E53 PolarHBondContact OG-OE2 2.86Å; S51-E54 PolarHBondContact O-N 3.1Å; S51-E54 PolarHBondContact OG-N 3.11Å; S51-C55 PolarHBondContact O-N 3.47Å; S51-C55 VanDerWaalsContact O-N 3.15Å; S51-F71 VanDerWaalsContact C-CE2 3.44Å; S51-F71 WeakPolarHBondContact O-CE2 3.01Å
52	L	93.2	Very high	89.4	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-60.5	-40.7	174.6	-177.9	64.6	0	0	0	111.1	F32 L34 E54 C55 V56 F71 H100 V107 V109	F32-L52 HydrophobicContact CE2-CD2 4Å; F32-L52 HydrophobicContact CZ-CD2 4.28Å; L34-L52 HydrophobicContact CD1-CD2 4.21Å; L34-L52 HydrophobicContact CD2-CD2 4.36Å; L52-E54 VanDerWaalsContact C-N 3.34Å; L52-E54 PolarHBondContact O-N 3.11Å; L52-C55 WeakPolarHBondContact O-CA 3.22Å; L52-C55 WeakPolarHBondContact O-CB 3.34Å; L52-C55 PolarHBondContact O-N 3.36Å; L52-V56 VanDerWaalsContact O-CG2 3.29Å; L52-V56 WeakPolarHBondContact O-CG2 3.4Å; L52-V56 PolarHBondContact O-N 3.07Å; L52-F71 HydrophobicContact CB-CD1 4.47Å; L52-F71 HydrophobicContact CB-CE1 4.27Å; L52-F71 HydrophobicContact CB-CE2 4.48Å; L52-F71 HydrophobicContact CB-CZ 4.26Å; L52-F71 HydrophobicContact CD1-CB 3.68Å; L52-F71 HydrophobicContact CD1-CD1 3.77Å; L52-F71 HydrophobicContact CD1-CD2 4.17Å; L52-F71 HydrophobicContact CD1-CE1 4.4Å; L52-F71 HydrophobicContact CD1-CG 3.61Å; L52-H100 HydrophobicContact CD2-CB 3.9Å; L52-V107 HydrophobicContact CD1-CG2 4.18Å; L52-V109 HydrophobicContact CD1-CG2 3.63Å
53	E	91.4	Very high	89.6	Confident	70 Å²	70	50.6 Å²	50.6	33%	0.327	24%	0.24	S	C	.	.	H	α-helix	trans	-67.6	-32.8	-179.1	-53.5	71.8	-154.4	0	0	112	S51 R57	S51-E53 VanDerWaalsContact C-N 3.29Å; S51-E53 WeakPolarHBondContact CB-OE2 3.44Å; S51-E53 PolarHBondContact O-N 3.14Å; S51-E53 PolarHBondContact OG-N 2.9Å; S51-E53 PolarHBondContact OG-OE2 2.86Å; E53-R57 VanDerWaalsContact O-CB 3.25Å; E53-R57 WeakPolarHBondContact O-CB 3.31Å; E53-R57 PolarHBondContact O-N 3.1Å
54	E	92.3	Very high	89.3	Confident	35 Å²	35	51 Å²	51	16%	0.164	24%	0.24	C	C	.	.	H	α-helix	trans	-72.4	-31.8	170.5	-178.6	57	-163.7	0	0	111.6	A49 S51 L52 R57 I58 K62	A49-E54 HydrophobicContact CB-CB 4.34Å; A49-E54 HydrophobicContact CB-CG 4.36Å; S51-E54 PolarHBondContact O-N 3.1Å; S51-E54 PolarHBondContact OG-N 3.11Å; L52-E54 VanDerWaalsContact C-N 3.34Å; L52-E54 PolarHBondContact O-N 3.11Å; E54-R57 PolarHBondContact O-N 3.28Å; E54-R57 WeakPolarHBondContact OE2-CD 3.41Å; E54-R57 IonicContact OE2-CZ 3.53Å; E54-R57 IonicContact OE2-NE 3.67Å; E54-R57 IonicContact OE2-NH1 3.73Å; E54-R57 PolarHBondContact OE2-NH1 3.49Å; E54-I58 HydrophobicContact CG-CD1 3.87Å; E54-I58 HydrophobicContact CG-CG1 4.27Å; E54-I58 VanDerWaalsContact O-CB 3.31Å; E54-I58 WeakPolarHBondContact O-CB 3.03Å; E54-I58 WeakPolarHBondContact O-CD1 3.07Å; E54-I58 WeakPolarHBondContact O-CG1 3.48Å; E54-I58 PolarHBondContact O-N 3.28Å; E54-I58 WeakPolarHBondContact OE1-CG1 3.09Å; E54-K62 IonicContact OE1-NZ 3.98Å; E54-K62 PolarHBondContact OE1-NZ 2.99Å
55	C	94.4	Very high	89.3	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-66.1	-45.3	171.4	-177.8	0	0	0	0	112	A49 S51 L52 R57 I58 C59 F71 C81	A49-C55 HydrophobicContact CB-CB 3.91Å; S51-C55 PolarHBondContact O-N 3.47Å; S51-C55 VanDerWaalsContact O-N 3.15Å; L52-C55 WeakPolarHBondContact O-CA 3.22Å; L52-C55 WeakPolarHBondContact O-CB 3.34Å; L52-C55 PolarHBondContact O-N 3.36Å; C55-R57 VanDerWaalsContact C-N 3.32Å; C55-R57 PolarHBondContact O-N 2.96Å; C55-I58 PolarHBondContact O-N 2.8Å; C55-C59 WeakPolarHBondContact O-CB 3.42Å; C55-C59 PolarHBondContact O-N 3.2Å; C55-F71 HydrophobicContact CB-CD2 3.68Å; C55-F71 HydrophobicContact CB-CE2 4.31Å; C55-C81 WeakPolarHBondContact CA-SG 3.46Å; C55-C81 HydrophobicContact CB-CB 3.71Å; C55-C81 WeakPolarHBondContact CB-SG 3.19Å; C55-C81 WeakPolarHBondContact SG-CB 3.45Å; C55-C81 CovalentContact SG-SG 2.04Å; C55-C81 PolarHBondContact SG-SG 2.89Å
56	V	94.5	Very high	89.4	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-56.3	-45.7	171.8	176	0	0	0	0	110.8	F30 F32 L52 C59 Y60 V109 I112	F30-V56 HydrophobicContact CB-CG1 3.86Å; F30-V56 HydrophobicContact CD1-CG1 3.77Å; F30-V56 HydrophobicContact CD2-CG1 4.03Å; F30-V56 HydrophobicContact CE1-CG1 4.29Å; F30-V56 HydrophobicContact CG-CG1 3.62Å; F32-V56 HydrophobicContact CD1-CG1 3.97Å; F32-V56 HydrophobicContact CD1-CG2 3.86Å; F32-V56 HydrophobicContact CD2-CG2 4.39Å; F32-V56 HydrophobicContact CE1-CG1 4.37Å; F32-V56 HydrophobicContact CE1-CG2 3.86Å; F32-V56 HydrophobicContact CE2-CG2 4.38Å; F32-V56 HydrophobicContact CG-CG2 4.14Å; F32-V56 HydrophobicContact CZ-CG2 4.12Å; L52-V56 VanDerWaalsContact O-CG2 3.29Å; L52-V56 WeakPolarHBondContact O-CG2 3.4Å; L52-V56 PolarHBondContact O-N 3.07Å; V56-C59 PolarHBondContact O-N 2.91Å; V56-Y60 WeakPolarHBondContact O-CB 3.18Å; V56-Y60 PolarHBondContact O-N 3.34Å; V56-V109 HydrophobicContact CG2-CG1 3.8Å; V56-I112 HydrophobicContact CG1-CG1 4.46Å; V56-I112 HydrophobicContact CG1-CG2 3.73Å
57	R	93.1	Very high	89.2	Confident	101 Å²	101	54.2 Å²	54.2	38%	0.381	25%	0.252	S	S	.	.	H	α-helix	trans	-66	-44.4	178.2	-171.6	-178.5	-62.3	103.2	5.4	112.5	F30 E53 E54 C55 C59 Y60 S61	F30-R57 HydrophobicContact CE2-CB 3.94Å; F30-R57 HydrophobicContact CE2-CG 4.22Å; F30-R57 HydrophobicContact CZ-CB 4.22Å; F30-R57 HydrophobicContact CZ-CG 4.32Å; E53-R57 VanDerWaalsContact O-CB 3.25Å; E53-R57 WeakPolarHBondContact O-CB 3.31Å; E53-R57 PolarHBondContact O-N 3.1Å; E54-R57 PolarHBondContact O-N 3.28Å; E54-R57 WeakPolarHBondContact OE2-CD 3.41Å; E54-R57 IonicContact OE2-CZ 3.53Å; E54-R57 IonicContact OE2-NE 3.67Å; E54-R57 IonicContact OE2-NH1 3.73Å; E54-R57 PolarHBondContact OE2-NH1 3.49Å; C55-R57 VanDerWaalsContact C-N 3.32Å; C55-R57 PolarHBondContact O-N 2.96Å; R57-C59 VanDerWaalsContact C-N 3.29Å; R57-C59 PolarHBondContact O-N 3.37Å; R57-Y60 PolarHBondContact O-N 2.86Å; R57-S61 WeakPolarHBondContact O-CB 3.49Å; R57-S61 PolarHBondContact O-N 3.04Å; R57-S61 PolarHBondContact O-OG 2.96Å; R57-S61 VanDerWaalsContact O-OG 3.14Å
58	I	92.6	Very high	89.3	Confident	6 Å²	6	49.7 Å²	49.7	3%	0.031	24%	0.235	C	C	.	.	H	α-helix	trans	-56.4	-46.4	174.3	-74.9	162.2	0	0	0	110.2	R47 R48 A49 E54 C55 K62 L83	R47-I58 HydrophobicContact CB-CD1 4.29Å; R47-I58 HydrophobicContact CB-CG2 3.94Å; R47-I58 HydrophobicContact CG-CG2 3.78Å; R48-I58 WeakPolarHBondContact O-CD1 3.32Å; A49-I58 HydrophobicContact CB-CD1 4.14Å; E54-I58 HydrophobicContact CG-CD1 3.87Å; E54-I58 HydrophobicContact CG-CG1 4.27Å; E54-I58 VanDerWaalsContact O-CB 3.31Å; E54-I58 WeakPolarHBondContact O-CB 3.03Å; E54-I58 WeakPolarHBondContact O-CD1 3.07Å; E54-I58 WeakPolarHBondContact O-CG1 3.48Å; E54-I58 PolarHBondContact O-N 3.28Å; E54-I58 WeakPolarHBondContact OE1-CG1 3.09Å; C55-I58 PolarHBondContact O-N 2.8Å; I58-K62 HydrophobicContact CB-CD 4.41Å; I58-K62 HydrophobicContact CG1-CD 3.99Å; I58-K62 WeakPolarHBondContact O-CA 3.38Å; I58-K62 VanDerWaalsContact O-CB 3.28Å; I58-K62 WeakPolarHBondContact O-CB 3.45Å; I58-K62 PolarHBondContact O-N 2.04Å; I58-K62 VanDerWaalsContact O-N 3.11Å; I58-L83 HydrophobicContact CG2-CD1 4.02Å; I58-L83 HydrophobicContact CG2-CD2 4.04Å
59	C	94	Very high	89.4	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60	-59.9	176.5	-173	0	0	0	0	110.8	C55 V56 R57 S61 S63 C66 A69 L83 I112	C55-C59 WeakPolarHBondContact O-CB 3.42Å; C55-C59 PolarHBondContact O-N 3.2Å; V56-C59 PolarHBondContact O-N 2.91Å; R57-C59 VanDerWaalsContact C-N 3.29Å; R57-C59 PolarHBondContact O-N 3.37Å; C59-S61 PolarHBondContact O-N 2.9Å; C59-S63 VanDerWaalsContact O-O 3.11Å; C59-C66 WeakPolarHBondContact CA-SG 3.16Å; C59-C66 HydrophobicContact CB-CB 3.96Å; C59-C66 WeakPolarHBondContact CB-SG 3.38Å; C59-C66 WeakPolarHBondContact O-CB 3.48Å; C59-C66 WeakPolarHBondContact SG-CB 3.37Å; C59-C66 PolarHBondContact SG-O 3.24Å; C59-C66 CovalentContact SG-SG 2.03Å; C59-C66 PolarHBondContact SG-SG 3.26Å; C59-A69 HydrophobicContact CB-CB 4.39Å; C59-L83 HydrophobicContact CB-CD2 4.08Å; C59-I112 HydrophobicContact CB-CD1 3.91Å; C59-I112 WeakPolarHBondContact SG-CD1 3.36Å
60	Y	91.8	Very high	89.5	Confident	62 Å²	62	43.4 Å²	43.4	24%	0.243	21%	0.212	C	C	.	.	H	α-helix	trans	-67.3	-37.1	-172.9	-174.5	-92.5	0	0	0	115	K24 C26 F30 V56 R57 I112 C114	K24-Y60 HydrophobicContact CB-CD1 4.33Å; K24-Y60 HydrophobicContact CB-CE1 3.79Å; K24-Y60 WeakPolarHBondContact O-CD1 3.03Å; K24-Y60 WeakPolarHBondContact O-CE1 3.06Å; C26-Y60 HydrophobicContact CB-CD1 4.17Å; C26-Y60 HydrophobicContact CB-CE1 3.98Å; F30-Y60 AromaticContact CE1-CD1 3.66Å; F30-Y60 HydrophobicContact CE1-CD1 3.66Å; F30-Y60 HydrophobicContact CE1-CD2 4.3Å; F30-Y60 HydrophobicContact CE1-CE1 4.36Å; F30-Y60 AromaticContact CE1-CG 3.62Å; F30-Y60 HydrophobicContact CE1-CG 3.62Å; F30-Y60 HydrophobicContact CZ-CD1 4.14Å; F30-Y60 HydrophobicContact CZ-CG 4.35Å; V56-Y60 WeakPolarHBondContact O-CB 3.18Å; V56-Y60 PolarHBondContact O-N 3.34Å; R57-Y60 PolarHBondContact O-N 2.86Å; Y60-I112 HydrophobicContact CD2-CG2 4.02Å; Y60-I112 HydrophobicContact CG-CG2 4.45Å; Y60-C114 HydrophobicContact CE1-CB 3.91Å; Y60-C114 HydrophobicContact CE2-CB 4.15Å; Y60-C114 WeakPolarHBondContact OH-CB 3.32Å
61	S	85.9	Confident	89.6	Confident	30 Å²	30	38.3 Å²	38.3	21%	0.21	18%	0.181	C	C	.	.	H	α-helix	trans	-112.2	-5.9	-168.8	93.3	0	0	0	0	115	K24 R57 C59	K24-S61 VanDerWaalsContact O-CB 3.26Å; K24-S61 WeakPolarHBondContact O-CB 3.29Å; R57-S61 WeakPolarHBondContact O-CB 3.49Å; R57-S61 PolarHBondContact O-N 3.04Å; R57-S61 PolarHBondContact O-OG 2.96Å; R57-S61 VanDerWaalsContact O-OG 3.14Å; C59-S61 PolarHBondContact O-N 2.9Å
62	K	81	Confident	89.7	Confident	119 Å²	119	39.3 Å²	39.3	52%	0.517	18%	0.183	S	C	.	.	H	α-helix	trans	-123.4	5.9	-179.9	-46	-179.7	-163.2	168.5	0	113.1	E54 I58	E54-K62 IonicContact OE1-NZ 3.98Å; E54-K62 PolarHBondContact OE1-NZ 2.99Å; I58-K62 HydrophobicContact CB-CD 4.41Å; I58-K62 HydrophobicContact CG1-CD 3.99Å; I58-K62 WeakPolarHBondContact O-CA 3.38Å; I58-K62 VanDerWaalsContact O-CB 3.28Å; I58-K62 WeakPolarHBondContact O-CB 3.45Å; I58-K62 PolarHBondContact O-N 2.04Å; I58-K62 VanDerWaalsContact O-N 3.11Å
63	S	78.8	Confident	89.6	Confident	16 Å²	16	40.5 Å²	40.5	11%	0.112	19%	0.191	C	C	.	.			trans	-157.3	114.8	168.4	-172.6	0	0	0	0	111.8	F44 C59 F65 C66	F44-S63 WeakPolarHBondContact CE2-OG 3.5Å; F44-S63 WeakPolarHBondContact CZ-OG 3.06Å; C59-S63 VanDerWaalsContact O-O 3.11Å; S63-F65 PolarHBondContact O-N 3.49Å; S63-C66 PolarHBondContact O-N 3.15Å; S63-C66 VanDerWaalsContact O-N 3.16Å
64	D	76.7	Confident	89.5	Confident	76 Å²	76	38.7 Å²	38.7	41%	0.406	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-14.1	177	-58.2	-65.2	0	0	0	113.7	S603	D64-S603 WeakPolarHBondContact OD2-CB 3.45Å; D64-S603 PolarHBondContact OD2-OG 3.04Å
65	F	81.5	Confident	89.1	Confident	105 Å²	105	43.7 Å²	43.7	46%	0.461	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	1.4	-177.5	-48.4	-74.1	0	0	0	114	S63 F67 Y85	S63-F65 PolarHBondContact O-N 3.49Å; F65-F67 WeakPolarHBondContact O-CD2 2.99Å; F65-F67 WeakPolarHBondContact O-CE2 3.48Å; F65-F67 PolarHBondContact O-N 2.84Å; F65-Y85 HydrophobicContact CB-CD1 3.71Å; F65-Y85 HydrophobicContact CB-CE1 3.56Å; F65-Y85 HydrophobicContact CG-CE1 4.25Å; F65-Y85 WeakPolarHBondContact O-CD1 3.17Å
66	C	87.7	Confident	88.6	Confident	16 Å²	16	49 Å²	49	11%	0.108	25%	0.254	C	S	.	.			trans	-85.4	108.7	-179.6	-170.5	0	0	0	0	111.3	F44 C59 S63 S68 L83	F44-C66 HydrophobicContact CE1-CB 4.34Å; F44-C66 HydrophobicContact CZ-CB 4.03Å; C59-C66 WeakPolarHBondContact CA-SG 3.16Å; C59-C66 HydrophobicContact CB-CB 3.96Å; C59-C66 WeakPolarHBondContact CB-SG 3.38Å; C59-C66 WeakPolarHBondContact O-CB 3.48Å; C59-C66 WeakPolarHBondContact SG-CB 3.37Å; C59-C66 PolarHBondContact SG-O 3.24Å; C59-C66 CovalentContact SG-SG 2.03Å; C59-C66 PolarHBondContact SG-SG 3.26Å; S63-C66 PolarHBondContact O-N 3.15Å; S63-C66 VanDerWaalsContact O-N 3.16Å; C66-S68 PolarHBondContact SG-O 3.08Å; C66-L83 HydrophobicContact CB-CB 4.48Å; C66-L83 HydrophobicContact CB-CD1 4.5Å
67	F	87.3	Confident	88.1	Confident	112 Å²	112	50.7 Å²	50.7	49%	0.491	27%	0.272	S	S	.	.	S	Bend	trans	-103.4	-17.2	178.3	-60.5	-85.4	0	0	0	113.2	F65 S84 Y85 A87	F65-F67 WeakPolarHBondContact O-CD2 2.99Å; F65-F67 WeakPolarHBondContact O-CE2 3.48Å; F65-F67 PolarHBondContact O-N 2.84Å; F67-S84 PolarHBondContact N-O 2.83Å; F67-S84 VanDerWaalsContact N-O 3.11Å; F67-Y85 VanDerWaalsContact CD2-O 3.25Å; F67-Y85 WeakPolarHBondContact CD2-O 3.46Å; F67-A87 HydrophobicContact CB-CB 3.68Å; F67-A87 HydrophobicContact CG-CB 4.28Å
68	S	92.7	Very high	87.7	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	163.5	169.8	61.6	0	0	0	0	111.3	R41 C66 S84 Q86 V109	R41-S68 WeakPolarHBondContact CD-OG 3.09Å; R41-S68 PolarHBondContact NH1-OG 3.35Å; C66-S68 PolarHBondContact SG-O 3.08Å; S68-S84 PolarHBondContact N-O 3.45Å; S68-S84 PolarHBondContact O-N 3.01Å; S68-Q86 WeakPolarHBondContact CB-O 3.44Å; S68-Q86 PolarHBondContact N-O 3.38Å; S68-Q86 PolarHBondContact OG-O 2.67Å; S68-V109 CarbonylContact C-O 3.56Å; S68-V109 WeakPolarHBondContact CA-O 3.47Å; S68-V109 WeakPolarHBondContact CB-O 3.33Å
69	A	93.4	Very high	87.6	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	139.1	172.9	0	0	0	0	0	111.6	C59 L82 L83 V109	C59-A69 HydrophobicContact CB-CB 4.39Å; A69-L82 CarbonylContact C-O 3.55Å; A69-L82 VanDerWaalsContact CA-O 3.24Å; A69-L82 WeakPolarHBondContact CA-O 3.46Å; A69-L83 HydrophobicContact CB-CD2 3.94Å; A69-V109 PolarHBondContact N-O 2.78Å; A69-V109 WeakPolarHBondContact O-CB 3.44Å; A69-V109 PolarHBondContact O-N 3Å
70	L	94	Very high	87.6	Confident	23 Å²	23	52.3 Å²	52.3	12%	0.12	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	115.5	166.6	-179.6	69.1	0	0	0	108.7	V38 I72 C81 L82 P106 I108	V38-L70 HydrophobicContact CG1-CD1 4.21Å; V38-L70 HydrophobicContact CG1-CD2 4.38Å; V38-L70 HydrophobicContact CG2-CD1 4.09Å; L70-I72 HydrophobicContact CD2-CD1 4.03Å; L70-I72 HydrophobicContact CD2-CG1 3.98Å; L70-I72 HydrophobicContact CG-CG1 3.96Å; L70-C81 WeakPolarHBondContact O-CA 3.12Å; L70-L82 HydrophobicContact CB-CB 4.31Å; L70-L82 HydrophobicContact CD2-CD1 4.28Å; L70-L82 PolarHBondContact N-O 2.87Å; L70-L82 PolarHBondContact O-N 3.28Å; L70-P106 HydrophobicContact CD1-CB 3.94Å; L70-I108 HydrophobicContact CB-CG1 4.47Å; L70-I108 HydrophobicContact CD1-CD1 4.33Å; L70-I108 HydrophobicContact CD1-CG1 3.48Å; L70-I108 VanDerWaalsContact CD1-CG1 3.48Å
71	F	94.1	Very high	87.7	Confident	4 Å²	4	49.3 Å²	49.3	2%	0.018	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	112.8	172.5	179.5	-103	0	0	0	109.4	A49 S51 L52 C55 P73 H79 Q80 L102 P106 V107 V109	A49-F71 HydrophobicContact CB-CE2 4.43Å; S51-F71 VanDerWaalsContact C-CE2 3.44Å; S51-F71 WeakPolarHBondContact O-CE2 3.01Å; L52-F71 HydrophobicContact CB-CD1 4.47Å; L52-F71 HydrophobicContact CB-CE1 4.27Å; L52-F71 HydrophobicContact CB-CE2 4.48Å; L52-F71 HydrophobicContact CB-CZ 4.26Å; L52-F71 HydrophobicContact CD1-CB 3.68Å; L52-F71 HydrophobicContact CD1-CD1 3.77Å; L52-F71 HydrophobicContact CD1-CD2 4.17Å; L52-F71 HydrophobicContact CD1-CE1 4.4Å; L52-F71 HydrophobicContact CD1-CG 3.61Å; C55-F71 HydrophobicContact CB-CD2 3.68Å; C55-F71 HydrophobicContact CB-CE2 4.31Å; F71-P73 HydrophobicContact CE1-CB 4.2Å; F71-H79 HydrophobicContact CD2-CB 4.28Å; F71-H79 AromaticContact CE1-ND1 3.95Å; F71-H79 HydrophobicContact CE2-CB 3.41Å; F71-H79 VanDerWaalsContact CE2-CB 3.41Å; F71-H79 AromaticContact CE2-CG 3.82Å; F71-H79 HydrophobicContact CZ-CB 3.58Å; F71-H79 AromaticContact CZ-CG 3.47Å; F71-H79 VanDerWaalsContact CZ-CG 3.47Å; F71-H79 AromaticContact CZ-ND1 3.39Å; F71-H79 WeakPolarHBondContact CZ-ND1 3.44Å; F71-Q80 WeakPolarHBondContact CA-O 3.36Å; F71-L102 HydrophobicContact CE1-CD2 3.85Å; F71-L102 HydrophobicContact CZ-CD2 4.16Å; F71-P106 VanDerWaalsContact O-CA 3.3Å; F71-P106 WeakPolarHBondContact O-CA 3.47Å; F71-V107 HydrophobicContact CB-CG2 4.1Å; F71-V107 HydrophobicContact CD1-CG2 4.12Å; F71-V107 PolarHBondContact N-O 3.22Å; F71-V107 PolarHBondContact O-N 3.46Å; F71-V109 HydrophobicContact CB-CG2 4.39Å
72	I	93.1	Very high	88	Confident	48 Å²	48	49.1 Å²	49.1	25%	0.246	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	111.2	177.2	-53.6	174.3	0	0	0	107.7	L70 Q80 L82 P106	L70-I72 HydrophobicContact CD2-CD1 4.03Å; L70-I72 HydrophobicContact CD2-CG1 3.98Å; L70-I72 HydrophobicContact CG-CG1 3.96Å; I72-Q80 HydrophobicContact CB-CB 4.16Å; I72-Q80 PolarHBondContact N-O 2.89Å; I72-Q80 PolarHBondContact O-N 3.5Å; I72-L82 HydrophobicContact CD1-CD1 3.95Å; I72-L82 HydrophobicContact CD1-CG 4.32Å; I72-P106 HydrophobicContact CG1-CB 4.26Å; I72-P106 HydrophobicContact CG2-CG 4.36Å
73	P	92.1	Very high	88.6	Confident	28 Å²	28	43.6 Å²	43.6	18%	0.182	25%	0.249	C	C	.	.			trans	-71.9	139.6	-178	29.1	-34.5	0	0	0	111.9	F71 H79 S104 K105	F71-P73 HydrophobicContact CE1-CB 4.2Å; P73-H79 VanDerWaalsContact CA-ND1 3.33Å; P73-H79 WeakPolarHBondContact CA-ND1 3.46Å; P73-S104 WeakPolarHBondContact CG-O 3.32Å; P73-K105 VanDerWaalsContact CD-O 3.32Å; P73-K105 WeakPolarHBondContact CD-O 3.06Å; P73-K105 WeakPolarHBondContact CG-O 3.34Å
74	S	89.7	Confident	89.1	Confident	31 Å²	31	42.9 Å²	42.9	22%	0.217	24%	0.243	C	C	.	.			trans	-114.3	136.9	174.2	177.4	0	0	0	0	110.6	T76 G77 S78 H79	S74-T76 PolarHBondContact O-N 3.06Å; S74-T76 VanDerWaalsContact O-N 3.12Å; S74-T76 PolarHBondContact OG-N 3.19Å; S74-T76 PolarHBondContact OG-OG1 3.46Å; S74-G77 PolarHBondContact O-N 2.04Å; S74-G77 VanDerWaalsContact O-N 3.16Å; S74-S78 VanDerWaalsContact CB-O 3.26Å; S74-S78 WeakPolarHBondContact CB-O 3.28Å; S74-H79 PolarHBondContact N-ND1 2.99Å
75	P	84.1	Confident	89.5	Confident	140 Å²	140	44.3 Å²	44.3	91%	0.909	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-12.2	173.3	28.8	-36	0	0	0	113.3
76	T	83.8	Confident	89.4	Confident	111 Å²	111	43.5 Å²	43.5	68%	0.681	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	0.2	176.5	65.2	0	0	0	0	114.2	S74 S78	S74-T76 PolarHBondContact O-N 3.06Å; S74-T76 VanDerWaalsContact O-N 3.12Å; S74-T76 PolarHBondContact OG-N 3.19Å; S74-T76 PolarHBondContact OG-OG1 3.46Å; T76-S78 PolarHBondContact O-N 2.94Å
77	G	82.8	Confident	88.8	Confident	36 Å²	36	45.3 Å²	45.3	37%	0.371	26%	0.257	S	S	.	.	S	Bend	trans	72.7	-3.3	-172.8	0	0	0	0	0	114.8	S74 H79	S74-G77 PolarHBondContact O-N 2.04Å; S74-G77 VanDerWaalsContact O-N 3.16Å; G77-H79 PolarHBondContact O-CD2 3.16Å; G77-H79 PolarHBondContact O-N 2.82Å
78	S	85.1	Confident	88.2	Confident	38 Å²	38	40.5 Å²	40.5	27%	0.266	24%	0.238	S	C	.	.			trans	-92.8	68.7	170	172.9	0	0	0	0	109.6	R48 S74 T76	R48-S78 PolarHBondContact NH1-OG 2.82Å; S74-S78 VanDerWaalsContact CB-O 3.26Å; S74-S78 WeakPolarHBondContact CB-O 3.28Å; T76-S78 PolarHBondContact O-N 2.94Å
79	H	91.3	Very high	86.8	Confident	25 Å²	25	47.2 Å²	47.2	12%	0.116	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	149.7	179.2	-47.5	-102.9	0	0	0	110.5	R48 A49 F71 P73 S74 G77	R48-H79 WeakPolarHBondContact CA-O 3.41Å; A49-H79 PolarHBondContact N-O 3.14Å; A49-H79 WeakPolarHBondContact O-CB 3.32Å; A49-H79 PolarHBondContact O-CD2 3.47Å; A49-H79 PolarHBondContact O-N 2.95Å; F71-H79 HydrophobicContact CD2-CB 4.28Å; F71-H79 AromaticContact CE1-ND1 3.95Å; F71-H79 HydrophobicContact CE2-CB 3.41Å; F71-H79 VanDerWaalsContact CE2-CB 3.41Å; F71-H79 AromaticContact CE2-CG 3.82Å; F71-H79 HydrophobicContact CZ-CB 3.58Å; F71-H79 AromaticContact CZ-CG 3.47Å; F71-H79 VanDerWaalsContact CZ-CG 3.47Å; F71-H79 AromaticContact CZ-ND1 3.39Å; F71-H79 WeakPolarHBondContact CZ-ND1 3.44Å; P73-H79 VanDerWaalsContact CA-ND1 3.33Å; P73-H79 WeakPolarHBondContact CA-ND1 3.46Å; S74-H79 PolarHBondContact N-ND1 2.99Å; G77-H79 PolarHBondContact O-CD2 3.16Å; G77-H79 PolarHBondContact O-N 2.82Å
80	Q	92.7	Very high	85.4	Confident	78 Å²	78	52.5 Å²	52.5	36%	0.364	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	145.9	173.8	-54.8	-179.6	-9.4	0	0	110.2	H46 F71 I72 L82	H46-Q80 WeakPolarHBondContact NE2-CG 3.34Å; F71-Q80 WeakPolarHBondContact CA-O 3.36Å; I72-Q80 HydrophobicContact CB-CB 4.16Å; I72-Q80 PolarHBondContact N-O 2.89Å; I72-Q80 PolarHBondContact O-N 3.5Å; Q80-L82 HydrophobicContact CB-CD2 4.5Å
81	C	94.2	Very high	84.7	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	104.3	-180	-176.6	0	0	0	0	107.6	R47 A49 C55 L70	R47-C81 HydrophobicContact CB-CB 4.5Å; R47-C81 PolarHBondContact N-O 2.04Å; R47-C81 PolarHBondContact O-N 2.92Å; A49-C81 HydrophobicContact CB-CB 4.12Å; C55-C81 WeakPolarHBondContact CA-SG 3.46Å; C55-C81 HydrophobicContact CB-CB 3.71Å; C55-C81 WeakPolarHBondContact CB-SG 3.19Å; C55-C81 WeakPolarHBondContact SG-CB 3.45Å; C55-C81 CovalentContact SG-SG 2.04Å; C55-C81 PolarHBondContact SG-SG 2.89Å; L70-C81 WeakPolarHBondContact O-CA 3.12Å
82	L	92.9	Very high	83.7	Confident	26 Å²	26	57.3 Å²	57.3	14%	0.136	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	109.1	-178.3	-46	-173.8	0	0	0	109.1	T43 H46 A69 L70 I72 Q80	T43-L82 HydrophobicContact CG2-CB 3.55Å; T43-L82 HydrophobicContact CG2-CD1 4.12Å; T43-L82 HydrophobicContact CG2-CG 4.49Å; H46-L82 HydrophobicContact CB-CD2 3.73Å; H46-L82 WeakPolarHBondContact CD2-CD2 3.47Å; H46-L82 VanDerWaalsContact CG-CD2 3.46Å; A69-L82 CarbonylContact C-O 3.55Å; A69-L82 VanDerWaalsContact CA-O 3.24Å; A69-L82 WeakPolarHBondContact CA-O 3.46Å; L70-L82 HydrophobicContact CB-CB 4.31Å; L70-L82 HydrophobicContact CD2-CD1 4.28Å; L70-L82 PolarHBondContact N-O 2.87Å; L70-L82 PolarHBondContact O-N 3.28Å; I72-L82 HydrophobicContact CD1-CD1 3.95Å; I72-L82 HydrophobicContact CD1-CG 4.32Å; Q80-L82 HydrophobicContact CB-CD2 4.5Å
83	L	93.2	Very high	82.8	Confident	3 Å²	3	62.8 Å²	62.8	2%	0.016	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	138.1	-175.9	-49.9	-169.9	0	0	0	110.6	T43 F44 S45 R47 I58 C59 C66 A69	T43-L83 CarbonylContact C-O 3.58Å; T43-L83 VanDerWaalsContact CA-O 3.28Å; T43-L83 WeakPolarHBondContact CA-O 3.5Å; F44-L83 HydrophobicContact CD1-CB 4.26Å; F44-L83 VanDerWaalsContact CD1-O 3.22Å; F44-L83 WeakPolarHBondContact CD1-O 3.44Å; F44-L83 HydrophobicContact CE1-CB 3.68Å; F44-L83 HydrophobicContact CE2-CB 4.17Å; F44-L83 HydrophobicContact CE2-CD1 4.42Å; F44-L83 HydrophobicContact CZ-CB 3.62Å; F44-L83 HydrophobicContact CZ-CD1 4.21Å; F44-L83 PolarHBondContact N-O 3.24Å; S45-L83 PolarHBondContact O-N 3.34Å; R47-L83 HydrophobicContact CG-CD1 4.35Å; I58-L83 HydrophobicContact CG2-CD1 4.02Å; I58-L83 HydrophobicContact CG2-CD2 4.04Å; C59-L83 HydrophobicContact CB-CD2 4.08Å; C66-L83 HydrophobicContact CB-CB 4.48Å; C66-L83 HydrophobicContact CB-CD1 4.5Å; A69-L83 HydrophobicContact CB-CD2 3.94Å
84	S	88.7	Confident	82.1	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	144.1	-179.5	-174.3	0	0	0	0	112.7	E42 F67 S68 Q86	E42-S84 WeakPolarHBondContact O-CA 3.3Å; E42-S84 VanDerWaalsContact O-CB 3.26Å; E42-S84 WeakPolarHBondContact O-CB 3.1Å; E42-S84 PolarHBondContact O-OG 3.03Å; F67-S84 PolarHBondContact N-O 2.83Å; F67-S84 VanDerWaalsContact N-O 3.11Å; S68-S84 PolarHBondContact N-O 3.45Å; S68-S84 PolarHBondContact O-N 3.01Å; S84-Q86 PolarHBondContact O-N 3.01Å; S84-Q86 PolarHBondContact OG-N 3.45Å
85	Y	84.8	Confident	81.7	Confident	106 Å²	106	70.3 Å²	70.3	42%	0.416	37%	0.374	S	S	.	.	S	Bend	trans	-72.4	-13.1	171.7	-59.7	-57.5	0	0	0	112.8	F44 F65 F67	F44-Y85 HydrophobicContact CB-CD2 3.96Å; F44-Y85 HydrophobicContact CB-CE1 4.18Å; F44-Y85 HydrophobicContact CB-CE2 3.28Å; F44-Y85 VanDerWaalsContact CB-CZ 3.41Å; F44-Y85 AromaticContact CD1-CD1 3.57Å; F44-Y85 HydrophobicContact CD1-CD1 3.57Å; F44-Y85 AromaticContact CD1-CD2 3.9Å; F44-Y85 HydrophobicContact CD1-CD2 3.9Å; F44-Y85 AromaticContact CD1-CE1 3.53Å; F44-Y85 HydrophobicContact CD1-CE1 3.53Å; F44-Y85 AromaticContact CD1-CE2 3.87Å; F44-Y85 HydrophobicContact CD1-CE2 3.87Å; F44-Y85 AromaticContact CD1-CG 3.76Å; F44-Y85 HydrophobicContact CD1-CG 3.76Å; F44-Y85 AromaticContact CD1-CZ 3.69Å; F44-Y85 AromaticContact CD2-CE1 3.98Å; F44-Y85 HydrophobicContact CD2-CE1 3.98Å; F44-Y85 AromaticContact CD2-CZ 3.85Å; F44-Y85 AromaticContact CE1-CD1 3.73Å; F44-Y85 HydrophobicContact CE1-CD1 3.73Å; F44-Y85 AromaticContact CE1-CE1 3.81Å; F44-Y85 HydrophobicContact CE1-CE1 3.81Å; F44-Y85 HydrophobicContact CE1-CG 4.26Å; F44-Y85 HydrophobicContact CE2-CE1 4.24Å; F44-Y85 HydrophobicContact CG-CD1 4.16Å; F44-Y85 HydrophobicContact CG-CD2 4.19Å; F44-Y85 AromaticContact CG-CE1 3.64Å; F44-Y85 HydrophobicContact CG-CE1 3.64Å; F44-Y85 AromaticContact CG-CE2 3.69Å; F44-Y85 HydrophobicContact CG-CE2 3.69Å; F44-Y85 HydrophobicContact CG-CG 4.41Å; F44-Y85 AromaticContact CG-CZ 3.37Å; F44-Y85 HydrophobicContact CZ-CD1 4.43Å; F44-Y85 HydrophobicContact CZ-CE1 4.16Å; F65-Y85 HydrophobicContact CB-CD1 3.71Å; F65-Y85 HydrophobicContact CB-CE1 3.56Å; F65-Y85 HydrophobicContact CG-CE1 4.25Å; F65-Y85 WeakPolarHBondContact O-CD1 3.17Å; F67-Y85 VanDerWaalsContact CD2-O 3.25Å; F67-Y85 WeakPolarHBondContact CD2-O 3.46Å
86	Q	80.5	Confident	81.8	Confident	89 Å²	89	65.2 Å²	65.2	42%	0.416	34%	0.339	S	S	.	.			trans	-84	145.5	-175.9	-57.9	-171.4	13.9	0	0	111	R41 S68 S84	R41-Q86 HydrophobicContact CB-CB 4.18Å; R41-Q86 HydrophobicContact CB-CG 4.27Å; R41-Q86 VanDerWaalsContact CB-OE1 3.31Å; S68-Q86 WeakPolarHBondContact CB-O 3.44Å; S68-Q86 PolarHBondContact N-O 3.38Å; S68-Q86 PolarHBondContact OG-O 2.67Å; S84-Q86 PolarHBondContact O-N 3.01Å; S84-Q86 PolarHBondContact OG-N 3.45Å
87	A	74.7	Confident	81.9	Confident	53 Å²	53	62.3 Å²	62.3	44%	0.438	32%	0.323	S	S	.	.			trans	-126.7	144.7	-178.2	0	0	0	0	0	110.8	F67 Y89	F67-A87 HydrophobicContact CB-CB 3.68Å; F67-A87 HydrophobicContact CG-CB 4.28Å; A87-Y89 PolarHBondContact O-N 2.79Å
88	A	74.5	Confident	81.8	Confident	11 Å²	11	63.1 Å²	63.1	9%	0.091	32%	0.321	C	S	.	.			trans	-53.4	133.8	166.8	0	0	0	0	0	111.9	C91 R94 E110 C111	A88-C91 VanDerWaalsContact CB-SG 3.56Å; A88-C91 PolarHBondContact O-SG 3.08Å; A88-C91 VanDerWaalsContact O-SG 3.38Å; A88-R94 VanDerWaalsContact CB-NH2 3.26Å; A88-E110 VanDerWaalsContact CA-OE1 3.26Å; A88-E110 WeakPolarHBondContact CA-OE1 3.33Å; A88-E110 HydrophobicContact CB-CB 3.85Å; A88-E110 VanDerWaalsContact CB-CD 3.43Å; A88-E110 HydrophobicContact CB-CG 4.02Å; A88-E110 WeakPolarHBondContact CB-OE1 3.25Å; A88-E110 PolarHBondContact N-OE1 3.18Å; A88-E110 VanDerWaalsContact N-OE1 3.11Å; A88-C111 WeakPolarHBondContact CB-SG 3.23Å
89	Y	62.8	Low	81.3	Confident	141 Å²	141	67 Å²	67	55%	0.553	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	143.7	161.7	-90.9	-116.8	0	0	0	110.7	A87 C91 K748	A87-Y89 PolarHBondContact O-N 2.79Å; Y89-C91 PolarHBondContact O-N 3.29Å; Y89-K748 HydrophobicContact CE1-CD 4.09Å; Y89-K748 HydrophobicContact CE2-CD 4.34Å; Y89-K748 WeakPolarHBondContact OH-CD 3.01Å; Y89-K748 WeakPolarHBondContact OH-CG 3.32Å
90	M	65.2	Low	80.4	Confident	112 Å²	112	68.6 Å²	68.6	55%	0.552	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	44.7	175.6	-61.9	-164.4	171.1	0	0	115.5	S92 K93 R94	M90-S92 PolarHBondContact O-N 3.06Å; M90-K93 HydrophobicContact CB-CB 4.33Å; M90-K93 HydrophobicContact CB-CD 4.44Å; M90-K93 HydrophobicContact CB-CG 4.37Å; M90-K93 PolarHBondContact O-N 2.9Å; M90-K93 HydrophobicContact SD-CD 3.69Å; M90-R94 PolarHBondContact O-N 3.17Å
91	C	79.4	Confident	79.5	Confident	27 Å²	27	74.2 Å²	74.2	18%	0.182	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-11.6	168.7	-70.3	0	0	0	0	115.7	A88 Y89 C111 R113	A88-C91 VanDerWaalsContact CB-SG 3.56Å; A88-C91 PolarHBondContact O-SG 3.08Å; A88-C91 VanDerWaalsContact O-SG 3.38Å; Y89-C91 PolarHBondContact O-N 3.29Å; C91-C111 WeakPolarHBondContact CA-SG 3.5Å; C91-C111 HydrophobicContact CB-CB 3.55Å; C91-C111 WeakPolarHBondContact CB-SG 3.46Å; C91-C111 WeakPolarHBondContact SG-CA 3.35Å; C91-C111 WeakPolarHBondContact SG-CB 3.32Å; C91-C111 CovalentContact SG-SG 2.04Å; C91-C111 PolarHBondContact SG-SG 3.22Å; C91-R113 PolarHBondContact O-NH2 2.74Å
92	S	71.3	Confident	78.3	Confident	100 Å²	100	79 Å²	79	70%	0.699	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-14.7	168.7	47.5	0	0	0	0	114.2	M90	M90-S92 PolarHBondContact O-N 3.06Å
93	K	75.6	Confident	77.2	Confident	163 Å²	163	79.4 Å²	79.4	71%	0.709	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.3	-10.6	179.3	-59.4	-170.7	-175.5	176.7	0	114.2	M90	M90-K93 HydrophobicContact CB-CB 4.33Å; M90-K93 HydrophobicContact CB-CD 4.44Å; M90-K93 HydrophobicContact CB-CG 4.37Å; M90-K93 PolarHBondContact O-N 2.9Å; M90-K93 HydrophobicContact SD-CD 3.69Å
94	R	77.8	Confident	76.7	Confident	88 Å²	88	84.8 Å²	84.8	33%	0.332	44%	0.441	S	S	.	.	S	Bend	trans	-80.2	147.3	178.5	-61.7	-150.5	-171.6	176.9	6.2	111.6	D33 A88 M90 L96 E110	D33-R94 HydrophobicContact CB-CB 4.4Å; D33-R94 WeakPolarHBondContact OD2-CD 3.41Å; D33-R94 IonicContact OD2-CZ 2.71Å; D33-R94 IonicContact OD2-NE 3.58Å; D33-R94 IonicContact OD2-NH1 3.07Å; D33-R94 PolarHBondContact OD2-NH1 3.21Å; A88-R94 VanDerWaalsContact CB-NH2 3.26Å; M90-R94 PolarHBondContact O-N 3.17Å; R94-L96 HydrophobicContact CB-CD2 4.45Å; R94-L96 PolarHBondContact O-N 2.64Å; R94-E110 IonicContact CZ-OE2 2.87Å; R94-E110 IonicContact NH1-OE2 3.71Å; R94-E110 PolarHBondContact NH1-OE2 2.89Å; R94-E110 IonicContact NH2-OE2 3.65Å; R94-E110 PolarHBondContact NH2-OE2 2.77Å
95	Q	81	Confident	76.7	Confident	129 Å²	129	91 Å²	91	60%	0.603	47%	0.469	S	S	*	.			trans	-84.6	90.8	-176.8	-177.1	178.9	-14.4	0	0	110.5	S97 V124	Q95-S97 PolarHBondContact O-N 2.94Å; Q95-V124 HydrophobicContact CG-CG2 4.47Å
96	L	86.6	Confident	77	Confident	34 Å²	34	88.4 Å²	88.4	18%	0.178	46%	0.464	C	S	.	.			trans	-70.9	122	-175.2	-48.8	-176.5	0	0	0	111.9	H31 F32 D33 R94 C111 R113	H31-L96 HydrophobicContact CB-CB 3.88Å; H31-L96 HydrophobicContact CB-CD1 4.06Å; F32-L96 CarbonylContact O-C 3.57Å; D33-L96 HydrophobicContact CB-CD2 3.99Å; R94-L96 HydrophobicContact CB-CD2 4.45Å; R94-L96 PolarHBondContact O-N 2.64Å; L96-C111 HydrophobicContact CD2-CB 3.48Å; L96-C111 VanDerWaalsContact CD2-CB 3.48Å; L96-R113 HydrophobicContact CD1-CG 4.23Å
97	S	84.7	Confident	77.5	Confident	49 Å²	49	84.3 Å²	84.3	34%	0.343	45%	0.445	S	S	.	.	B	Isolated β-bridge	trans	-89	158.1	174.7	-64.9	0	0	0	0	111.6	H31 F32 Q95	H31-S97 WeakPolarHBondContact CA-O 3.09Å; F32-S97 PolarHBondContact N-O 3.47Å; F32-S97 PolarHBondContact O-N 2.77Å; Q95-S97 PolarHBondContact O-N 2.94Å
98	T	81.5	Confident	78.4	Confident	54 Å²	54	81.8 Å²	81.8	33%	0.331	43%	0.425	S	S	.	.	S	Bend	trans	-122.1	-12.9	178.3	57.6	0	0	0	0	113	L29 H31	L29-T98 HydrophobicContact CD2-CG2 3.75Å; H31-T98 WeakPolarHBondContact CE1-CG2 3.3Å; H31-T98 VanDerWaalsContact ND1-CG2 3.25Å; H31-T98 WeakPolarHBondContact ND1-CG2 3.47Å
99	V	74.3	Confident	79.3	Confident	120 Å²	120	81.3 Å²	81.3	73%	0.727	42%	0.42	S	S	*	.			trans	-138.4	136.5	-179.5	179.3	0	0	0	0	106.9
100	H	73	Confident	80.7	Confident	58 Å²	58	74.9 Å²	74.9	27%	0.269	40%	0.395	S	S	.	.			trans	-136.6	144.6	174.1	-179	72.7	0	0	0	111	L34 L52 L102	L34-H100 HydrophobicContact CD1-CB 3.56Å; L34-H100 WeakPolarHBondContact CD1-ND1 3.49Å; L52-H100 HydrophobicContact CD2-CB 3.9Å; H100-L102 PolarHBondContact O-N 3.11Å
101	K	72.1	Confident	81.9	Confident	195 Å²	195	70 Å²	70	85%	0.848	37%	0.372	S	S	*	.			trans	-87.6	101.3	175.4	-175.2	179.9	-178.3	-179	0	108.2	S103	K101-S103 PolarHBondContact O-N 2.91Å
102	L	69	Low	82.5	Confident	101 Å²	101	69.9 Å²	69.9	53%	0.529	37%	0.37	S	S	.	.			trans	-35.9	105.5	-177.5	-81.9	158	0	0	0	113.3	F71 H100	F71-L102 HydrophobicContact CE1-CD2 3.85Å; F71-L102 HydrophobicContact CZ-CD2 4.16Å; H100-L102 PolarHBondContact O-N 3.11Å
103	S	70.6	Confident	83.3	Confident	35 Å²	35	70.6 Å²	70.6	25%	0.245	36%	0.357	C	S	.	.			trans	-69.9	151.7	169.1	-172.1	0	0	0	0	110.7	K101 K105	K101-S103 PolarHBondContact O-N 2.91Å; S103-K105 VanDerWaalsContact C-N 3.25Å; S103-K105 PolarHBondContact OG-N 3.38Å
104	S	82.9	Confident	83.9	Confident	116 Å²	116	64.6 Å²	64.6	81%	0.811	34%	0.335	S	S	*	.	S	Bend	trans	-82.7	-3	168.3	56.5	0	0	0	0	113.1	P73	P73-S104 WeakPolarHBondContact CG-O 3.32Å
105	K	88.3	Confident	84.1	Confident	131 Å²	131	61.2 Å²	61.2	57%	0.57	32%	0.324	S	S	*	.	S	Bend	trans	-97.4	155.8	176.9	-59	179	-177.1	175.6	0	111	P73 S103	P73-K105 VanDerWaalsContact CD-O 3.32Å; P73-K105 WeakPolarHBondContact CD-O 3.06Å; P73-K105 WeakPolarHBondContact CG-O 3.34Å; S103-K105 VanDerWaalsContact C-N 3.25Å; S103-K105 PolarHBondContact OG-N 3.38Å
106	P	90.7	Very high	83.8	Confident	50 Å²	50	58 Å²	58	33%	0.325	32%	0.319	S	S	.	.			trans	-57.2	138.4	165.1	-19.9	32.1	0	0	0	111.1	V38 L70 F71 I72	V38-P106 HydrophobicContact CG2-CB 4.03Å; L70-P106 HydrophobicContact CD1-CB 3.94Å; F71-P106 VanDerWaalsContact O-CA 3.3Å; F71-P106 WeakPolarHBondContact O-CA 3.47Å; I72-P106 HydrophobicContact CG1-CB 4.26Å; I72-P106 HydrophobicContact CG2-CG 4.36Å
107	V	92.3	Very high	82.5	Confident	3 Å²	3	64 Å²	64	2%	0.018	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	138	175.8	-62.9	0	0	0	0	110.5	L34 L52 F71	L34-V107 HydrophobicContact CD2-CG2 4.25Å; L52-V107 HydrophobicContact CD1-CG2 4.18Å; F71-V107 HydrophobicContact CB-CG2 4.1Å; F71-V107 HydrophobicContact CD1-CG2 4.12Å; F71-V107 PolarHBondContact N-O 3.22Å; F71-V107 PolarHBondContact O-N 3.46Å
108	I	92.5	Very high	81.1	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.005	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	123.2	175.2	-74.4	-172.2	0	0	0	109.2	L34 S35 D39 L70 E110	L34-I108 WeakPolarHBondContact CA-O 3.46Å; S35-I108 PolarHBondContact N-O 3.1Å; S35-I108 PolarHBondContact O-N 3.1Å; D39-I108 VanDerWaalsContact OD1-CD1 3.32Å; D39-I108 WeakPolarHBondContact OD1-CD1 3.48Å; L70-I108 HydrophobicContact CB-CG1 4.47Å; L70-I108 HydrophobicContact CD1-CD1 4.33Å; L70-I108 HydrophobicContact CD1-CG1 3.48Å; L70-I108 VanDerWaalsContact CD1-CG1 3.48Å; I108-E110 HydrophobicContact CG2-CG 3.73Å
109	V	93.4	Very high	79.8	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	117.4	176.2	-172.6	0	0	0	0	108.8	F32 L34 L52 V56 S68 A69 F71 I112	F32-V109 HydrophobicContact CB-CG1 3.94Å; F32-V109 HydrophobicContact CD2-CG1 3.97Å; F32-V109 HydrophobicContact CG-CG1 4.07Å; L34-V109 HydrophobicContact CD2-CB 4.39Å; L34-V109 HydrophobicContact CD2-CG2 3.89Å; L52-V109 HydrophobicContact CD1-CG2 3.63Å; V56-V109 HydrophobicContact CG2-CG1 3.8Å; S68-V109 CarbonylContact C-O 3.56Å; S68-V109 WeakPolarHBondContact CA-O 3.47Å; S68-V109 WeakPolarHBondContact CB-O 3.33Å; A69-V109 PolarHBondContact N-O 2.78Å; A69-V109 WeakPolarHBondContact O-CB 3.44Å; A69-V109 PolarHBondContact O-N 3Å; F71-V109 HydrophobicContact CB-CG2 4.39Å; V109-I112 HydrophobicContact CG1-CD1 3.76Å; V109-I112 HydrophobicContact CG1-CG1 3.73Å
110	E	92.6	Very high	78.4	Confident	6 Å²	6	71.4 Å²	71.4	3%	0.028	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	169.2	-178.6	-80.6	-175.8	126.6	0	0	112.2	D33 R41 A88 R94 I108 I112	D33-E110 HydrophobicContact CB-CB 4.34Å; D33-E110 PolarHBondContact N-O 2.85Å; D33-E110 PolarHBondContact O-N 3.11Å; R41-E110 IonicContact CZ-OE1 2.67Å; R41-E110 VanDerWaalsContact CZ-OE1 3.22Å; R41-E110 VanDerWaalsContact NH1-CD 3.33Å; R41-E110 IonicContact NH1-OE1 3.97Å; R41-E110 PolarHBondContact NH1-OE1 2.9Å; R41-E110 IonicContact NH2-OE1 3.78Å; R41-E110 PolarHBondContact NH2-OE1 2.95Å; R41-E110 IonicContact NH2-OE2 2.64Å; A88-E110 VanDerWaalsContact CA-OE1 3.26Å; A88-E110 WeakPolarHBondContact CA-OE1 3.33Å; A88-E110 HydrophobicContact CB-CB 3.85Å; A88-E110 VanDerWaalsContact CB-CD 3.43Å; A88-E110 HydrophobicContact CB-CG 4.02Å; A88-E110 WeakPolarHBondContact CB-OE1 3.25Å; A88-E110 PolarHBondContact N-OE1 3.18Å; A88-E110 VanDerWaalsContact N-OE1 3.11Å; R94-E110 IonicContact CZ-OE2 2.87Å; R94-E110 IonicContact NH1-OE2 3.71Å; R94-E110 PolarHBondContact NH1-OE2 2.89Å; R94-E110 IonicContact NH2-OE2 3.65Å; R94-E110 PolarHBondContact NH2-OE2 2.77Å; I108-E110 HydrophobicContact CG2-CG 3.73Å; E110-I112 PolarHBondContact O-N 3.22Å
111	C	90.3	Very high	77.3	Confident	9 Å²	9	71.8 Å²	71.8	6%	0.061	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	55.8	31	169.6	-57.6	0	0	0	0	115.3	D33 A88 C91 L96 R113	D33-C111 HydrophobicContact CB-CB 4.09Å; A88-C111 WeakPolarHBondContact CB-SG 3.23Å; C91-C111 WeakPolarHBondContact CA-SG 3.5Å; C91-C111 HydrophobicContact CB-CB 3.55Å; C91-C111 WeakPolarHBondContact CB-SG 3.46Å; C91-C111 WeakPolarHBondContact SG-CA 3.35Å; C91-C111 WeakPolarHBondContact SG-CB 3.32Å; C91-C111 CovalentContact SG-SG 2.04Å; C91-C111 PolarHBondContact SG-SG 3.22Å; L96-C111 HydrophobicContact CD2-CB 3.48Å; L96-C111 VanDerWaalsContact CD2-CB 3.48Å; C111-R113 PolarHBondContact O-N 2.04Å
112	I	91.4	Very high	76	Confident	26 Å²	26	70.2 Å²	70.2	13%	0.133	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	126.8	-174.3	-58.2	164.3	0	0	0	110.3	F30 H31 F32 V56 C59 Y60 V109 E110	F30-I112 HydrophobicContact CD1-CG2 4.23Å; H31-I112 CarbonylContact O-C 3.52Å; H31-I112 WeakPolarHBondContact O-CA 3.39Å; F32-I112 HydrophobicContact CB-CG1 3.97Å; V56-I112 HydrophobicContact CG1-CG1 4.46Å; V56-I112 HydrophobicContact CG1-CG2 3.73Å; C59-I112 HydrophobicContact CB-CD1 3.91Å; C59-I112 WeakPolarHBondContact SG-CD1 3.36Å; Y60-I112 HydrophobicContact CD2-CG2 4.02Å; Y60-I112 HydrophobicContact CG-CG2 4.45Å; V109-I112 HydrophobicContact CG1-CD1 3.76Å; V109-I112 HydrophobicContact CG1-CG1 3.73Å; E110-I112 PolarHBondContact O-N 3.22Å
113	R	88.3	Confident	74.5	Confident	114 Å²	114	70.9 Å²	70.9	43%	0.43	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	147.7	175.1	-65.6	-178.4	-177.1	172.7	0.5	110.1	F30 H31 C91 L96 C111	F30-R113 WeakPolarHBondContact CA-O 3.45Å; H31-R113 HydrophobicContact CB-CB 4.47Å; H31-R113 PolarHBondContact N-O 2.03Å; H31-R113 PolarHBondContact O-N 2.83Å; C91-R113 PolarHBondContact O-NH2 2.74Å; L96-R113 HydrophobicContact CD1-CG 4.23Å; C111-R113 PolarHBondContact O-N 2.04Å
114	C	89.1	Confident	72.9	Confident	37 Å²	37	73.9 Å²	73.9	25%	0.25	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	135.5	159.7	-173.3	0	0	0	0	108.9	C26 Y60	C26-C114 WeakPolarHBondContact CA-SG 3.21Å; C26-C114 HydrophobicContact CB-CB 3.66Å; C26-C114 WeakPolarHBondContact CB-SG 3Å; C26-C114 WeakPolarHBondContact SG-CB 3.37Å; C26-C114 CovalentContact SG-SG 2.03Å; C26-C114 PolarHBondContact SG-SG 2.87Å; Y60-C114 HydrophobicContact CE1-CB 3.91Å; Y60-C114 HydrophobicContact CE2-CB 4.15Å; Y60-C114 WeakPolarHBondContact OH-CB 3.32Å
115	T	82.8	Confident	70.5	Confident	17 Å²	17	72.8 Å²	72.8	10%	0.104	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	145.3	167.2	50.5	0	0	0	0	109.5	G28 L29 H31 V121	G28-T115 CarbonylContact C-O 3.59Å; G28-T115 VanDerWaalsContact CA-O 3.23Å; G28-T115 WeakPolarHBondContact CA-O 3.48Å; L29-T115 PolarHBondContact N-O 3.46Å; L29-T115 PolarHBondContact O-N 3.29Å; L29-T115 PolarHBondContact O-OG1 3.38Å; H31-T115 VanDerWaalsContact CD2-CG2 3.41Å; H31-T115 WeakPolarHBondContact CD2-CG2 3.45Å; H31-T115 PolarHBondContact CD2-OG1 2.03Å; H31-T115 PolarHBondContact NE2-OG1 2.84Å; H31-T115 VanDerWaalsContact NE2-OG1 3.12Å; T115-V121 HydrophobicContact CG2-CG2 3.56Å
116	A	73.1	Confident	67.8	Low	61 Å²	61	71.7 Å²	71.7	50%	0.504	42%	0.422	S	S	.	.			trans	-73.3	154.5	173.2	0	0	0	0	0	110.5	G118 D119	A116-G118 VanDerWaalsContact C-N 3.3Å; A116-G118 PolarHBondContact O-N 3.17Å; A116-D119 VanDerWaalsContact CB-OD2 3.31Å; A116-D119 WeakPolarHBondContact CB-OD2 3.21Å; A116-D119 PolarHBondContact N-OD2 3.47Å; A116-D119 PolarHBondContact O-N 2.9Å; A116-D119 VanDerWaalsContact O-N 3.09Å
117	L	59.4	Low	65.3	Low	162 Å²	162	75.3 Å²	75.3	85%	0.848	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	89.6	171.3	-90.2	151.2	0	0	0	110.1	K27	K27-L117 WeakPolarHBondContact O-CD1 3.46Å
118	G	54.9	Low	62.6	Low	71 Å²	71	84.2 Å²	84.2	73%	0.732	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	146.1	-23.1	-177	0	0	0	0	0	113.9	A116 K120	A116-G118 VanDerWaalsContact C-N 3.3Å; A116-G118 PolarHBondContact O-N 3.17Å; G118-K120 PolarHBondContact O-N 2.76Å
119	D	54.5	Low	59.8	Low	99 Å²	99	87.6 Å²	87.6	53%	0.529	52%	0.522	S	S	.	.			trans	-71.4	118.7	-177.8	-67.6	-34.7	0	0	0	111.7	A116 V121	A116-D119 VanDerWaalsContact CB-OD2 3.31Å; A116-D119 WeakPolarHBondContact CB-OD2 3.21Å; A116-D119 PolarHBondContact N-OD2 3.47Å; A116-D119 PolarHBondContact O-N 2.9Å; A116-D119 VanDerWaalsContact O-N 3.09Å; D119-V121 VanDerWaalsContact C-N 3.3Å; D119-V121 PolarHBondContact O-N 3.04Å
120	K	45	Very low	57	Low	208 Å²	208	96.8 Å²	96.8	90%	0.904	57%	0.565	S	S	*	*			trans	-77.5	75.2	176.2	-70.2	-173.6	178.5	-179.7	0	111.8	G118	G118-K120 PolarHBondContact O-N 2.76Å
121	V	50.9	Low	54.1	Low	65 Å²	65	100.1 Å²	100.1	39%	0.394	59%	0.594	S	S	.	*			trans	-68.5	137.1	154.8	175.7	0	0	0	0	108.5	T115 D119 S123	T115-V121 HydrophobicContact CG2-CG2 3.56Å; D119-V121 VanDerWaalsContact C-N 3.3Å; D119-V121 PolarHBondContact O-N 3.04Å; V121-S123 PolarHBondContact O-N 3.16Å
122	L	43.9	Very low	51.4	Low	162 Å²	162	110 Å²	110	85%	0.848	64%	0.636	S	S	*	*			trans	-64	100.8	177.1	-72.5	167.5	0	0	0	109.8	V124	L122-V124 PolarHBondContact O-N 3.39Å
123	S	37.9	Very low	48.7	Very low	116 Å²	116	115.3 Å²	115.3	81%	0.811	66%	0.664	S	S	*	*			trans	-72.5	103.1	174.1	40	0	0	0	0	109.4	V121	V121-S123 PolarHBondContact O-N 3.16Å
124	V	37.5	Very low	46.2	Very low	98 Å²	98	117.6 Å²	117.6	59%	0.594	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-78.5	122.4	169.8	-167.8	0	0	0	0	107.4	Q95 L122	Q95-V124 HydrophobicContact CG-CG2 4.47Å; L122-V124 PolarHBondContact O-N 3.39Å
125	S	31.4	Very low	43.6	Very low	92 Å²	92	122.3 Å²	122.3	64%	0.643	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-58.2	148.5	170.1	45.4	0	0	0	0	110.3
126	P	32.3	Very low	41.2	Very low	109 Å²	109	125 Å²	125	71%	0.708	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-52.7	143.4	169	-22.1	33	0	0	0	109.8	E128	P126-E128 PolarHBondContact O-N 3.09Å; P126-E128 VanDerWaalsContact O-N 3.07Å
127	P	37.7	Very low	39.1	Very low	126 Å²	126	129.2 Å²	129.2	82%	0.818	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-60.2	116.9	170.9	25.6	-32.5	0	0	0	108.4	G129	P127-G129 PolarHBondContact O-N 3.16Å
128	E	36.5	Very low	37.8	Very low	189 Å²	189	128.1 Å²	128.1	88%	0.883	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-61.5	121.3	168.2	-64.6	-170.6	139.8	0	0	107.1	P126 E130	P126-E128 PolarHBondContact O-N 3.09Å; P126-E128 VanDerWaalsContact O-N 3.07Å; E128-E130 PolarHBondContact O-N 2.78Å
129	G	32.6	Very low	36.7	Very low	72 Å²	72	131.1 Å²	131.1	74%	0.742	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-66.4	118.6	-165.2	0	0	0	0	0	112.1	P127 A131	P127-G129 PolarHBondContact O-N 3.16Å; G129-A131 PolarHBondContact O-N 2.84Å
130	E	35.1	Very low	35.8	Very low	193 Å²	193	131.7 Å²	131.7	90%	0.902	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-58.9	123.1	169.1	-69.5	-167.3	135.8	0	0	109.6	E128 F132	E128-E130 PolarHBondContact O-N 2.78Å; E130-F132 PolarHBondContact O-N 2.86Å
131	A	31.2	Very low	35.3	Very low	77 Å²	77	128.3 Å²	128.3	64%	0.636	74%	0.743	S	S	*	*			trans	-81.2	113.5	-170.1	0	0	0	0	0	111.3	G129 L133	G129-A131 PolarHBondContact O-N 2.84Å; A131-L133 VanDerWaalsContact C-N 3.32Å; A131-L133 HydrophobicContact CB-CD1 3.89Å; A131-L133 PolarHBondContact O-N 2.81Å
132	F	34.1	Very low	34.4	Very low	216 Å²	216	128.6 Å²	128.6	95%	0.947	76%	0.76	S	S	*	*			trans	-69.1	94.4	153.4	-93.7	-91.6	0	0	0	108.9	E130	E130-F132 PolarHBondContact O-N 2.86Å
133	L	34.3	Very low	33.9	Very low	138 Å²	138	124.2 Å²	124.2	72%	0.723	75%	0.753	S	S	*	*			trans	-64.9	138.4	161.8	-91.9	72.7	0	0	0	109.3	A131	A131-L133 VanDerWaalsContact C-N 3.32Å; A131-L133 HydrophobicContact CB-CD1 3.89Å; A131-L133 PolarHBondContact O-N 2.81Å
134	Q	35.9	Very low	33.8	Very low	162 Å²	162	126.7 Å²	126.7	76%	0.757	75%	0.754	S	S	*	*				-165.5	142.7	100.5	-103.2	-176.2	-94	0	0	113.4
135	D	34.5	Very low	33.6	Very low	135 Å²	135	131.4 Å²	131.4	72%	0.722	77%	0.767	S	S	*	*			trans	55.4	121.3	149.7	-51.2	-27.5	0	0	0	120.5
136	G	32.5	Very low	33.5	Very low	73 Å²	73	133 Å²	133	75%	0.753	77%	0.773	S	S	*	*			trans	171.3	-13.5	178.3	0	0	0	0	0	118.2
137	L	29.3	Very low	33.6	Very low	150 Å²	150	137.1 Å²	137.1	79%	0.785	78%	0.783	S	S	*	*			trans	36.2	139.4	154.7	-81.6	165.5	0	0	0	122.7
138	I	32.5	Very low	33.4	Very low	139 Å²	139	138.7 Å²	138.7	71%	0.713	78%	0.777	S	S	*	*			trans	73.4	126.9	153.4	-66.3	160.6	0	0	0	114.2
139	N	31.9	Very low	33.1	Very low	134 Å²	134	136.3 Å²	136.3	72%	0.717	77%	0.769	S	S	*	*			cis	-168.5	-176.6	5.4	-115.2	12.1	0	0	0	107.4
140	V	34.3	Very low	33.3	Very low	112 Å²	112	140.4 Å²	140.4	68%	0.679	77%	0.769	S	S	*	*			cis	-178	152.1	-32.4	130.7	0	0	0	0	104.8
141	T	34.6	Very low	33	Very low	136 Å²	136	137 Å²	137	83%	0.834	76%	0.761	S	S	*	*			cis	-108.8	-147.2	6.1	-17.2	0	0	0	0	109.2
142	G	32.4	Very low	33.3	Very low	72 Å²	72	141 Å²	141	74%	0.742	77%	0.77	S	S	*	*			cis	117.4	142.8	-2.2	0	0	0	0	0	114.4
143	G	34.1	Very low	33.4	Very low	69 Å²	69	136.8 Å²	136.8	71%	0.711	76%	0.763	S	S	*	*			cis	177.6	-179.4	-0.5	0	0	0	0	0	115.9
144	M	35	Very low	33.5	Very low	169 Å²	169	136 Å²	136	83%	0.833	77%	0.765	S	S	*	*			trans	60.9	122.9	172.9	-49.3	-172.4	80.3	0	0	115.9
145	F	33	Very low	33.7	Very low	196 Å²	196	135.3 Å²	135.3	86%	0.86	77%	0.767	S	S	*	*				-146.3	158.3	57.3	-113	-98.6	0	0	0	113.8
146	T	29.2	Very low	33.8	Very low	126 Å²	126	136.6 Å²	136.6	77%	0.773	77%	0.771	S	S	*	*			trans	-137.1	136.9	-175.5	53.3	0	0	0	0	112.6
147	Q	35	Very low	34.1	Very low	195 Å²	195	142.8 Å²	142.8	91%	0.911	78%	0.777	S	S	*	*			trans	168.3	152	149.5	-97.9	177.9	13.3	0	0	108.8
148	K	33.3	Very low	34.1	Very low	160 Å²	160	143.2 Å²	143.2	70%	0.696	78%	0.779	S	S	*	*			cis	-158.6	140	-34.1	-176.1	-162.8	160	-158.9	0	105.9	E150	K148-E150 IonicContact NZ-OE1 2.65Å; K148-E150 PolarHBondContact NZ-OE1 2.83Å
149	I	29.7	Very low	34.3	Very low	138 Å²	138	145.2 Å²	145.2	71%	0.708	79%	0.786	S	S	*	*			trans	-75.8	142.7	175.4	-60.8	163.6	0	0	0	110.5
150	E	37.6	Very low	34.6	Very low	158 Å²	158	145.1 Å²	145.1	74%	0.738	79%	0.79	S	S	*	*			trans	-147.1	125.7	151	-124.1	153.6	-115.6	0	0	109.5	K148	K148-E150 IonicContact NZ-OE1 2.65Å; K148-E150 PolarHBondContact NZ-OE1 2.83Å
151	T	29.2	Very low	34.7	Very low	122 Å²	122	147.5 Å²	147.5	75%	0.748	79%	0.794	S	S	*	*			trans	-129.6	119.4	-170.6	-58.6	0	0	0	0	108.7
152	I	36.2	Very low	35.1	Very low	160 Å²	160	146.9 Å²	146.9	82%	0.821	79%	0.792	S	S	*	*			trans	-133.8	146.6	170.9	-61.2	-175	0	0	0	109.8
153	T	38	Very low	35.2	Very low	129 Å²	129	147.7 Å²	147.7	79%	0.791	78%	0.784	S	S	*	*			trans	-67.3	164.9	-162.3	26.9	0	0	0	0	117.3
154	P	36.3	Very low	34.9	Very low	120 Å²	120	153.7 Å²	153.7	78%	0.779	79%	0.791	S	S	*	*			trans	-89.5	166.5	179.3	38.2	-36.5	0	0	0	113
155	D	38.8	Very low	34.9	Very low	149 Å²	149	153.4 Å²	153.4	80%	0.797	79%	0.788	S	S	*	*			trans	-152.1	165.6	160.1	-140.5	-24.3	0	0	0	113.9
156	M	36.8	Very low	34.6	Very low	161 Å²	161	150.5 Å²	150.5	79%	0.793	79%	0.786	S	S	*	*			trans	-45.7	143.4	-172	-59	179.9	-179.6	0	0	116
157	K	38.8	Very low	34.7	Very low	203 Å²	203	154.3 Å²	154.3	88%	0.883	79%	0.786	S	S	*	*				-169	169.8	73.6	-124.3	154	-168.1	175.7	0	115
158	L	29.6	Very low	34.5	Very low	160 Å²	160	150.6 Å²	150.6	84%	0.838	78%	0.779	S	S	*	*			trans	-101.3	130.1	-179.3	175.7	80.9	0	0	0	111.1
159	E	37.2	Very low	34.5	Very low	181 Å²	181	153 Å²	153	85%	0.846	79%	0.785	S	S	*	*			trans	-165.3	121.8	154.6	-117.2	166.2	-149.2	0	0	113.8
160	T	38.6	Very low	34.7	Very low	132 Å²	132	152.4 Å²	152.4	81%	0.81	79%	0.788	S	S	*	*			trans	51.7	130.2	143	-38.3	0	0	0	0	122.6
161	E	35.1	Very low	34.5	Very low	162 Å²	162	154.3 Å²	154.3	76%	0.757	79%	0.794	S	S	*	*			trans	-65.7	166.2	167.7	-60.8	-165.4	133.6	0	0	114.6
162	P	42.6	Very low	34.7	Very low	122 Å²	122	155 Å²	155	79%	0.792	80%	0.798	S	S	*	*				-136.6	163.1	100.4	33.5	-19.9	0	0	0	115.3
163	P	35.5	Very low	34.7	Very low	90 Å²	90	152 Å²	152	58%	0.584	80%	0.797	S	S	*	*			trans	-95.1	-168	-164.9	38.8	-39.6	0	0	0	115.9
164	F	28.7	Very low	34.6	Very low	195 Å²	195	153.3 Å²	153.3	86%	0.855	80%	0.798	S	S	*	*			trans	77	151.7	-171.6	-57.2	-85.5	0	0	0	113.7
165	Q	33	Very low	34.6	Very low	163 Å²	163	156.6 Å²	156.6	76%	0.762	80%	0.803	S	S	*	*			cis	-147.7	148.4	17	-164.5	173.1	61.8	0	0	111.9
166	T	27.1	Very low	34.7	Very low	135 Å²	135	157.1 Å²	157.1	83%	0.828	81%	0.805	S	S	*	*			trans	-74.4	139.1	177.8	39.2	0	0	0	0	113.3
167	R	32.7	Very low	34.7	Very low	206 Å²	206	152.5 Å²	152.5	78%	0.777	80%	0.798	S	S	*	*			trans	-140.3	128.3	163.8	-75.5	-170	174.4	-164.6	-1.5	110.7
168	P	31	Very low	34.7	Very low	117 Å²	117	148.7 Å²	148.7	76%	0.76	79%	0.792	S	S	*	*			trans	-88.2	135.8	174.6	33.8	-31.6	0	0	0	111.1
169	Y	31.8	Very low	35.1	Very low	210 Å²	210	150.1 Å²	150.1	82%	0.824	79%	0.792	S	S	*	*			trans	-135.8	101	165.1	-94.8	-78	0	0	0	113.2
170	T	34.5	Very low	35	Very low	125 Å²	125	147.1 Å²	147.1	77%	0.767	79%	0.786	S	S	*	*			trans	2.4	140.7	147.9	-41.3	0	0	0	0	119.4
171	K	33	Very low	34.9	Very low	198 Å²	198	144.6 Å²	144.6	86%	0.861	78%	0.778	S	S	*	*			trans	-48.1	140.4	168.4	-62.7	-179	180	-178.2	0	112.9
172	V	33.8	Very low	35	Very low	137 Å²	137	144.1 Å²	144.1	83%	0.83	78%	0.776	S	S	*	*			trans	-84.2	131.4	156.7	177.6	0	0	0	0	108.6	I174	V172-I174 HydrophobicContact CG1-CG1 4.42Å
173	A	36.7	Very low	34.7	Very low	97 Å²	97	145.6 Å²	145.6	80%	0.802	77%	0.773	S	S	*	*			trans	-134.2	137.3	165.8	0	0	0	0	0	107.8
174	I	36	Very low	34.7	Very low	157 Å²	157	149 Å²	149	81%	0.805	78%	0.781	S	S	*	*			trans	-103.3	119.1	-173.8	-59.7	173.9	0	0	0	109.2	V172	V172-I174 HydrophobicContact CG1-CG1 4.42Å
175	Q	36.5	Very low	34.9	Very low	189 Å²	189	146 Å²	146	88%	0.883	77%	0.773	S	S	*	*			trans	-149.7	117.8	162.1	-86.6	-168.8	-28.6	0	0	109.7
176	D	40.2	Very low	35.1	Very low	160 Å²	160	146 Å²	146	86%	0.856	77%	0.773	S	S	*	*			trans	-69.2	139.6	141.5	-72.3	-62.9	0	0	0	106.7
177	G	36.5	Very low	35.5	Very low	63 Å²	63	143.6 Å²	143.6	65%	0.649	76%	0.762	S	S	*	*				107	126.6	60.5	0	0	0	0	0	107.2
178	T	37.7	Very low	35.5	Very low	123 Å²	123	142.5 Å²	142.5	76%	0.755	77%	0.768	S	S	*	*			cis	-162.4	150.4	11.3	-1.9	0	0	0	0	110.4
179	K	38.3	Very low	35.7	Very low	191 Å²	191	140 Å²	140	83%	0.83	76%	0.757	S	S	*	*			trans	42.4	141.8	136.6	-69.9	175.9	-178.1	175.9	0	120.4
180	T	35.6	Very low	35.7	Very low	117 Å²	117	137 Å²	137	72%	0.718	76%	0.761	S	S	*	*			cis	-173.4	148	8.8	-100.5	0	0	0	0	110.1
181	A	37.2	Very low	35.8	Very low	79 Å²	79	134.8 Å²	134.8	65%	0.653	75%	0.75	S	S	*	*			trans	62.1	158.3	159	0	0	0	0	0	118.4
182	E	36.9	Very low	36.1	Very low	153 Å²	153	133.5 Å²	133.5	72%	0.715	75%	0.747	S	S	*	*			cis	-156.1	171	-19.1	-116.9	179.1	109.7	0	0	108.8
183	Q	36.7	Very low	36.2	Very low	153 Å²	153	134.7 Å²	134.7	72%	0.715	74%	0.744	S	S	*	*			trans	38	144.4	149	-64	175.8	33.4	0	0	120.9
184	Q	35.5	Very low	36.2	Very low	161 Å²	161	137.1 Å²	137.1	75%	0.752	74%	0.738	S	S	*	*			cis	171.2	142.7	-17.8	-138.4	178.6	-14.4	0	0	104.9
185	L	32.8	Very low	36.2	Very low	131 Å²	131	134.7 Å²	134.7	69%	0.686	73%	0.73	S	S	*	*			trans	72.6	148.9	144.7	-141	66.7	0	0	0	121.3
186	E	36.9	Very low	36.1	Very low	163 Å²	163	130.9 Å²	130.9	76%	0.762	72%	0.72	S	S	*	*			trans	61.1	157.7	159	-80.5	149.4	-158.7	0	0	120.8
187	S	34.4	Very low	35.9	Very low	85 Å²	85	129.1 Å²	129.1	59%	0.594	72%	0.716	S	S	*	*				-176.1	147.4	-50.5	55.1	0	0	0	0	109.3
188	M	34.3	Very low	35.8	Very low	183 Å²	183	129.8 Å²	129.8	90%	0.901	72%	0.722	S	S	*	*			trans	64.5	161.5	158.2	-67.6	169.7	72.9	0	0	116.1
189	A	34.4	Very low	35.8	Very low	66 Å²	66	130.5 Å²	130.5	55%	0.545	72%	0.722	S	S	.	*			cis	-167.5	163.5	-29	0	0	0	0	0	109.5
190	T	32.5	Very low	35.4	Very low	146 Å²	146	127.7 Å²	127.7	90%	0.896	72%	0.72	S	S	*	*			trans	64	166.4	155.4	50.5	0	0	0	0	117
191	S	36.7	Very low	35.3	Very low	78 Å²	78	128.5 Å²	128.5	55%	0.545	73%	0.725	S	S	.	*			cis	-147.6	169	5.3	69.2	0	0	0	0	113
192	E	38.7	Very low	35.1	Very low	172 Å²	172	132.1 Å²	132.1	80%	0.804	73%	0.73	S	S	*	*			trans	55.3	163.3	141.5	-71.6	137.8	-168.9	0	0	120.7
193	E	36.5	Very low	34.9	Very low	162 Å²	162	134.6 Å²	134.6	76%	0.757	74%	0.738	S	S	*	*			cis	-157.9	169.8	-9.8	-112.3	-124.2	123.6	0	0	106
194	H	35.5	Very low	34.7	Very low	148 Å²	148	133.2 Å²	133.2	69%	0.685	74%	0.736	S	S	*	*			cis	-174.1	-163.6	-37.2	-174.4	36.4	0	0	0	107.3
195	V	35.8	Very low	34.6	Very low	105 Å²	105	136.7 Å²	136.7	64%	0.636	74%	0.744	S	S	*	*			trans	67.2	131.8	158.9	170.9	0	0	0	0	118.4
196	T	35.6	Very low	34.7	Very low	109 Å²	109	134.4 Å²	134.4	67%	0.669	75%	0.752	S	S	*	*			cis	-162.4	143.3	-16.2	30.3	0	0	0	0	111.1
197	T	36.1	Very low	34.5	Very low	124 Å²	124	132.6 Å²	132.6	76%	0.761	76%	0.757	S	S	*	*				41.5	136.7	127.6	-38.3	0	0	0	0	122.6
198	G	34.4	Very low	34.4	Very low	76 Å²	76	134 Å²	134	78%	0.784	77%	0.767	S	S	*	*			trans	-178.3	35.8	173.8	0	0	0	0	0	120.8
199	D	36.3	Very low	34.2	Very low	139 Å²	139	131.4 Å²	131.4	74%	0.743	76%	0.762	S	S	*	*			trans	24.2	124.4	159.3	-60	-16.5	0	0	0	125.2
200	V	31.6	Very low	34.3	Very low	132 Å²	132	132.8 Å²	132.8	80%	0.8	77%	0.773	S	S	*	*				52.4	126.5	123.4	-173.7	0	0	0	0	121.9
201	V	33.7	Very low	34.4	Very low	134 Å²	134	134.3 Å²	134.3	81%	0.812	77%	0.77	S	S	*	*				-175.5	143	123	144.5	0	0	0	0	110.9
202	M	31.2	Very low	34.3	Very low	154 Å²	154	137.8 Å²	137.8	76%	0.759	78%	0.782	S	S	*	*			trans	-93.2	166.7	171.8	-57.5	-165.6	-55.4	0	0	111.9
203	F	33.7	Very low	34.1	Very low	205 Å²	205	135.8 Å²	135.8	90%	0.899	78%	0.781	S	S	*	*				-165.9	168.3	128.4	-99.3	-60.1	0	0	0	112.7
204	N	31.7	Very low	33.8	Very low	125 Å²	125	133.2 Å²	133.2	67%	0.668	78%	0.781	S	S	*	*			trans	-118.1	174.9	-167.8	-83.9	-24.9	0	0	0	113.4
205	Y	34.2	Very low	34.1	Very low	233 Å²	233	132.2 Å²	132.2	91%	0.914	79%	0.788	S	S	*	*			trans	80.8	142.4	157.3	-68.8	-74.3	0	0	0	119.9
206	G	34.3	Very low	33.9	Very low	83 Å²	83	132.4 Å²	132.4	86%	0.856	79%	0.794	S	S	*	*			trans	160	102.2	161.5	0	0	0	0	0	114.3
207	S	32.1	Very low	34.1	Very low	125 Å²	125	132.8 Å²	132.8	87%	0.874	80%	0.796	S	S	*	*			trans	-130.6	139.9	167.6	173.4	0	0	0	0	109.7
208	S	33.8	Very low	34.1	Very low	114 Å²	114	133.9 Å²	133.9	80%	0.797	80%	0.797	S	S	*	*			trans	-167.1	165.4	160.6	-150.9	0	0	0	0	112.9
209	T	30.1	Very low	34.1	Very low	130 Å²	130	135 Å²	135	80%	0.798	79%	0.792	S	S	*	*			trans	-124.8	151.3	-175.4	49.4	0	0	0	0	112.6
210	A	36.7	Very low	34	Very low	95 Å²	95	135.2 Å²	135.2	79%	0.785	79%	0.792	S	S	*	*			trans	-163.6	132.6	152.9	0	0	0	0	0	108.3
211	H	32.9	Very low	34.2	Very low	177 Å²	177	137.6 Å²	137.6	82%	0.819	80%	0.795	S	S	*	*			cis	86	146.4	45.1	-104.7	-75.1	0	0	0	116.4
212	L	35.1	Very low	34	Very low	152 Å²	152	138.3 Å²	138.3	80%	0.796	79%	0.794	S	S	*	*			trans	82	140.3	176.4	-47.4	173.6	0	0	0	114.9
213	T	34.7	Very low	34.2	Very low	130 Å²	130	139.4 Å²	139.4	80%	0.798	80%	0.801	S	S	*	*			cis	-161.1	155.3	-10.6	10	0	0	0	0	110.2
214	S	29.7	Very low	34.2	Very low	107 Å²	107	136.5 Å²	136.5	75%	0.748	79%	0.79	S	S	*	*			trans	-92.9	169.9	166.4	58	0	0	0	0	112.4
215	P	43	Very low	34.4	Very low	128 Å²	128	139 Å²	139	83%	0.831	79%	0.792	S	S	*	*				-143.6	178.2	104.5	40	-26.2	0	0	0	115
216	S	30.8	Very low	34.4	Very low	108 Å²	108	133.8 Å²	133.8	76%	0.755	78%	0.784	S	S	*	*			trans	-101.7	-179.4	179.4	51.1	0	0	0	0	113.3
217	V	40.3	Very low	34.2	Very low	118 Å²	118	138 Å²	138	72%	0.715	78%	0.782	S	S	*	*				159.2	118.4	127.4	160.9	0	0	0	0	113.5
218	D	36.3	Very low	34.3	Very low	147 Å²	147	138.6 Å²	138.6	79%	0.786	78%	0.78	S	S	*	*			trans	62.4	141.9	144	-61.2	-0.2	0	0	0	128.2
219	S	33.7	Very low	34.1	Very low	98 Å²	98	139 Å²	139	69%	0.685	78%	0.778	S	S	*	*			trans	98.6	93.3	137.8	-72.4	0	0	0	0	123.1
220	I	33.7	Very low	34.3	Very low	144 Å²	144	139 Å²	139	74%	0.738	78%	0.778	S	S	*	*				47.7	118.2	108.2	-58	159.7	0	0	0	117.9
221	Q	36.6	Very low	33.9	Very low	183 Å²	183	143.8 Å²	143.8	86%	0.855	78%	0.781	S	S	*	*				-174.3	161.1	94.7	-149.2	146.8	53.4	0	0	113.4
222	N	30.4	Very low	34	Very low	149 Å²	149	143.1 Å²	143.1	80%	0.797	78%	0.782	S	S	*	*			trans	-83.2	163.2	-179.9	-56.2	-14.1	0	0	0	113
223	I	35.4	Very low	33.9	Very low	177 Å²	177	142 Å²	142	91%	0.908	78%	0.781	S	S	*	*			trans	-168	161	130.1	-99.7	153.6	0	0	0	110.9
224	E	33.3	Very low	34.1	Very low	144 Å²	144	141.6 Å²	141.6	67%	0.673	78%	0.78	S	S	*	*			trans	-121.7	-176.2	-163.3	-178.5	177.7	-145.6	0	0	111.3
225	Y	35.8	Very low	34.3	Very low	177 Å²	177	144.2 Å²	144.2	69%	0.694	78%	0.784	S	S	*	*			trans	106.7	95.1	158	-69.2	-81.1	0	0	0	122.9
226	T	34.4	Very low	33.8	Very low	124 Å²	124	144.7 Å²	144.7	76%	0.761	78%	0.779	S	S	*	*				78	157.4	122.6	51.4	0	0	0	0	125
227	E	30	Very low	34	Very low	171 Å²	171	146.6 Å²	146.6	80%	0.799	78%	0.776	S	S	*	*			trans	-74.1	159.4	-174.8	-46.5	157.9	98.6	0	0	115.5
228	V	33.6	Very low	33.8	Very low	138 Å²	138	148.7 Å²	148.7	84%	0.836	78%	0.778	S	S	*	*			trans	-144.4	141.8	144.8	-177.8	0	0	0	0	109.7
229	T	30.1	Very low	33.8	Very low	123 Å²	123	148 Å²	148	76%	0.755	77%	0.774	S	S	*	*			trans	-129.3	132.3	175.1	-63.2	0	0	0	0	111.6
230	T	34.2	Very low	33.9	Very low	130 Å²	130	150.9 Å²	150.9	80%	0.798	78%	0.777	S	S	*	*			trans	-155.2	155.4	169.8	-4.3	0	0	0	0	114.3
231	K	28.3	Very low	34.1	Very low	195 Å²	195	149.7 Å²	149.7	85%	0.848	78%	0.776	S	S	*	*			trans	-130	141.4	-179.4	-55.5	173.3	-179.9	177.1	0	111.7
232	I	34.7	Very low	34	Very low	163 Å²	163	145.2 Å²	145.2	84%	0.836	77%	0.77	S	S	*	*			trans	-149.3	104	159.9	-58.5	-174	0	0	0	107.3
233	V	33.6	Very low	34.2	Very low	129 Å²	129	142.7 Å²	142.7	78%	0.782	76%	0.764	S	S	*	*				67.2	121.2	95	-179.3	0	0	0	0	115.9
234	P	38	Very low	34.1	Very low	121 Å²	121	140.2 Å²	140.2	79%	0.786	76%	0.757	S	S	*	*			trans	-106.2	177.4	179.1	41.6	-35.6	0	0	0	114.8
235	I	33.2	Very low	34.2	Very low	162 Å²	162	139.4 Å²	139.4	83%	0.831	77%	0.765	S	S	*	*			trans	-140.1	136.7	176.7	-54.1	-178.6	0	0	0	113.1
236	L	33.8	Very low	34.1	Very low	137 Å²	137	138 Å²	138	72%	0.717	78%	0.775	S	S	*	*			trans	-19	163.6	149	-99.7	68.6	0	0	0	119.3
237	E	34.3	Very low	34	Very low	149 Å²	149	137 Å²	137	70%	0.696	78%	0.779	S	S	*	*			cis	-168	-167.2	-1	-151.1	167.9	-136.1	0	0	110.6
238	Q	37.1	Very low	34.2	Very low	161 Å²	161	138.3 Å²	138.3	75%	0.752	79%	0.785	S	S	*	*			trans	80.6	119.8	163.2	-70.9	169.7	31.6	0	0	117.2
239	N	35.7	Very low	34.2	Very low	134 Å²	134	138.1 Å²	138.1	72%	0.717	79%	0.785	S	S	*	*				87.4	141.1	64.6	-81.2	54	0	0	0	112.5
240	E	35.7	Very low	34.4	Very low	158 Å²	158	139.3 Å²	139.3	74%	0.738	79%	0.792	S	S	*	*			cis	-174	179	-8.3	-171.2	-175.2	159.5	0	0	109.2
241	V	38	Very low	34.2	Very low	119 Å²	119	138.5 Å²	138.5	72%	0.721	79%	0.791	S	S	*	*			trans	86.2	118.2	155.4	-172.6	0	0	0	0	120.8
242	A	35.3	Very low	34.5	Very low	89 Å²	89	137.7 Å²	137.7	74%	0.736	79%	0.791	S	S	*	*			trans	65.9	156.9	148.1	0	0	0	0	0	122
243	S	34.1	Very low	34.3	Very low	96 Å²	96	140.7 Å²	140.7	67%	0.671	79%	0.791	S	S	*	*			cis	-170.2	171.3	-31.8	60.5	0	0	0	0	111
244	T	32.7	Very low	34.3	Very low	124 Å²	124	145.8 Å²	145.8	76%	0.761	80%	0.797	S	S	*	*			trans	61.1	118.4	159.3	49.3	0	0	0	0	119.8
245	P	35.2	Very low	33.9	Very low	128 Å²	128	151 Å²	151	83%	0.831	80%	0.801	S	S	*	*			trans	-99.8	149	163	37.2	-30.3	0	0	0	112.8
246	T	34.8	Very low	33.8	Very low	148 Å²	148	148.6 Å²	148.6	91%	0.908	80%	0.798	S	S	*	*			trans	-146.4	149.7	164.8	22.3	0	0	0	0	109.3
247	A	32.5	Very low	33.6	Very low	101 Å²	101	147.3 Å²	147.3	84%	0.835	80%	0.796	S	S	*	*			trans	-91.1	146.6	-171.7	0	0	0	0	0	113.1
248	E	34.2	Very low	33.4	Very low	199 Å²	199	146.7 Å²	146.7	93%	0.93	80%	0.796	S	S	*	*			trans	-126.4	136.5	157.8	-72.8	-162	136.2	0	0	110.5
249	T	31.9	Very low	33.3	Very low	135 Å²	135	148.3 Å²	148.3	83%	0.828	80%	0.804	S	S	*	*			trans	-84.3	143.4	174	47.8	0	0	0	0	111.3
250	T	35.1	Very low	33.3	Very low	147 Å²	147	150 Å²	150	90%	0.902	81%	0.805	S	S	*	*			trans	-153.7	149.7	143.9	11.3	0	0	0	0	109.5
251	S	31.2	Very low	33	Very low	113 Å²	113	150.5 Å²	150.5	79%	0.79	81%	0.812	S	S	*	*			trans	-106.9	149.2	167.8	63.6	0	0	0	0	108.9
252	E	34.1	Very low	32.7	Very low	179 Å²	179	151.1 Å²	151.1	84%	0.836	81%	0.81	S	S	*	*			trans	-147.4	166.8	156.4	-128.3	-173.6	-131.8	0	0	112.3
253	R	30.9	Very low	32.6	Very low	225 Å²	225	153.3 Å²	153.3	85%	0.849	81%	0.814	S	S	*	*			trans	-154.1	87.3	-148	175.3	-129.9	-165.4	164.9	6.2	111.3
254	W	32.3	Very low	32.4	Very low	236 Å²	236	153.4 Å²	153.4	89%	0.894	81%	0.811	S	S	*	*			trans	-132.9	153.7	175.1	-79.4	103	0	0	0	113.8
255	R	30.8	Very low	32.4	Very low	231 Å²	231	156.6 Å²	156.6	87%	0.872	82%	0.815	S	S	*	*			trans	-109	150.1	176.3	-70.9	177	167.7	176.6	-5.1	109.8
256	S	29.6	Very low	32.4	Very low	111 Å²	111	156.3 Å²	156.3	78%	0.776	81%	0.812	S	S	*	*			trans	80.7	148	142.5	-160.5	0	0	0	0	119.9
257	T	30.3	Very low	32.3	Very low	110 Å²	110	155.2 Å²	155.2	68%	0.675	81%	0.806	S	S	*	*			trans	101.5	91.8	143.9	-45	0	0	0	0	119.7
258	I	30.5	Very low	32.4	Very low	136 Å²	136	160 Å²	160	70%	0.697	81%	0.811	S	S	*	*			trans	54.3	113.1	134.1	-50.7	170.2	0	0	0	120.1	K260	I258-K260 HydrophobicContact CG2-CG 4.16Å
259	E	35	Very low	32.3	Very low	195 Å²	195	155.9 Å²	155.9	91%	0.911	80%	0.8	S	S	*	*				-129.6	121.3	124	-66.8	-165	121.9	0	0	107.2
260	K	34.4	Very low	32.6	Very low	171 Å²	171	157.2 Å²	157.2	74%	0.743	80%	0.801	S	S	*	*				68.8	90.5	66.7	-88.4	-168	172.9	-178.2	0	115.3	I258	I258-K260 HydrophobicContact CG2-CG 4.16Å
261	L	29.3	Very low	32.7	Very low	168 Å²	168	157.3 Å²	157.3	88%	0.88	80%	0.797	S	S	*	*			trans	-133.8	108.4	147.9	-115.5	163.1	0	0	0	107.6
262	L	31.6	Very low	32.9	Very low	131 Å²	131	159.3 Å²	159.3	69%	0.686	80%	0.797	S	S	*	*			trans	-101.1	139.6	171.9	-95	75.1	0	0	0	108.9
263	V	34.2	Very low	33	Very low	136 Å²	136	161.6 Å²	161.6	82%	0.824	80%	0.798	S	S	*	*			trans	-111.9	133.4	155.1	178.9	0	0	0	0	106.5
264	T	29.8	Very low	33.2	Very low	97 Å²	97	154.9 Å²	154.9	60%	0.595	79%	0.785	S	S	*	*			trans	-126.8	126.2	-165.9	-54.6	0	0	0	0	110.9
265	F	32.7	Very low	33.1	Very low	192 Å²	192	149 Å²	149	84%	0.842	78%	0.775	S	S	*	*			trans	-137.9	155.2	160.2	-75.5	-66.5	0	0	0	109.9
266	P	35.8	Very low	33.4	Very low	121 Å²	121	144.6 Å²	144.6	79%	0.786	77%	0.769	S	S	*	*			trans	-98.1	161.1	-136.7	35.9	-37.9	0	0	0	116.5
267	T	31.2	Very low	33.6	Very low	126 Å²	126	146.2 Å²	146.2	77%	0.773	76%	0.764	S	S	*	*			trans	-85.5	153.4	173.2	49.8	0	0	0	0	113.2
268	Q	35.2	Very low	33.9	Very low	202 Å²	202	148.1 Å²	148.1	94%	0.944	77%	0.769	S	S	*	*			trans	-119	157.1	140.9	-100.9	-176.2	-2.7	0	0	109.8
269	T	32.8	Very low	34	Very low	112 Å²	112	146.8 Å²	146.8	69%	0.687	77%	0.772	S	S	*	*			trans	-121.9	159.9	-162.8	47.1	0	0	0	0	111.9
270	D	37.9	Very low	33.9	Very low	162 Å²	162	143.5 Å²	143.5	87%	0.866	77%	0.765	S	S	*	*				-156.8	151.8	128.6	-94	-29.8	0	0	0	110.6
271	D	36.6	Very low	34.1	Very low	150 Å²	150	145.3 Å²	145.3	80%	0.802	78%	0.776	S	S	*	*			trans	-79.2	173.5	-174.9	-77.7	-66.1	0	0	0	112.6
272	I	36.4	Very low	34.4	Very low	155 Å²	155	140.4 Å²	140.4	80%	0.795	77%	0.766	S	S	*	*				-174.9	123.1	65.3	-76.3	176.1	0	0	0	105.3
273	R	35.1	Very low	34.6	Very low	227 Å²	227	143.3 Å²	143.3	86%	0.857	78%	0.776	S	S	*	*				67.3	139.1	74.8	-169.3	177.4	-173	170.4	3.4	113.7
274	S	34.8	Very low	34.6	Very low	83 Å²	83	147 Å²	147	58%	0.58	78%	0.776	S	S	*	*			cis	-145	152.6	5.2	-117.3	0	0	0	0	109
275	T	32	Very low	34.9	Very low	112 Å²	112	149.9 Å²	149.9	69%	0.687	79%	0.786	S	S	*	*				78.9	115.7	70.2	-44.6	0	0	0	0	116.5
276	D	36.9	Very low	35.1	Very low	139 Å²	139	144.2 Å²	144.2	74%	0.743	78%	0.775	S	S	*	*			trans	175.5	168.7	139.3	-96.7	-18.3	0	0	0	111.1
277	Q	33.4	Very low	34.9	Very low	145 Å²	145	144.1 Å²	144.1	68%	0.678	77%	0.773	S	S	*	*				-162	163.2	-62.5	-131.3	-173	109.4	0	0	111.4
278	I	36.7	Very low	35	Very low	150 Å²	150	146 Å²	146	77%	0.769	77%	0.772	S	S	*	*			trans	71.2	145.7	160.5	-62	154.8	0	0	0	115.3
279	S	33.5	Very low	34.8	Very low	108 Å²	108	143.6 Å²	143.6	76%	0.755	77%	0.765	S	S	*	*			cis	-141.4	-179.4	7	-154.3	0	0	0	0	113.3
280	T	31.6	Very low	34.8	Very low	127 Å²	127	144.1 Å²	144.1	78%	0.779	77%	0.768	S	S	*	*			trans	-138.4	138.2	-179.4	52.2	0	0	0	0	114.4
281	E	39.1	Very low	34.9	Very low	209 Å²	209	141.7 Å²	141.7	98%	0.977	76%	0.761	S	S	*	*			trans	-171.5	150.9	157	-109.5	171.7	164.8	0	0	109.5
282	G	35.5	Very low	34.7	Very low	65 Å²	65	143.6 Å²	143.6	67%	0.67	77%	0.765	S	S	*	*			cis	174.7	143.7	-12.2	0	0	0	0	0	114
283	Q	36	Very low	34.5	Very low	191 Å²	191	140.8 Å²	140.8	89%	0.893	77%	0.765	S	S	*	*			trans	64.8	169.5	158.6	-59.2	-173	12.2	0	0	120.4
284	R	34.9	Very low	34.4	Very low	215 Å²	215	134 Å²	134	81%	0.811	76%	0.758	S	S	*	*			cis	-171.2	167.7	-49.6	-154.7	179.1	-172.9	-173.4	2.3	109.7
285	L	36.3	Very low	34.2	Very low	156 Å²	156	136.4 Å²	136.4	82%	0.817	77%	0.77	S	S	*	*			trans	79.2	152.4	164.8	-58.2	127.1	0	0	0	117.9
286	A	35.4	Very low	34.2	Very low	73 Å²	73	136.2 Å²	136.2	60%	0.603	77%	0.768	S	S	*	*			cis	-174.9	148.2	-26.8	0	0	0	0	0	112.8
287	T	32.2	Very low	33.8	Very low	120 Å²	120	136.3 Å²	136.3	74%	0.736	76%	0.764	S	S	*	*			trans	64.3	155.3	147	-51.9	0	0	0	0	117.2
288	E	32.7	Very low	33.8	Very low	164 Å²	164	135.6 Å²	135.6	77%	0.766	76%	0.76	S	S	*	*			cis	-140.8	151.1	13.4	-136.6	147.3	132.8	0	0	107
289	L	31.7	Very low	33.5	Very low	153 Å²	153	135.5 Å²	135.5	80%	0.801	76%	0.758	S	S	*	*			cis	59.6	138.8	49.7	-62.1	174.8	0	0	0	112.7
290	T	32.7	Very low	33.4	Very low	122 Å²	122	135.5 Å²	135.5	75%	0.748	76%	0.758	S	S	*	*			cis	-155.8	161.1	23.4	-46.2	0	0	0	0	111.4
291	P	39.7	Very low	33.4	Very low	111 Å²	111	134.3 Å²	134.3	72%	0.721	76%	0.755	S	S	*	*			trans	-114.6	158.6	174	40	-31.7	0	0	0	116.5
292	E	33.1	Very low	33	Very low	190 Å²	190	130.9 Å²	130.9	89%	0.888	75%	0.749	S	S	*	*			trans	-141.4	149.8	161.7	-72.5	-175.3	107.7	0	0	108.9
293	A	31.5	Very low	32.7	Very low	96 Å²	96	132.7 Å²	132.7	79%	0.793	75%	0.752	S	S	*	*			cis	106	92.2	10.9	0	0	0	0	0	116.5
294	A	33.9	Very low	32.4	Very low	85 Å²	85	132.8 Å²	132.8	70%	0.702	75%	0.749	S	S	*	*			trans	-171.1	128.1	157.5	0	0	0	0	0	107.8
295	T	30.3	Very low	32.3	Very low	134 Å²	134	130.2 Å²	130.2	82%	0.822	75%	0.746	S	S	*	*				63.2	139.9	66.8	62.2	0	0	0	0	113.4
296	V	30.6	Very low	31.9	Very low	107 Å²	107	132.8 Å²	132.8	65%	0.648	75%	0.751	S	S	*	*			cis	-164.2	149.9	18.3	90.9	0	0	0	0	113.4
297	Q	29.9	Very low	31.8	Very low	141 Å²	141	135.2 Å²	135.2	66%	0.659	76%	0.761	S	S	*	*			trans	56.7	163.5	152.8	-71.2	162.6	-82.8	0	0	119.9
298	E	31.9	Very low	31.6	Very low	130 Å²	130	138.8 Å²	138.8	61%	0.607	77%	0.766	S	S	*	*			cis	-161.8	167.7	-3.9	-121.6	162.9	-179.9	0	0	113.4
299	M	31.3	Very low	31.6	Very low	148 Å²	148	137.4 Å²	137.4	73%	0.729	77%	0.769	S	S	*	*			trans	40.7	142.9	148.8	-64.7	179	-60.9	0	0	120.8
300	S	32.1	Very low	31.5	Very low	108 Å²	108	135.8 Å²	135.8	76%	0.755	77%	0.766	S	S	*	*			cis	-153.6	151.4	23.4	-41.2	0	0	0	0	108.5
301	S	30.3	Very low	31.3	Very low	102 Å²	102	136.1 Å²	136.1	71%	0.713	77%	0.767	S	S	*	*			cis	91.5	78.3	21.6	83.2	0	0	0	0	118
302	T	30.9	Very low	30.9	Very low	138 Å²	138	137.3 Å²	137.3	85%	0.847	77%	0.772	S	S	*	*			trans	-155.9	122	152.8	44.4	0	0	0	0	107.6
303	S	28.5	Very low	30.6	Very low	103 Å²	103	133.1 Å²	133.1	72%	0.72	76%	0.764	S	S	*	*			cis	81.9	105.7	27.4	-164.2	0	0	0	0	116.2
304	F	30.5	Very low	30.7	Very low	192 Å²	192	137.2 Å²	137.2	84%	0.842	77%	0.767	S	S	*	*			trans	-171.4	92.8	151	-102.8	-74.2	0	0	0	106.5
305	E	32.4	Very low	30.4	Very low	161 Å²	161	140 Å²	140	75%	0.752	77%	0.769	S	S	*	*				82.5	125.1	86	-77.1	-164.6	143.7	0	0	115.8
306	F	27.8	Very low	30.5	Very low	210 Å²	210	139.1 Å²	139.1	92%	0.921	77%	0.768	S	S	*	*			trans	-106.1	136.9	169.1	-83.3	-95.4	0	0	0	110.6
307	P	34	Very low	30.5	Very low	125 Å²	125	139.3 Å²	139.3	81%	0.812	77%	0.769	S	S	*	*			trans	-92.7	146.9	165.5	34.4	-30.9	0	0	0	112.9
308	K	27.9	Very low	30.6	Very low	194 Å²	194	140.7 Å²	140.7	84%	0.843	78%	0.78	S	S	*	*			trans	-100.9	139	172.4	-57.7	169.7	-179	173.2	0	111
309	T	31.9	Very low	30.7	Very low	135 Å²	135	139.1 Å²	139.1	83%	0.828	78%	0.783	S	S	*	*			trans	-161.6	128.2	145.2	28.2	0	0	0	0	107.5
310	T	30.6	Very low	30.9	Very low	119 Å²	119	137.5 Å²	137.5	73%	0.73	79%	0.787	S	S	*	*			cis	89.1	96.4	45.3	-57.7	0	0	0	0	113.3
311	V	27.8	Very low	31.1	Very low	129 Å²	129	140.4 Å²	140.4	78%	0.782	79%	0.79	S	S	*	*			trans	41.3	124.1	139	-173.2	0	0	0	0	120.1
312	V	31.2	Very low	31.3	Very low	136 Å²	136	141 Å²	141	82%	0.824	79%	0.79	S	S	*	*				-169.9	160	125.8	139.5	0	0	0	0	109.8
313	S	27.7	Very low	31.5	Very low	102 Å²	102	139.9 Å²	139.9	71%	0.713	78%	0.783	S	S	*	*			trans	-129.1	140.1	-178	-52.9	0	0	0	0	112.6
314	E	32.4	Very low	31.8	Very low	183 Å²	183	140.5 Å²	140.5	86%	0.855	78%	0.783	S	S	*	*			trans	-164.7	126.2	161.3	-103.8	159.1	-150.8	0	0	105.5
315	I	29.4	Very low	32	Very low	144 Å²	144	140.8 Å²	140.8	74%	0.738	78%	0.784	S	S	*	*			cis	76.5	91.1	44.5	-53.2	175.3	0	0	0	113.8
316	S	32.2	Very low	32.3	Very low	114 Å²	114	137.7 Å²	137.7	80%	0.797	78%	0.778	S	S	*	*			trans	-177.5	126.9	143.8	-77.6	0	0	0	0	107.8
317	T	29.3	Very low	32.8	Very low	111 Å²	111	135.1 Å²	135.1	68%	0.681	77%	0.768	S	S	*	*			cis	76.1	96.9	34.6	74	0	0	0	0	116.3
318	L	33.4	Very low	33	Very low	171 Å²	171	137 Å²	137	90%	0.895	77%	0.766	S	S	*	*			trans	-175.9	165.9	139.6	-125	65.4	0	0	0	110.6
319	S	32.9	Very low	33.5	Very low	96 Å²	96	131.2 Å²	131.2	67%	0.671	76%	0.761	S	S	*	*				-179.6	130.1	-79.7	-82	0	0	0	0	111.3
320	S	35.3	Very low	33.8	Very low	114 Å²	114	132 Å²	132	80%	0.797	76%	0.76	S	S	*	*			trans	-158.8	112.6	152.7	44.5	0	0	0	0	108.4
321	M	36.7	Very low	34.4	Very low	169 Å²	169	132.4 Å²	132.4	83%	0.833	76%	0.762	S	S	*	*				74.7	137.2	69.4	-70.2	-174.7	-179.1	0	0	112.4
322	T	35.3	Very low	34.9	Very low	115 Å²	115	130.2 Å²	130.2	71%	0.706	75%	0.753	S	S	*	*			cis	-170.3	151.1	15.1	11.7	0	0	0	0	108.7
323	T	34.7	Very low	35.2	Very low	115 Å²	115	130.5 Å²	130.5	71%	0.706	75%	0.749	S	S	*	*			cis	-164.7	147.8	-6.5	0.9	0	0	0	0	113.3
324	T	34.2	Very low	35.6	Very low	116 Å²	116	135.7 Å²	135.7	71%	0.712	75%	0.752	S	S	*	*			trans	21.7	126.1	144.9	51.5	0	0	0	0	124.8
325	K	34.6	Very low	35.8	Very low	197 Å²	197	133.1 Å²	133.1	86%	0.857	74%	0.74	S	S	*	*				59.6	164.9	119.2	-72.8	-167	171	-172.6	0	121.8
326	P	39.8	Very low	36.2	Very low	97 Å²	97	134.1 Å²	134.1	63%	0.63	74%	0.742	S	S	*	*			cis	-147.2	-165.2	-44.1	45.6	-27.8	0	0	0	114
327	H	37.3	Very low	36.5	Very low	156 Å²	156	136 Å²	136	72%	0.722	74%	0.743	S	S	*	*			trans	65.9	155.2	163	-82.8	-114.1	0	0	0	116.8
328	E	38.9	Very low	37.4	Very low	164 Å²	164	136.3 Å²	136.3	77%	0.766	75%	0.747	S	S	*	*			cis	-170.5	144.3	-17	169.9	167.6	-136.3	0	0	110.6
329	G	38.1	Very low	38.1	Very low	72 Å²	72	133.2 Å²	133.2	74%	0.742	74%	0.737	S	S	*	*			trans	77.7	160.7	167.4	0	0	0	0	0	118
330	D	38.8	Very low	38.5	Very low	151 Å²	151	133.9 Å²	133.9	81%	0.807	74%	0.738	S	S	*	*			cis	-164.8	160.8	-18.7	-156.9	1.1	0	0	0	111.1
331	V	41.7	Very low	38.7	Very low	128 Å²	128	136.2 Å²	136.2	78%	0.776	74%	0.741	S	S	*	*			trans	61.4	145.2	157.9	158.3	0	0	0	0	119.5
332	S	38.2	Very low	38.8	Very low	84 Å²	84	131.9 Å²	131.9	59%	0.587	74%	0.739	S	S	*	*			cis	-173.1	139.1	-25.9	-168.2	0	0	0	0	110.9
333	I	37.6	Very low	39	Very low	142 Å²	142	135.9 Å²	135.9	73%	0.728	75%	0.75	S	S	*	*			trans	36.4	127.4	138.4	-54.8	171.3	0	0	0	117.8
334	R	35.9	Very low	39.5	Very low	210 Å²	210	135.6 Å²	135.6	79%	0.792	75%	0.75	S	S	*	*				-176	145.2	78.2	-151	148.4	-173.9	164.6	2.4	116
335	Q	37.2	Very low	39.5	Very low	129 Å²	129	137.9 Å²	137.9	60%	0.603	76%	0.757	S	S	*	*			trans	11.2	157.9	142.7	-49.8	170.6	-64.5	0	0	120.4
336	Q	38.2	Very low	39.5	Very low	165 Å²	165	134.3 Å²	134.3	77%	0.771	75%	0.752	S	S	*	*			cis	-161.3	-179.7	28.1	-145	145.8	3.7	0	0	112.9
337	N	38.3	Very low	39.3	Very low	153 Å²	153	136 Å²	136	82%	0.818	76%	0.761	S	S	*	*			trans	-95.2	-153.1	-170.2	-57	-19.9	0	0	0	113.9
338	P	48	Very low	39.2	Very low	119 Å²	119	134.3 Å²	134.3	77%	0.773	76%	0.761	S	S	*	*				-123.3	-139.8	-120.7	41.2	-17.5	0	0	0	110.8
339	P	48.9	Very low	39	Very low	106 Å²	106	134.6 Å²	134.6	69%	0.688	77%	0.767	S	S	*	*			cis	-135.1	-164.1	-18.1	29.2	-3.6	0	0	0	114.6
340	T	41	Very low	38.8	Very low	110 Å²	110	136.2 Å²	136.2	68%	0.675	76%	0.762	S	S	*	*			trans	101.1	125	142.9	-52.4	0	0	0	0	120.3
341	D	39.7	Very low	38.8	Very low	163 Å²	163	136 Å²	136	87%	0.872	77%	0.767	S	S	*	*			trans	49.6	145.1	156.8	-61.1	-23.5	0	0	0	124
342	G	39	Very low	38.5	Very low	77 Å²	77	136.9 Å²	136.9	79%	0.794	77%	0.767	S	S	*	*			trans	151.1	105.8	164	0	0	0	0	0	114.3
343	Q	39.6	Very low	38.8	Very low	199 Å²	199	139.9 Å²	139.9	93%	0.93	78%	0.781	S	S	*	*			trans	-77.4	159.4	176.1	-95.4	-175.5	-38.5	0	0	113.5
344	P	43.8	Very low	38.7	Very low	110 Å²	110	139.1 Å²	139.1	71%	0.714	78%	0.783	S	S	*	*			trans	-100.9	164.7	-164.8	39.1	-36.7	0	0	0	115
345	L	35.7	Very low	39.2	Very low	163 Å²	163	134 Å²	134	85%	0.853	78%	0.778	S	S	*	*			trans	-157.1	126.3	142.4	-139.7	73.8	0	0	0	114.7
346	V	34.9	Very low	39.4	Very low	123 Å²	123	134.6 Å²	134.6	75%	0.745	79%	0.79	S	S	*	*			trans	14.8	128.3	143.6	-176.4	0	0	0	0	119.8
347	T	34.3	Very low	39.6	Very low	133 Å²	133	130.5 Å²	130.5	82%	0.816	79%	0.792	S	S	*	*				-172.4	147.5	114.4	-70.1	0	0	0	0	111.5
348	V	35.1	Very low	39.7	Very low	119 Å²	119	134.1 Å²	134.1	72%	0.721	79%	0.794	S	S	*	*			trans	-102.2	147.2	-176.1	173	0	0	0	0	111.7
349	L	35.3	Very low	39.3	Very low	170 Å²	170	135 Å²	135	89%	0.89	79%	0.789	S	S	*	*			trans	-161.8	150.7	143.6	-111.8	155.3	0	0	0	112.6
350	T	34	Very low	38.7	Very low	106 Å²	106	135 Å²	135	65%	0.65	79%	0.787	S	S	*	*			trans	-119	164	-170.3	49	0	0	0	0	112.3
351	T	39	Very low	38.5	Very low	148 Å²	148	135.4 Å²	135.4	91%	0.908	79%	0.789	S	S	*	*			trans	-168.6	137.6	145.5	3.3	0	0	0	0	112.6
352	D	34.8	Very low	38.4	Very low	146 Å²	146	136.2 Å²	136.2	78%	0.781	79%	0.788	S	S	*	*			trans	-93.7	151.7	179.4	-53.9	-91.4	0	0	0	113.8
353	V	44.3	Very low	38.2	Very low	146 Å²	146	136.5 Å²	136.5	89%	0.885	78%	0.782	S	S	*	*			trans	-146.2	116.7	148.7	-174.5	0	0	0	0	111.6
354	T	35.5	Very low	38	Very low	126 Å²	126	133.8 Å²	133.8	77%	0.773	78%	0.779	S	S	*	*			trans	-105	166.9	155.2	-0	0	0	0	0	108.2
355	P	46.1	Very low	37.5	Very low	104 Å²	104	133.8 Å²	133.8	68%	0.675	78%	0.782	S	S	*	*				-164.8	-177.9	64.4	41.5	-16.7	0	0	0	120.7
356	T	41.6	Very low	37.6	Very low	141 Å²	141	134.9 Å²	134.9	87%	0.865	78%	0.78	S	S	*	*			trans	70.8	131.9	146.1	41.3	0	0	0	0	124
357	G	42.4	Very low	37.6	Very low	79 Å²	79	135 Å²	135	81%	0.814	78%	0.776	S	S	*	*			trans	-179.5	80.7	164.7	0	0	0	0	0	116.8
358	R	40.3	Very low	37.7	Very low	228 Å²	228	134.4 Å²	134.4	86%	0.86	77%	0.772	S	S	*	*			trans	-42	158.7	167.3	-92.2	178.6	147.8	144.7	-3.2	115.6
359	Q	39.9	Very low	37.5	Very low	139 Å²	139	134.6 Å²	134.6	65%	0.65	77%	0.773	S	S	*	*			cis	-173.5	167.5	-8.5	-129.4	-175.7	-102.6	0	0	107.5
360	T	36.9	Very low	37.7	Very low	106 Å²	106	131.1 Å²	131.1	65%	0.65	76%	0.761	S	S	*	*			cis	-129.6	-121.8	-2.8	-33.5	0	0	0	0	109.7
361	T	37.4	Very low	37.7	Very low	117 Å²	117	135.2 Å²	135.2	72%	0.718	77%	0.77	S	S	*	*			cis	-154.2	-159.6	-0.2	-29	0	0	0	0	110.3
362	E	35.7	Very low	37.4	Very low	181 Å²	181	132.7 Å²	132.7	85%	0.846	76%	0.759	S	S	*	*			trans	-60.6	154.9	178.9	-69.3	161.9	140.7	0	0	115.8
363	A	36	Very low	37.4	Very low	82 Å²	82	132.5 Å²	132.5	68%	0.678	76%	0.763	S	S	*	*			cis	-163.2	161.2	-14.2	0	0	0	0	0	111.8
364	T	35.1	Very low	37.1	Very low	142 Å²	142	134.5 Å²	134.5	87%	0.871	76%	0.763	S	S	*	*			trans	72.6	121.4	173.1	-8.4	0	0	0	0	117.2
365	S	34.2	Very low	37.1	Very low	110 Å²	110	135.4 Å²	135.4	77%	0.769	77%	0.768	S	S	*	*			trans	-75.6	155.9	-177.4	-32.8	0	0	0	0	112.1
366	K	37.2	Very low	36.8	Very low	186 Å²	186	136.4 Å²	136.4	81%	0.809	77%	0.773	S	S	*	*			cis	64.4	156.5	26.4	-77.1	-156.8	173.5	-176.3	0	116.3
367	L	33.8	Very low	36.4	Very low	127 Å²	127	136.7 Å²	136.7	67%	0.665	76%	0.764	S	S	*	*			cis	175.9	118.2	-30.2	174	68.5	0	0	0	107.4
368	T	37	Very low	36	Very low	120 Å²	120	137.2 Å²	137.2	74%	0.736	76%	0.756	S	S	*	*			trans	64.5	161.8	153.4	-52.1	0	0	0	0	119.7
369	T	32	Very low	35.9	Very low	122 Å²	122	133.6 Å²	133.6	75%	0.748	75%	0.753	S	S	*	*			trans	-71	-167.6	169.3	58.2	0	0	0	0	111.2
370	P	38.8	Very low	35.9	Very low	98 Å²	98	135.4 Å²	135.4	64%	0.636	76%	0.762	S	S	*	*			cis	-143.5	-174.1	3.1	43.8	-24.2	0	0	0	118
371	F	34.1	Very low	35.8	Very low	191 Å²	191	135.1 Å²	135.1	84%	0.838	77%	0.77	S	S	*	*			trans	74.8	128.4	146.8	-86.1	-62.2	0	0	0	123.7
372	S	31.8	Very low	36.1	Very low	96 Å²	96	139.4 Å²	139.4	67%	0.671	78%	0.779	S	S	*	*			trans	49.2	117.4	144.4	-62.1	0	0	0	0	121.7
373	T	36.3	Very low	36.5	Very low	142 Å²	142	139.2 Å²	139.2	87%	0.871	78%	0.776	S	S	*	*				-160.6	166.5	93.7	10.6	0	0	0	0	111.5
374	E	36.7	Very low	36.5	Very low	187 Å²	187	142 Å²	142	87%	0.874	78%	0.778	S	S	*	*			trans	-80.6	142.7	-169.7	-60.6	163	112	0	0	113.2
375	T	36.8	Very low	36.8	Very low	145 Å²	145	143.5 Å²	143.5	89%	0.89	78%	0.775	S	S	*	*			trans	-154.5	156.8	151.4	-24.8	0	0	0	0	110.5
376	T	38	Very low	37.2	Very low	125 Å²	125	145.9 Å²	145.9	77%	0.767	78%	0.78	S	S	*	*			trans	-93.7	152.4	-161.8	46.3	0	0	0	0	116
377	E	34.9	Very low	37.4	Very low	147 Å²	147	143.2 Å²	143.2	69%	0.687	77%	0.773	S	S	*	*			trans	63.2	120.7	154.4	-69	-163.4	114.5	0	0	121.6	K862	E377-K862 IonicContact OE1-NZ 2.59Å; E377-K862 PolarHBondContact OE1-NZ 3.35Å
378	S	33.2	Very low	37.7	Very low	91 Å²	91	145 Å²	145	64%	0.636	78%	0.782	S	S	*	*			trans	82	154.7	141.1	-125.9	0	0	0	0	122.1	Q380	S378-Q380 PolarHBondContact O-N 3.48Å
379	D	37.3	Very low	37.8	Very low	152 Å²	152	147.2 Å²	147.2	81%	0.813	79%	0.786	S	S	*	*	S	Bend	trans	72.2	6.7	150.7	-63.3	11.3	0	0	0	121.7
380	Q	40.8	Very low	38	Very low	176 Å²	176	149 Å²	149	82%	0.822	79%	0.791	S	S	*	*			trans	-121.5	-10.6	175.4	-64.8	-156.9	9	0	0	118.6	S378 K382	S378-Q380 PolarHBondContact O-N 3.48Å; Q380-K382 PolarHBondContact O-N 2.93Å
381	A	35	Very low	38.2	Very low	101 Å²	101	153.1 Å²	153.1	84%	0.835	80%	0.802	S	S	*	*	S	Bend	trans	-66.5	-20	-177.8	0	0	0	0	0	114.7	K383	A381-K383 PolarHBondContact O-N 3.05Å
382	K	44.1	Very low	38.4	Very low	207 Å²	207	153.3 Å²	153.3	90%	0.9	81%	0.807	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	27.9	-170.8	-136	176.6	-170.9	-179.7	0	114.8	Q380	Q380-K382 PolarHBondContact O-N 2.93Å
383	K	42.6	Very low	38.8	Very low	177 Å²	177	157.6 Å²	157.6	77%	0.77	82%	0.817	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.7	8.5	-167.5	-149.1	177.7	178.3	-179.9	0	116	A381	A381-K383 PolarHBondContact O-N 3.05Å
384	L	36.1	Very low	38.9	Very low	141 Å²	141	160.8 Å²	160.8	74%	0.738	82%	0.819	S	S	*	*	S	Bend	trans	-115	-10.3	-178	-145.1	70.4	0	0	0	115.6	N386	L384-N386 VanDerWaalsContact C-N 3.25Å; L384-N386 PolarHBondContact O-N 3.39Å
385	E	43.2	Very low	39	Very low	173 Å²	173	155.1 Å²	155.1	81%	0.808	80%	0.804	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-21.1	171.7	-73.8	172.9	124.3	0	0	113	I387	E385-I387 VanDerWaalsContact C-N 3.31Å; E385-I387 PolarHBondContact O-N 2.94Å
386	N	41.3	Very low	39.3	Very low	160 Å²	160	156.5 Å²	156.5	86%	0.856	80%	0.804	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	14.8	-173.6	-99	11.5	0	0	0	115.6	L384	L384-N386 VanDerWaalsContact C-N 3.25Å; L384-N386 PolarHBondContact O-N 3.39Å
387	I	41	Very low	39.3	Very low	130 Å²	130	156.1 Å²	156.1	67%	0.667	81%	0.807	S	S	*	*	S	Bend	trans	-126.3	-19.2	-174.3	-63.6	-178.9	0	0	0	113.5	E385	E385-I387 VanDerWaalsContact C-N 3.31Å; E385-I387 PolarHBondContact O-N 2.94Å
388	L	40	Very low	39.3	Very low	164 Å²	164	152.8 Å²	152.8	86%	0.859	81%	0.812	S	S	*	*	S	Bend	trans	-100.1	19.8	-177.1	-140	76.9	0	0	0	114.8
389	M	39.6	Very low	39.8	Very low	167 Å²	167	154.8 Å²	154.8	82%	0.823	82%	0.823	S	S	*	*			trans	-126.4	68.3	177.2	-79.1	-70.3	-147.1	0	0	110.3
390	N	36.4	Very low	39.6	Very low	158 Å²	158	152.9 Å²	152.9	85%	0.845	82%	0.821	S	S	*	*			trans	-167.9	95.7	170	-102	-36.5	0	0	0	110.4
391	E	42.4	Very low	39.9	Very low	185 Å²	185	154 Å²	154	86%	0.864	83%	0.826	S	S	*	*	S	Bend	trans	165.1	83.1	145.5	-95.7	-176.4	-175.8	0	0	111.3
392	M	38.8	Very low	39.9	Very low	195 Å²	195	155.2 Å²	155.2	96%	0.961	82%	0.824	S	S	*	*			trans	165.5	88.3	134.9	-93	177.4	-79.9	0	0	111.3
393	E	41.3	Very low	39.8	Very low	187 Å²	187	152.1 Å²	152.1	87%	0.874	82%	0.817	S	S	*	*			trans	-140.5	116.8	160.2	-173.2	176.6	-132.7	0	0	109.3
394	F	37.1	Very low	39.5	Very low	209 Å²	209	152.1 Å²	152.1	92%	0.917	82%	0.817	S	S	*	*			trans	-170.8	132.4	171.1	-125.9	-85.8	0	0	0	108.6
395	A	39.1	Very low	39.7	Very low	68 Å²	68	151.1 Å²	151.1	56%	0.562	82%	0.816	S	S	*	*			cis	-164.1	165.2	-25.3	0	0	0	0	0	107.4
396	I	42.9	Very low	39.5	Very low	173 Å²	173	151.1 Å²	151.1	89%	0.887	82%	0.816	S	S	*	*			trans	172.2	122.1	137.5	-89.9	152.6	0	0	0	107.3
397	S	39.3	Very low	39.1	Very low	118 Å²	118	152 Å²	152	83%	0.825	82%	0.815	S	S	*	*			trans	-130.7	129.1	-169.5	-53.9	0	0	0	0	113.2
398	G	34.9	Very low	39	Very low	76 Å²	76	151.6 Å²	151.6	78%	0.784	82%	0.824	S	S	*	*			trans	68.3	-166.6	145.7	0	0	0	0	0	118.5
399	P	42	Very low	38.6	Very low	134 Å²	134	149.8 Å²	149.8	87%	0.87	82%	0.82	S	S	*	*			cis	-115.7	178.7	-3	40.6	-29.3	0	0	0	113.8
400	S	34	Very low	38.4	Very low	112 Å²	112	147.9 Å²	147.9	78%	0.783	82%	0.818	S	S	*	*			trans	-114.8	140	169.6	57.4	0	0	0	0	110.7
401	E	46.7	Very low	38.2	Very low	198 Å²	198	145.8 Å²	145.8	93%	0.925	81%	0.81	S	S	*	*			trans	-126.4	151.6	163	-72.8	-167	145.2	0	0	110.9
402	T	35.2	Very low	37.8	Very low	128 Å²	128	146.5 Å²	146.5	79%	0.785	81%	0.811	S	S	*	*			trans	-115.4	143.9	-177.3	52.5	0	0	0	0	110.2
403	D	41.7	Very low	37.9	Very low	141 Å²	141	146.9 Å²	146.9	75%	0.754	81%	0.811	S	S	*	*				-159.7	176.7	126.3	-126.4	-39.6	0	0	0	113.7
404	K	37.4	Very low	37.5	Very low	178 Å²	178	145.7 Å²	145.7	77%	0.774	81%	0.805	S	S	*	*			trans	-93	172.1	-168.4	-52.4	141.1	-172.8	157.9	0	113.1
405	V	39	Very low	37.5	Very low	119 Å²	119	144.4 Å²	144.4	72%	0.721	80%	0.802	S	S	*	*				163.9	140.3	118.6	156.3	0	0	0	0	112.6
406	E	39.3	Very low	37.3	Very low	173 Å²	173	148 Å²	148	81%	0.808	81%	0.807	S	S	*	*			trans	45.3	100.3	158.6	-71.5	153.4	-163.2	0	0	122.4
407	E	34	Very low	37.1	Very low	179 Å²	179	149 Å²	149	84%	0.836	81%	0.808	S	S	*	*				15	122.3	112.5	-174.6	171.8	-156.1	0	0	119.4
408	S	37	Very low	36.9	Very low	122 Å²	122	152 Å²	152	85%	0.853	81%	0.806	S	S	*	*			trans	-158.3	143.5	146.8	-81.1	0	0	0	0	110.7
409	T	33.1	Very low	37.1	Very low	126 Å²	126	153.4 Å²	153.4	77%	0.773	80%	0.801	S	S	*	*			trans	-94.9	165.7	177.6	50.1	0	0	0	0	111.6
410	V	35.1	Very low	37	Very low	127 Å²	127	156.5 Å²	156.5	77%	0.77	80%	0.801	S	S	*	*				168.2	123.7	127.7	155.5	0	0	0	0	112.3
411	T	32.8	Very low	36.9	Very low	113 Å²	113	156.7 Å²	156.7	69%	0.693	80%	0.798	S	S	*	*			trans	18.8	134.7	159.8	63.6	0	0	0	0	124.3
412	F	33.4	Very low	36.4	Very low	200 Å²	200	156.9 Å²	156.9	88%	0.877	80%	0.796	S	S	*	*				15.8	134.8	128.7	-60.2	-94.2	0	0	0	120.1
413	E	39.5	Very low	36.3	Very low	203 Å²	203	156.3 Å²	156.3	95%	0.949	79%	0.792	S	S	*	*				-148.9	168.8	112.8	-134.8	174.6	-165.4	0	0	112
414	E	34.6	Very low	36.1	Very low	162 Å²	162	156 Å²	156	76%	0.757	80%	0.795	S	S	*	*			trans	-117	139.9	-164.2	173.8	-169.3	148	0	0	111.1
415	Q	37.4	Very low	35.9	Very low	182 Å²	182	156.6 Å²	156.6	85%	0.85	80%	0.801	S	S	*	*			trans	-158.4	133.9	149.3	-131.6	154.2	84.7	0	0	115.3
416	E	34.1	Very low	35.7	Very low	145 Å²	145	154.6 Å²	154.6	68%	0.678	80%	0.804	S	S	*	*			trans	-67.8	154.4	166.3	-58.9	-179.1	84.5	0	0	112.2
417	Q	38.9	Very low	35.6	Very low	193 Å²	193	151 Å²	151	90%	0.902	80%	0.804	S	S	*	*				-151.1	139	122.4	-120.1	153.8	79.9	0	0	113.5
418	K	34.9	Very low	35.7	Very low	180 Å²	180	150.2 Å²	150.2	78%	0.783	80%	0.8	S	S	*	*			trans	-126.4	-173.7	-171.3	-144.6	-170.8	-179.7	170.2	0	109.6
419	P	37.9	Very low	35.6	Very low	106 Å²	106	151.8 Å²	151.8	69%	0.688	79%	0.792	S	S	*	*				-104.1	-179	-111.5	40.9	-27.8	0	0	0	113.5
420	K	40.7	Very low	35.9	Very low	200 Å²	200	152 Å²	152	87%	0.87	79%	0.793	S	S	*	*			trans	-149.3	136.6	145.5	-121.9	164.2	-172.5	171.8	0	113.4
421	V	32.8	Very low	35.9	Very low	116 Å²	116	154.2 Å²	154.2	70%	0.703	80%	0.795	S	S	*	*			trans	-106.7	143.7	171.9	173.3	0	0	0	0	107.7	V423	V421-V423 HydrophobicContact CG1-CG2 4.4Å
422	F	35.2	Very low	36.2	Very low	201 Å²	201	154.1 Å²	154.1	88%	0.882	80%	0.796	S	S	*	*			trans	-148.7	147.6	148.6	-109.9	-76.6	0	0	0	110.1
423	V	32.9	Very low	36.3	Very low	116 Å²	116	152.2 Å²	152.2	70%	0.703	79%	0.794	S	S	*	*			trans	-124.5	139.3	-178.8	174.2	0	0	0	0	108.2	V421	V421-V423 HydrophobicContact CG1-CG2 4.4Å
424	T	38.3	Very low	36.2	Very low	136 Å²	136	147.7 Å²	147.7	83%	0.834	78%	0.782	S	S	*	*			trans	-151.4	145.6	159.9	-15	0	0	0	0	110.8
425	E	33.9	Very low	36.1	Very low	190 Å²	190	144.3 Å²	144.3	89%	0.888	78%	0.776	S	S	*	*			trans	-83.9	165.7	179.6	-59.5	143.8	116.3	0	0	112.2
426	G	34.4	Very low	36	Very low	76 Å²	76	141.4 Å²	141.4	78%	0.784	77%	0.771	S	S	*	*			trans	-175.8	52	-175	0	0	0	0	0	119.6
427	A	36.6	Very low	36.2	Very low	98 Å²	98	140 Å²	140	81%	0.81	78%	0.777	S	S	*	*			trans	40.7	113.2	145.7	0	0	0	0	0	122.7
428	E	35.4	Very low	36.3	Very low	162 Å²	162	135 Å²	135	76%	0.757	76%	0.764	S	S	*	*				83	145.3	122.7	-127.4	-157.6	145.8	0	0	124.3
429	K	35.9	Very low	36.6	Very low	155 Å²	155	133 Å²	133	67%	0.674	76%	0.762	S	S	*	*			trans	86.1	106.7	155.2	-72.9	-159.6	169.6	61	0	123.7
430	V	39.2	Very low	36.9	Very low	132 Å²	132	139.1 Å²	139.1	80%	0.8	77%	0.773	S	S	*	*				89.9	127.4	122.1	176.2	0	0	0	0	121
431	E	36	Very low	36.8	Very low	173 Å²	173	136.4 Å²	136.4	81%	0.808	77%	0.768	S	S	*	*			trans	-51	179.1	165.3	-83	-173.4	106.3	0	0	118.4
432	P	38.4	Very low	37.2	Very low	110 Å²	110	141.4 Å²	141.4	71%	0.714	78%	0.776	S	S	*	*			cis	-133.8	-169.4	-14.5	24.9	-0.4	0	0	0	114.9
433	L	34.7	Very low	37.2	Very low	160 Å²	160	134.8 Å²	134.8	84%	0.838	76%	0.764	S	S	*	*			trans	-37.3	165.2	158.3	-75.5	159	0	0	0	116.4
434	P	37.8	Very low	37.4	Very low	108 Å²	108	136.3 Å²	136.3	70%	0.701	77%	0.774	S	S	*	*			cis	-143.8	176.2	25.6	44.6	-25.9	0	0	0	119.2
435	S	32.7	Very low	37.3	Very low	91 Å²	91	135.8 Å²	135.8	64%	0.636	77%	0.771	S	S	*	*			trans	19.6	133.7	148.3	64.5	0	0	0	0	122.7
436	T	35.5	Very low	37.4	Very low	122 Å²	122	132.7 Å²	132.7	75%	0.748	77%	0.77	S	S	*	*				168.9	138.8	99.5	42.2	0	0	0	0	113.2
437	S	37.9	Very low	37.5	Very low	115 Å²	115	134.4 Å²	134.4	80%	0.804	77%	0.766	S	S	*	*			trans	60.9	163.3	153.6	69	0	0	0	0	117.9
438	S	40.8	Very low	37.4	Very low	89 Å²	89	136.9 Å²	136.9	62%	0.622	76%	0.764	S	S	*	*			cis	-150.5	155.3	1.7	51.3	0	0	0	0	110.5
439	D	40.9	Very low	37.3	Very low	136 Å²	136	140.1 Å²	140.1	73%	0.727	77%	0.769	S	S	*	*			trans	32.6	133.3	142	-43.1	-26.1	0	0	0	121.6
440	Y	44.7	Very low	37.1	Very low	235 Å²	235	138.9 Å²	138.9	92%	0.922	77%	0.774	S	S	*	*				-152	152.2	105.3	-97.1	-68.4	0	0	0	110.9
441	D	38.1	Very low	36.8	Very low	144 Å²	144	136.4 Å²	136.4	77%	0.77	78%	0.776	S	S	*	*			trans	-120	-162.5	-162.8	-168.8	7.6	0	0	0	111.8
442	Y	41.8	Very low	36.5	Very low	220 Å²	220	133.9 Å²	133.9	86%	0.863	77%	0.772	S	S	*	*			trans	82	117.7	-170.1	-62.4	-87.8	0	0	0	113.8
443	G	35.8	Very low	36.1	Very low	63 Å²	63	135.1 Å²	135.1	65%	0.649	78%	0.778	S	S	*	*			cis	106.4	132.6	-2.9	0	0	0	0	0	114.3
444	T	37.5	Very low	35.9	Very low	148 Å²	148	135.6 Å²	135.6	91%	0.908	78%	0.776	S	S	*	*			trans	-165.8	142	130.1	-70.8	0	0	0	0	109.6
445	T	35.3	Very low	35.4	Very low	124 Å²	124	138.1 Å²	138.1	76%	0.761	78%	0.782	S	S	*	*			trans	-95.7	156.6	-169.2	52.5	0	0	0	0	115.1
446	S	36.8	Very low	35.3	Very low	126 Å²	126	141.2 Å²	141.2	88%	0.881	79%	0.79	S	S	*	*			trans	-136.8	139.8	144.9	-168.6	0	0	0	0	109.7
447	T	36	Very low	34.8	Very low	111 Å²	111	140.7 Å²	140.7	68%	0.681	79%	0.792	S	S	*	*			trans	-122.8	-178.2	-163.1	52.6	0	0	0	0	114
448	I	34.8	Very low	34.5	Very low	150 Å²	150	140.6 Å²	140.6	77%	0.769	79%	0.786	S	S	*	*			trans	91.3	120	178.5	-57.3	174.6	0	0	0	111.7
449	R	32.8	Very low	33.9	Very low	230 Å²	230	145.4 Å²	145.4	87%	0.868	80%	0.795	S	S	*	*			cis	-139.1	-160.7	5.8	-144.5	179.1	-175.8	108.9	4.6	112.1
450	T	31.9	Very low	33.4	Very low	129 Å²	129	148 Å²	148	79%	0.791	80%	0.8	S	S	*	*			trans	-127.9	150.7	-175.6	45.3	0	0	0	0	112.9
451	G	31.7	Very low	33	Very low	80 Å²	80	145.1 Å²	145.1	83%	0.825	80%	0.795	S	S	*	*			trans	-157.2	111.7	164.3	0	0	0	0	0	108.6
452	T	30.7	Very low	32.7	Very low	120 Å²	120	146.4 Å²	146.4	74%	0.736	80%	0.797	S	S	*	*			trans	-102	135.2	-163.6	-38.1	0	0	0	0	112.4
453	T	29.1	Very low	32.3	Very low	136 Å²	136	143.8 Å²	143.8	83%	0.834	80%	0.797	S	S	*	*			trans	-138	140	161.9	-37.7	0	0	0	0	109
454	H	31.3	Very low	32.1	Very low	171 Å²	171	147.4 Å²	147.4	79%	0.792	80%	0.802	S	S	*	*			trans	-85.1	135.6	-173.4	-71.7	-101.6	0	0	0	112.4
455	I	27	Very low	31.8	Very low	161 Å²	161	150.8 Å²	150.8	83%	0.826	80%	0.799	S	S	*	*			trans	-83.5	133.5	163.5	-61.5	173.2	0	0	0	107.9
456	L	29.6	Very low	31.6	Very low	156 Å²	156	151.1 Å²	151.1	82%	0.817	80%	0.801	S	S	*	*			trans	-126.2	103.8	177.1	-136.2	171	0	0	0	108.4	V458	L456-V458 PolarHBondContact O-N 3.01Å
457	S	26.8	Very low	31.3	Very low	111 Å²	111	148.6 Å²	148.6	78%	0.776	80%	0.795	S	S	*	*			trans	-70.6	126.1	-175.1	-51.3	0	0	0	0	111.4
458	V	30	Very low	31.1	Very low	112 Å²	112	147.2 Å²	147.2	68%	0.679	80%	0.803	S	S	*	*			trans	-113.8	116.7	173.5	-175.2	0	0	0	0	108.8	L456 F460	L456-V458 PolarHBondContact O-N 3.01Å; V458-F460 HydrophobicContact CG1-CD2 3.77Å; V458-F460 HydrophobicContact CG1-CE2 3.7Å
459	K	28.3	Very low	30.9	Very low	191 Å²	191	143.8 Å²	143.8	83%	0.83	81%	0.805	S	S	*	*			trans	-79.2	140	162	-80.4	-174.3	170.7	-171.7	0	108.8
460	F	32	Very low	31	Very low	189 Å²	189	141.6 Å²	141.6	83%	0.829	81%	0.806	S	S	*	*			trans	-120.2	133.6	157.3	-96.9	-83	0	0	0	109.3	V458	V458-F460 HydrophobicContact CG1-CD2 3.77Å; V458-F460 HydrophobicContact CG1-CE2 3.7Å
461	E	34.9	Very low	31.3	Very low	175 Å²	175	143 Å²	143	82%	0.818	81%	0.808	S	S	*	*			trans	-95.8	167.2	174.7	-71	176.5	129	0	0	110.6	L463	E461-L463 PolarHBondContact O-N 3.05Å
462	E	33.3	Very low	31.5	Very low	172 Å²	172	146.6 Å²	146.6	80%	0.804	81%	0.808	S	S	*	*			trans	-68	126.8	-164.1	-60.3	174.2	147.3	0	0	113.3
463	L	32.9	Very low	31.7	Very low	164 Å²	164	149.3 Å²	149.3	86%	0.859	81%	0.812	S	S	*	*			trans	-95.7	101.4	166.7	-87.3	169.1	0	0	0	110.4	E461	E461-L463 PolarHBondContact O-N 3.05Å
464	N	31.9	Very low	31.9	Very low	140 Å²	140	151.2 Å²	151.2	75%	0.749	82%	0.816	S	S	*	*			trans	-64.7	129.9	163.8	-87	-66.3	0	0	0	110
465	Y	31.3	Very low	32	Very low	219 Å²	219	148.4 Å²	148.4	86%	0.859	82%	0.815	S	S	*	*			trans	-120.3	104.2	171.9	-141.2	-81.2	0	0	0	110.4
466	T	30.4	Very low	32.2	Very low	130 Å²	130	144.1 Å²	144.1	80%	0.798	81%	0.81	S	S	*	*			trans	-119.4	117.7	-174.8	19.9	0	0	0	0	112.4
467	G	30.6	Very low	32.1	Very low	74 Å²	74	145.8 Å²	145.8	76%	0.763	81%	0.812	S	S	*	*			trans	83.2	170	162.2	0	0	0	0	0	116.4
468	G	31.9	Very low	32.4	Very low	82 Å²	82	152.3 Å²	152.3	85%	0.845	82%	0.819	S	S	*	*			trans	114.6	64.1	178.7	0	0	0	0	0	114.1
469	G	31.4	Very low	32.6	Very low	78 Å²	78	154.6 Å²	154.6	80%	0.804	82%	0.822	S	S	*	*			trans	-78.7	142.2	166.8	0	0	0	0	0	111.4
470	M	34.9	Very low	32.7	Very low	183 Å²	183	154.6 Å²	154.6	90%	0.901	83%	0.825	S	S	*	*			trans	-119.3	121.5	158.9	-77.9	-164.9	175.8	0	0	109.3
471	I	36.6	Very low	32.7	Very low	159 Å²	159	148.9 Å²	148.9	82%	0.815	82%	0.82	S	S	*	*			trans	-93.4	126.3	165	-55.1	167.8	0	0	0	105.3
472	N	36.1	Very low	32.5	Very low	155 Å²	155	147.7 Å²	147.7	83%	0.829	83%	0.825	S	S	*	*			trans	-119.7	125.3	164.6	-96.3	-15.2	0	0	0	108.8
473	E	35	Very low	32.6	Very low	178 Å²	178	145.6 Å²	145.6	83%	0.832	82%	0.824	S	S	*	*			trans	-75	132.6	175.2	-53.6	169.5	118.2	0	0	109.8
474	I	34.1	Very low	32.5	Very low	176 Å²	176	143 Å²	143	90%	0.903	82%	0.816	S	S	*	*			trans	-132.3	118.2	138.8	-78.4	172.6	0	0	0	105.4
475	S	32.9	Very low	32.3	Very low	111 Å²	111	143.2 Å²	143.2	78%	0.776	82%	0.817	S	S	*	*			trans	-111.5	146.1	178	56.1	0	0	0	0	110.3
476	G	30.9	Very low	32.4	Very low	71 Å²	71	139.7 Å²	139.7	73%	0.732	81%	0.811	S	S	*	*			trans	87.2	93.1	169.4	0	0	0	0	0	116
477	F	29	Very low	32.3	Very low	192 Å²	192	139 Å²	139	84%	0.842	80%	0.803	S	S	*	*				-139.3	132.5	129.6	-129.1	-91.9	0	0	0	109.2	Q479	F477-Q479 HydrophobicContact CD1-CB 4.44Å; F477-Q479 HydrophobicContact CE1-CB 4.48Å
478	R	31.3	Very low	32.3	Very low	247 Å²	247	145 Å²	145	93%	0.932	81%	0.808	S	S	*	*			trans	-140.7	103.3	179.5	-174.6	-170.2	-162.3	-137.8	5.1	107
479	Q	35.6	Very low	32.1	Very low	160 Å²	160	149.6 Å²	149.6	75%	0.748	81%	0.805	S	S	*	*			trans	-147.9	126.8	177.6	-152.2	164.1	21.1	0	0	110.3	F477	F477-Q479 HydrophobicContact CD1-CB 4.44Å; F477-Q479 HydrophobicContact CE1-CB 4.48Å
480	E	30.2	Very low	32.1	Very low	191 Å²	191	153.4 Å²	153.4	89%	0.893	81%	0.806	S	S	*	*			trans	-73.9	139.3	168.7	-66.2	137.8	137.4	0	0	108.7
481	G	32.7	Very low	31.9	Very low	70 Å²	70	150.2 Å²	150.2	72%	0.722	80%	0.799	S	S	*	*			trans	-155.6	89	-173.7	0	0	0	0	0	112.1
482	T	29.1	Very low	31.5	Very low	149 Å²	149	151.7 Å²	151.7	91%	0.914	80%	0.803	S	S	*	*			trans	-71.9	133.3	175.9	-43.7	0	0	0	0	110.7
483	V	35.4	Very low	31.4	Very low	129 Å²	129	152.8 Å²	152.8	78%	0.782	80%	0.803	S	S	*	*			trans	-126.4	135.9	175.3	-178.7	0	0	0	0	107.6
484	P	31.2	Very low	31.3	Very low	109 Å²	109	152 Å²	152	71%	0.708	80%	0.799	S	S	*	*			trans	-86.8	162.7	-160	34.2	-37.6	0	0	0	115
485	L	27.7	Very low	31	Very low	145 Å²	145	151.8 Å²	151.8	76%	0.759	80%	0.798	S	S	*	*			trans	-60.9	150.1	163.7	-85.2	77	0	0	0	111.3
486	I	33.3	Very low	31.2	Very low	144 Å²	144	153.1 Å²	153.1	74%	0.738	80%	0.795	S	S	*	*			trans	-131.4	108.8	159.5	-60.9	178.8	0	0	0	106.7	F488	I486-F488 HydrophobicContact CG2-CD2 4.24Å; I486-F488 HydrophobicContact CG2-CE2 4.09Å
487	D	28	Very low	31.4	Very low	115 Å²	115	156.3 Å²	156.3	62%	0.615	80%	0.795	S	S	*	*			trans	-75	141.7	176.2	-65.1	-57.4	0	0	0	111.8	F489	D487-F489 HydrophobicContact CB-CD2 4.24Å; D487-F489 HydrophobicContact CB-CE2 4.42Å
488	F	30.3	Very low	31.4	Very low	201 Å²	201	156.4 Å²	156.4	88%	0.882	80%	0.798	S	S	*	*			trans	-127.1	110.8	163	-95.4	-90.3	0	0	0	109.2	I486	I486-F488 HydrophobicContact CG2-CD2 4.24Å; I486-F488 HydrophobicContact CG2-CE2 4.09Å
489	F	27.9	Very low	31.4	Very low	178 Å²	178	150.9 Å²	150.9	78%	0.781	79%	0.792	S	S	*	*			trans	-96.6	169.6	-178.9	-97.5	-94.4	0	0	0	112.6	D487	D487-F489 HydrophobicContact CB-CD2 4.24Å; D487-F489 HydrophobicContact CB-CE2 4.42Å
490	L	31.2	Very low	31.5	Very low	158 Å²	158	148.8 Å²	148.8	83%	0.827	80%	0.795	S	S	*	*			trans	89.6	144.8	163.4	-53.9	176.1	0	0	0	117.4
491	P	31.2	Very low	31.4	Very low	116 Å²	116	150.3 Å²	150.3	75%	0.753	80%	0.799	S	S	*	*			cis	-130.5	164.6	-19.7	36.1	-19.3	0	0	0	115.1
492	E	29.5	Very low	31.9	Very low	190 Å²	190	149.9 Å²	149.9	89%	0.888	80%	0.795	S	S	*	*			trans	-75.7	140.6	166.8	-64.5	172.2	95.2	0	0	112.3
493	Q	32.7	Very low	32.6	Very low	178 Å²	178	149 Å²	149	83%	0.832	79%	0.79	S	S	*	*			trans	-178.3	145.2	156.4	-104.4	175.7	-13	0	0	108.1
494	E	33.2	Very low	32.9	Very low	163 Å²	163	147.4 Å²	147.4	76%	0.762	78%	0.784	S	S	*	*			cis	-154.2	152.9	-16.7	-160.5	168.3	178.7	0	0	107.9
495	I	28.9	Very low	33.9	Very low	170 Å²	170	144.3 Å²	144.3	87%	0.872	76%	0.761	S	S	*	*			trans	-81.9	121.1	-171.5	-58.1	168.8	0	0	0	111.5
496	I	36.9	Very low	35.4	Very low	139 Å²	139	140.2 Å²	140.2	71%	0.713	74%	0.742	S	S	*	*			trans	-136.9	115.2	169	-57.7	-176.4	0	0	0	112.7
497	N	33.7	Very low	36.5	Very low	139 Å²	139	134.6 Å²	134.6	74%	0.743	71%	0.712	S	S	*	*			trans	66	109.5	156.9	-61.9	-9.4	0	0	0	121.7
498	E	30.4	Very low	37.9	Very low	193 Å²	193	131.1 Å²	131.1	90%	0.902	70%	0.699	S	S	*	*			trans	-68.3	121.9	153.3	-50.7	172.5	110.1	0	0	110.8
499	T	30.5	Very low	39.4	Very low	132 Å²	132	126.1 Å²	126.1	81%	0.81	68%	0.679	S	S	*	*			trans	-154.5	55.5	160.1	-35	0	0	0	0	116.2
500	S	37	Very low	40.7	Very low	116 Å²	116	118 Å²	118	81%	0.811	64%	0.644	S	S	*	*			trans	-167.7	134.8	144.1	55.7	0	0	0	0	111.6	G502	S500-G502 PolarHBondContact O-N 2.87Å
501	K	30	Very low	41.9	Very low	222 Å²	222	111.3 Å²	111.3	97%	0.965	61%	0.609	S	S	*	*			trans	-95.1	73.2	172	-71.9	-171.3	175.6	-176.4	0	110.9
502	G	41.9	Very low	43.1	Very low	62 Å²	62	108.5 Å²	108.5	64%	0.639	59%	0.585	S	S	*	*			trans	-93.6	136.2	159.6	0	0	0	0	0	109.4	S500 S504	S500-G502 PolarHBondContact O-N 2.87Å; G502-S504 PolarHBondContact O-N 2.74Å
503	T	43.7	Very low	44.4	Very low	131 Å²	131	107.6 Å²	107.6	80%	0.804	57%	0.574	S	S	*	*			trans	-75.9	106.9	175.8	-45.5	0	0	0	0	109	M505	T503-M505 PolarHBondContact O-N 2.92Å
504	S	42.5	Very low	45	Very low	95 Å²	95	99.9 Å²	99.9	66%	0.664	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-66.5	125.1	172.8	45.9	0	0	0	0	110	G502	G502-S504 PolarHBondContact O-N 2.74Å
505	M	52.5	Low	45.7	Very low	44 Å²	44	96.3 Å²	96.3	22%	0.217	53%	0.525	C	S	.	.	P	Polyproline II helix	trans	-102.2	135.9	174.6	-66.6	171.1	-70.2	0	0	108.9	T503 E509 R513 A916	T503-M505 PolarHBondContact O-N 2.92Å; M505-E509 HydrophobicContact CB-CB 4.17Å; M505-R513 VanDerWaalsContact SD-CD 3.56Å; M505-R513 PolarHBondContact SD-NH1 3.42Å; M505-A916 WeakPolarHBondContact O-CA 3.36Å
506	T	59	Low	46.4	Very low	58 Å²	58	90.9 Å²	90.9	36%	0.356	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-64.7	162.5	169.9	62	0	0	0	0	111	A508 E509 S510	T506-A508 PolarHBondContact O-N 3.4Å; T506-E509 VanDerWaalsContact CB-OE2 3.3Å; T506-E509 WeakPolarHBondContact CB-OE2 3.39Å; T506-E509 WeakPolarHBondContact CG2-OE2 3.39Å; T506-E509 PolarHBondContact N-OE2 3.08Å; T506-E509 PolarHBondContact O-N 3.47Å; T506-E509 WeakPolarHBondContact OG1-CG 3.37Å; T506-E509 PolarHBondContact OG1-N 2.91Å; T506-E509 PolarHBondContact OG1-OE2 2.95Å; T506-S510 WeakPolarHBondContact O-CB 3.46Å; T506-S510 PolarHBondContact O-N 3.2Å
507	F	55	Low	46.7	Very low	27 Å²	27	91.5 Å²	91.5	12%	0.118	50%	0.504	C	S	.	.	H	α-helix	trans	-55.8	-37.1	175.6	178.3	-111.4	0	0	0	113.2	S510 I511 P909 F917 A943 P980 V982	F507-S510 PolarHBondContact O-N 3.07Å; F507-I511 HydrophobicContact CD1-CD1 3.92Å; F507-I511 HydrophobicContact CD2-CD1 4.5Å; F507-I511 HydrophobicContact CE1-CD1 3.29Å; F507-I511 HydrophobicContact CE1-CG1 4.31Å; F507-I511 HydrophobicContact CE2-CD1 4.01Å; F507-I511 HydrophobicContact CE2-CG1 4.23Å; F507-I511 HydrophobicContact CG-CD1 4.5Å; F507-I511 HydrophobicContact CZ-CD1 3.39Å; F507-I511 HydrophobicContact CZ-CG1 4.1Å; F507-I511 WeakPolarHBondContact O-CG1 3.49Å; F507-I511 PolarHBondContact O-N 2.8Å; F507-P909 HydrophobicContact CD1-CB 3.88Å; F507-P909 HydrophobicContact CD1-CG 4.37Å; F507-P909 HydrophobicContact CE1-CB 3.21Å; F507-P909 HydrophobicContact CE1-CG 3.28Å; F507-P909 HydrophobicContact CZ-CB 3.78Å; F507-P909 HydrophobicContact CZ-CG 3.35Å; F507-F917 HydrophobicContact CB-CE2 4.07Å; F507-F917 HydrophobicContact CD2-CD2 4.29Å; F507-F917 AromaticContact CD2-CE2 3.49Å; F507-F917 HydrophobicContact CD2-CE2 3.49Å; F507-F917 VanDerWaalsContact CD2-CE2 3.49Å; F507-F917 AromaticContact CD2-CZ 3.98Å; F507-F917 HydrophobicContact CD2-CZ 3.98Å; F507-F917 HydrophobicContact CE2-CE2 4.41Å; F507-F917 HydrophobicContact CG-CE2 4.23Å; F507-A943 HydrophobicContact CE2-CB 3.88Å; F507-P980 HydrophobicContact CZ-CB 4.03Å; F507-V982 HydrophobicContact CE2-CG2 4.5Å
508	A	58.4	Low	46.8	Very low	42 Å²	42	93.5 Å²	93.5	35%	0.347	51%	0.509	S	S	.	.	H	α-helix	trans	-65.8	-50	175.9	0	0	0	0	0	111.7	T506 S510 I511 E512	T506-A508 PolarHBondContact O-N 3.4Å; A508-S510 PolarHBondContact O-N 3.02Å; A508-I511 PolarHBondContact O-N 2.92Å; A508-E512 WeakPolarHBondContact O-CB 3.24Å; A508-E512 WeakPolarHBondContact O-CG 3.49Å; A508-E512 PolarHBondContact O-N 3.36Å
509	E	61.6	Low	47.3	Very low	96 Å²	96	89.3 Å²	89.3	45%	0.449	49%	0.492	S	S	.	.	H	α-helix	trans	-62.2	-31.9	175.8	-67.9	161.9	129.6	0	0	112.1	M505 T506 R513	M505-E509 HydrophobicContact CB-CB 4.17Å; T506-E509 VanDerWaalsContact CB-OE2 3.3Å; T506-E509 WeakPolarHBondContact CB-OE2 3.39Å; T506-E509 WeakPolarHBondContact CG2-OE2 3.39Å; T506-E509 PolarHBondContact N-OE2 3.08Å; T506-E509 PolarHBondContact O-N 3.47Å; T506-E509 WeakPolarHBondContact OG1-CG 3.37Å; T506-E509 PolarHBondContact OG1-N 2.91Å; T506-E509 PolarHBondContact OG1-OE2 2.95Å; E509-R513 WeakPolarHBondContact O-CB 3.41Å; E509-R513 PolarHBondContact O-N 2.78Å
510	S	54.4	Low	47.6	Very low	6 Å²	6	90.4 Å²	90.4	4%	0.042	49%	0.493	C	S	.	.	H	α-helix	trans	-72.2	-40.3	176.5	-165.1	0	0	0	0	112.3	T506 F507 A508 S514 L957	T506-S510 WeakPolarHBondContact O-CB 3.46Å; T506-S510 PolarHBondContact O-N 3.2Å; F507-S510 PolarHBondContact O-N 3.07Å; A508-S510 PolarHBondContact O-N 3.02Å; S510-S514 VanDerWaalsContact O-CB 3.27Å; S510-S514 WeakPolarHBondContact O-CB 3.37Å; S510-S514 PolarHBondContact O-N 2.81Å; S510-S514 PolarHBondContact O-OG 3.39Å; S510-L957 WeakPolarHBondContact OG-CD1 3.41Å
511	I	57.2	Low	47.3	Very low	18 Å²	18	94 Å²	94	9%	0.092	49%	0.494	C	S	.	.	H	α-helix	trans	-60.6	-51.8	167.3	-75.8	171.6	0	0	0	110.1	F507 A508 R513 S514 L515 I945 P980	F507-I511 HydrophobicContact CD1-CD1 3.92Å; F507-I511 HydrophobicContact CD2-CD1 4.5Å; F507-I511 HydrophobicContact CE1-CD1 3.29Å; F507-I511 HydrophobicContact CE1-CG1 4.31Å; F507-I511 HydrophobicContact CE2-CD1 4.01Å; F507-I511 HydrophobicContact CE2-CG1 4.23Å; F507-I511 HydrophobicContact CG-CD1 4.5Å; F507-I511 HydrophobicContact CZ-CD1 3.39Å; F507-I511 HydrophobicContact CZ-CG1 4.1Å; F507-I511 WeakPolarHBondContact O-CG1 3.49Å; F507-I511 PolarHBondContact O-N 2.8Å; A508-I511 PolarHBondContact O-N 2.92Å; I511-R513 VanDerWaalsContact C-N 3.33Å; I511-R513 PolarHBondContact O-N 3.38Å; I511-S514 CarbonylContact O-C 3.5Å; I511-S514 WeakPolarHBondContact O-CA 3.5Å; I511-S514 PolarHBondContact O-N 2.86Å; I511-L515 HydrophobicContact CG2-CD1 3.58Å; I511-L515 HydrophobicContact CG2-CG 4.12Å; I511-L515 WeakPolarHBondContact O-CG 3.1Å; I511-L515 PolarHBondContact O-N 3.41Å; I511-I945 HydrophobicContact CG1-CD1 4.13Å; I511-P980 HydrophobicContact CD1-CB 3.95Å; I511-P980 HydrophobicContact CD1-CG 3.93Å; I511-P980 HydrophobicContact CG1-CB 4.46Å; I511-P980 HydrophobicContact CG1-CG 4.36Å
512	E	55.7	Low	47.4	Very low	57 Å²	57	86.9 Å²	86.9	27%	0.266	48%	0.483	S	S	.	.	H	α-helix	trans	-60	-44.2	-176.8	-74.5	-174.4	165.5	0	0	110.8	A508 S514 L515 A516 F651	A508-E512 WeakPolarHBondContact O-CB 3.24Å; A508-E512 WeakPolarHBondContact O-CG 3.49Å; A508-E512 PolarHBondContact O-N 3.36Å; E512-S514 VanDerWaalsContact C-N 3.3Å; E512-S514 PolarHBondContact O-N 2.79Å; E512-L515 PolarHBondContact O-N 3.16Å; E512-A516 WeakPolarHBondContact O-CA 3.34Å; E512-A516 WeakPolarHBondContact O-CB 3.41Å; E512-A516 PolarHBondContact O-N 2.95Å; E512-F651 WeakPolarHBondContact OE1-CD2 3.18Å
513	R	57.2	Low	46.8	Very low	171 Å²	171	92.7 Å²	92.7	65%	0.645	49%	0.494	S	S	*	.	H	α-helix	trans	-64	-31	173.5	-173.2	174.2	-178.9	167.9	1.6	113.7	M505 E509 I511	M505-R513 VanDerWaalsContact SD-CD 3.56Å; M505-R513 PolarHBondContact SD-NH1 3.42Å; E509-R513 WeakPolarHBondContact O-CB 3.41Å; E509-R513 PolarHBondContact O-N 2.78Å; I511-R513 VanDerWaalsContact C-N 3.33Å; I511-R513 PolarHBondContact O-N 3.38Å
514	S	46.3	Very low	46.2	Very low	16 Å²	16	92 Å²	92	11%	0.112	49%	0.494	C	S	.	.	H	α-helix	trans	-80.4	-24.9	178.1	-59.2	0	0	0	0	113.6	S510 I511 E512 F517	S510-S514 VanDerWaalsContact O-CB 3.27Å; S510-S514 WeakPolarHBondContact O-CB 3.37Å; S510-S514 PolarHBondContact O-N 2.81Å; S510-S514 PolarHBondContact O-OG 3.39Å; I511-S514 CarbonylContact O-C 3.5Å; I511-S514 WeakPolarHBondContact O-CA 3.5Å; I511-S514 PolarHBondContact O-N 2.86Å; E512-S514 VanDerWaalsContact C-N 3.3Å; E512-S514 PolarHBondContact O-N 2.79Å; S514-F517 WeakPolarHBondContact O-CD2 3.11Å; S514-F517 VanDerWaalsContact O-CE2 3.29Å; S514-F517 WeakPolarHBondContact O-CE2 3.04Å
515	L	47.5	Very low	45.8	Very low	88 Å²	88	93.8 Å²	93.8	46%	0.461	50%	0.501	S	S	.	.	H	α-helix	trans	-94.4	-34.7	177	-64.9	-179.1	0	0	0	112.1	I511 E512 F517 I945	I511-L515 HydrophobicContact CG2-CD1 3.58Å; I511-L515 HydrophobicContact CG2-CG 4.12Å; I511-L515 WeakPolarHBondContact O-CG 3.1Å; I511-L515 PolarHBondContact O-N 3.41Å; E512-L515 PolarHBondContact O-N 3.16Å; L515-F517 PolarHBondContact O-N 3.05Å; L515-I945 HydrophobicContact CD2-CG2 4.47Å
516	A	43.4	Very low	44.7	Very low	57 Å²	57	97.2 Å²	97.2	47%	0.471	53%	0.53	S	S	.	.			trans	-77.9	68.2	175	0	0	0	0	0	111.2	E512 E518	E512-A516 WeakPolarHBondContact O-CA 3.34Å; E512-A516 WeakPolarHBondContact O-CB 3.41Å; E512-A516 PolarHBondContact O-N 2.95Å; A516-E518 PolarHBondContact O-N 3.25Å
517	F	42.6	Very low	43.4	Very low	152 Å²	152	100.5 Å²	100.5	67%	0.667	56%	0.555	S	S	*	*			trans	-70.1	58.8	162.7	-89.2	-84.2	0	0	0	111.3	S514 L515	S514-F517 WeakPolarHBondContact O-CD2 3.11Å; S514-F517 VanDerWaalsContact O-CE2 3.29Å; S514-F517 WeakPolarHBondContact O-CE2 3.04Å; L515-F517 PolarHBondContact O-N 3.05Å
518	E	36	Very low	42.2	Very low	180 Å²	180	105 Å²	105	84%	0.841	59%	0.59	S	S	*	*			trans	-83.6	141.4	158.4	-74.3	-133.6	111.5	0	0	109.9	A516 D520	A516-E518 PolarHBondContact O-N 3.25Å; E518-D520 PolarHBondContact O-N 3.48Å
519	L	41.4	Very low	40.8	Very low	105 Å²	105	106.2 Å²	106.2	55%	0.55	61%	0.606	S	S	.	*			trans	-84.6	96.1	-177.1	-129	165.4	0	0	0	108.7	K521 H729	L519-K521 PolarHBondContact O-N 2.64Å; L519-H729 HydrophobicContact CD2-CB 4.4Å
520	D	35.6	Very low	39.2	Very low	156 Å²	156	110.8 Å²	110.8	83%	0.834	63%	0.625	S	S	*	*			trans	-56.7	120.5	-171.8	-167.5	3.3	0	0	0	112.3	E518 G522	E518-D520 PolarHBondContact O-N 3.48Å; D520-G522 PolarHBondContact O-N 3.28Å; D520-G522 VanDerWaalsContact O-N 3.1Å
521	K	30.7	Very low	38.2	Very low	192 Å²	192	115.7 Å²	115.7	84%	0.835	66%	0.655	S	S	*	*			trans	-90.5	71.9	-169.9	-76.6	176.9	-177.7	157.4	0	111.1	L519 Q523	L519-K521 PolarHBondContact O-N 2.64Å; K521-Q523 PolarHBondContact O-N 2.99Å
522	G	33	Very low	37	Very low	71 Å²	71	122.7 Å²	122.7	73%	0.732	69%	0.687	S	S	*	*			trans	-51.6	104.9	174.2	0	0	0	0	0	113.1	D520 S524	D520-G522 PolarHBondContact O-N 3.28Å; D520-G522 VanDerWaalsContact O-N 3.1Å; G522-S524 PolarHBondContact O-N 3.22Å
523	Q	29.5	Very low	35.8	Very low	185 Å²	185	126.7 Å²	126.7	86%	0.864	72%	0.715	S	S	*	*			trans	-85.1	98.1	-177.3	-175.3	-177.8	23.7	0	0	111.2	K521	K521-Q523 PolarHBondContact O-N 2.99Å
524	S	30.9	Very low	34.7	Very low	115 Å²	115	123.7 Å²	123.7	80%	0.804	72%	0.721	S	S	*	*			trans	-104.9	113.3	172.1	63.3	0	0	0	0	111.8	G522	G522-S524 PolarHBondContact O-N 3.22Å
525	T	32.8	Very low	34.3	Very low	133 Å²	133	129.8 Å²	129.8	82%	0.816	75%	0.752	S	S	*	*			trans	-72.3	140.3	178.4	46.6	0	0	0	0	113.1
526	S	29.9	Very low	33.9	Very low	117 Å²	117	133 Å²	133	82%	0.818	77%	0.77	S	S	*	*			trans	-79.9	146.3	-179.1	56.5	0	0	0	0	115
527	S	32	Very low	33.6	Very low	126 Å²	126	135.4 Å²	135.4	88%	0.881	78%	0.78	S	S	*	*				-151.8	175.7	128.2	83.7	0	0	0	0	110.3
528	S	29.7	Very low	33.3	Very low	123 Å²	123	135.7 Å²	135.7	86%	0.86	79%	0.787	S	S	*	*			trans	-141.7	144.2	-158.9	58	0	0	0	0	115
529	G	28.4	Very low	33.1	Very low	67 Å²	67	135 Å²	135	69%	0.691	78%	0.784	S	S	*	*			trans	165.1	126.6	170.6	0	0	0	0	0	108.8
530	F	29	Very low	32.9	Very low	191 Å²	191	135.2 Å²	135.2	84%	0.838	79%	0.789	S	S	*	*			cis	56.7	115.1	33.3	-119.1	-106.1	0	0	0	109.5
531	V	34.4	Very low	33	Very low	110 Å²	110	132.1 Å²	132.1	67%	0.667	78%	0.78	S	S	*	*			cis	-140.4	135.3	40.3	166.9	0	0	0	0	108.3
532	E	31.2	Very low	33.5	Very low	165 Å²	165	130.5 Å²	130.5	77%	0.771	78%	0.776	S	S	*	*				54.1	145.4	92.8	-125.4	170.7	-154.9	0	0	115
533	T	30.2	Very low	33.8	Very low	140 Å²	140	134.1 Å²	134.1	86%	0.859	77%	0.773	S	S	*	*			trans	-143.9	114	-170.5	-49.9	0	0	0	0	112.7
534	S	33.9	Very low	34.4	Very low	109 Å²	109	132.7 Å²	132.7	76%	0.762	77%	0.766	S	S	*	*			trans	-155.3	104.5	164.8	62.8	0	0	0	0	112.3
535	D	37.4	Very low	34.9	Very low	144 Å²	144	132.9 Å²	132.9	77%	0.77	76%	0.763	S	S	*	*			trans	44.4	131.6	143.8	-57.2	-20.8	0	0	0	124
536	N	39.2	Very low	35.5	Very low	155 Å²	155	132 Å²	132	83%	0.829	76%	0.757	S	S	*	*			trans	92	149.8	150	-64.6	-46.5	0	0	0	120.4
537	P	38.4	Very low	36	Very low	108 Å²	108	133 Å²	133	70%	0.701	75%	0.753	S	S	*	*			trans	-123.6	-156.5	-158.2	40.7	-21.8	0	0	0	113.4
538	I	35.4	Very low	36.5	Very low	157 Å²	157	131.1 Å²	131.1	81%	0.805	74%	0.74	S	S	*	*			trans	91	134.6	177.5	-54.8	164.8	0	0	0	113.2
539	E	32.3	Very low	36.9	Very low	165 Å²	165	131 Å²	131	77%	0.771	73%	0.734	S	S	*	*			cis	-171.8	174.9	-27.3	-152.9	-177.3	-178.5	0	0	108.4
540	V	37.8	Very low	37.4	Very low	110 Å²	110	132.3 Å²	132.3	67%	0.667	74%	0.738	S	S	*	*			trans	71.5	109.6	155.6	177.5	0	0	0	0	120.6
541	S	37.9	Very low	37.9	Very low	91 Å²	91	127 Å²	127	64%	0.636	73%	0.729	S	S	*	*			trans	54.8	174.8	141	85.3	0	0	0	0	120.5
542	E	39.9	Very low	38	Very low	159 Å²	159	130.4 Å²	130.4	74%	0.743	74%	0.738	S	S	*	*			cis	-162.2	160	-0.4	-129.4	151.6	-68.1	0	0	105.8
543	Q	40.5	Very low	38.3	Very low	146 Å²	146	128.7 Å²	128.7	68%	0.682	74%	0.739	S	S	*	*			cis	-179.3	166.8	-21.8	167.1	161.4	-59.6	0	0	108.7
544	E	42	Very low	38.5	Very low	155 Å²	155	126.6 Å²	126.6	72%	0.724	73%	0.73	S	S	*	*			trans	73.3	149.9	159.8	-86	165.8	-137.1	0	0	120.5
545	V	41.6	Very low	38.9	Very low	119 Å²	119	127.9 Å²	127.9	72%	0.721	73%	0.733	S	S	*	*			cis	-172.4	173.8	-16.5	71.8	0	0	0	0	115.6
546	V	44.5	Very low	39.1	Very low	114 Å²	114	127.3 Å²	127.3	69%	0.691	73%	0.73	S	S	*	*			trans	89.7	100.1	152.1	157.9	0	0	0	0	120.5
547	D	40.9	Very low	39.5	Very low	139 Å²	139	125.1 Å²	125.1	74%	0.743	72%	0.724	S	S	*	*				58.9	141.5	109.3	-116.4	-24.1	0	0	0	119.8
548	S	42	Very low	39.6	Very low	86 Å²	86	128.2 Å²	128.2	60%	0.601	73%	0.73	S	S	*	*			cis	-173.4	154.6	28	-151	0	0	0	0	114.6
549	T	38.6	Very low	39.7	Very low	122 Å²	122	124.9 Å²	124.9	75%	0.748	72%	0.72	S	S	*	*			trans	13.6	157.5	141.8	-10.8	0	0	0	0	120.9
550	A	39	Very low	39.9	Very low	93 Å²	93	121 Å²	121	77%	0.769	72%	0.717	S	S	*	*			cis	-171.7	172.6	27.1	0	0	0	0	0	112
551	A	38.8	Very low	40	Very low	79 Å²	79	124.2 Å²	124.2	65%	0.653	72%	0.721	S	S	*	*			cis	-175.5	143.5	-33.1	0	0	0	0	0	112.9
552	Q	37.4	Very low	39.9	Very low	182 Å²	182	125.4 Å²	125.4	85%	0.85	72%	0.721	S	S	*	*			trans	70.9	157.4	142.9	-72	178.6	-0.5	0	0	125.3
553	T	37.2	Very low	39.9	Very low	129 Å²	129	124.9 Å²	124.9	79%	0.791	72%	0.722	S	S	*	*			trans	98.1	132.6	152.2	-36.6	0	0	0	0	117.4
554	S	34.7	Very low	39.6	Very low	97 Å²	97	125.4 Å²	125.4	68%	0.678	73%	0.729	S	S	*	*			cis	178.1	-170.1	-48.6	58.5	0	0	0	0	108.9
555	V	42.4	Very low	39.3	Very low	136 Å²	136	121.3 Å²	121.3	82%	0.824	72%	0.722	S	S	*	*			trans	75.7	136.5	172.8	177.4	0	0	0	0	115.7
556	N	40.3	Very low	38.9	Very low	131 Å²	131	124 Å²	124	70%	0.701	73%	0.727	S	S	*	*			cis	-163	148.9	-28	-160.5	85	0	0	0	109.2
557	P	48.8	Very low	38.4	Very low	109 Å²	109	127.3 Å²	127.3	71%	0.708	73%	0.731	S	S	*	*			trans	-91.6	-179.5	174.6	37.7	-37.9	0	0	0	113.9
558	E	40.6	Very low	38.2	Very low	174 Å²	174	125.9 Å²	125.9	81%	0.813	73%	0.733	S	S	*	*			trans	131	155.2	164.1	-81.2	-151.1	69	0	0	113.3
559	S	37.2	Very low	37.7	Very low	87 Å²	87	127.7 Å²	127.7	61%	0.608	74%	0.74	S	S	*	*			cis	-165.1	158.1	-30.2	56.1	0	0	0	0	111.2
560	A	36	Very low	37.4	Very low	84 Å²	84	128.5 Å²	128.5	69%	0.694	74%	0.744	S	S	*	*			trans	63.4	132.9	144.4	0	0	0	0	0	124.4
561	K	39	Very low	37.1	Very low	176 Å²	176	127.8 Å²	127.8	77%	0.765	74%	0.739	S	S	*	*				99.2	121.6	126.4	-86	172.3	158.8	-85.6	0	124.2
562	D	37.2	Very low	37	Very low	117 Å²	117	131.7 Å²	131.7	63%	0.626	75%	0.748	S	S	*	*				94.2	140.1	121.9	-82.4	-37.1	0	0	0	124
563	I	40.2	Very low	36.7	Very low	148 Å²	148	129.6 Å²	129.6	76%	0.759	75%	0.747	S	S	*	*			trans	74.3	91.2	152.5	-62.3	156.2	0	0	0	119.4
564	D	34.2	Very low	36.3	Very low	156 Å²	156	126.9 Å²	126.9	83%	0.834	75%	0.745	S	S	*	*				50.6	153.3	103.4	-149.4	4.4	0	0	0	122.7
565	A	35.1	Very low	36.2	Very low	70 Å²	70	129.8 Å²	129.8	58%	0.579	75%	0.748	S	S	*	*			trans	74.9	104.5	155.9	0	0	0	0	0	122.4
566	Q	33.5	Very low	35.6	Very low	176 Å²	176	132.3 Å²	132.3	82%	0.822	75%	0.75	S	S	*	*				74.2	116	125	-70.2	-167	25.9	0	0	122.7
567	K	34.4	Very low	35.4	Very low	182 Å²	182	133.7 Å²	133.7	79%	0.791	75%	0.753	S	S	*	*				106.1	149.8	114.1	-170.4	176.4	-174.2	176.4	0	119.9
568	S	35.9	Very low	34.4	Very low	110 Å²	110	133.9 Å²	133.9	77%	0.769	76%	0.756	S	S	*	*			trans	74.7	140.5	179.6	70.6	0	0	0	0	116.2
569	V	30.7	Very low	34.3	Very low	124 Å²	124	131.8 Å²	131.8	75%	0.752	76%	0.755	S	S	*	*			cis	152.7	140.2	-29.7	154.3	0	0	0	0	107.3
570	T	32.5	Very low	33.9	Very low	138 Å²	138	131.6 Å²	131.6	85%	0.847	76%	0.759	S	S	*	*			trans	61.6	141.7	-179.2	38.4	0	0	0	0	116
571	A	32.8	Very low	33.7	Very low	78 Å²	78	133.6 Å²	133.6	65%	0.645	76%	0.758	S	S	*	*			cis	-152.8	173.6	-11.5	0	0	0	0	0	106.8
572	L	36.3	Very low	33.5	Very low	161 Å²	161	129.2 Å²	129.2	84%	0.843	76%	0.755	S	S	*	*			cis	-131.8	148.3	15.7	-60.3	93.7	0	0	0	107.8
573	V	31.9	Very low	33.5	Very low	139 Å²	139	131.2 Å²	131.2	84%	0.842	76%	0.761	S	S	*	*			cis	75.1	108.2	47	-179.3	0	0	0	0	114.2
574	G	27.8	Very low	33.9	Very low	72 Å²	72	127 Å²	127	74%	0.742	74%	0.738	S	S	*	*			trans	98.6	99.8	148	0	0	0	0	0	117.9
575	Q	33.6	Very low	34.3	Very low	157 Å²	157	123.4 Å²	123.4	73%	0.734	73%	0.725	S	S	*	*				-164.6	124.1	95.3	-143.4	171.7	-39.7	0	0	110.6	E577	Q575-E577 PolarHBondContact NE2-OE1 2.87Å; Q575-E577 PolarHBondContact NE2-OE2 2.71Å
576	E	30.5	Very low	35.1	Very low	189 Å²	189	125.3 Å²	125.3	88%	0.883	73%	0.732	S	S	*	*			trans	-82.1	143.3	152.7	-69.2	162.1	86.5	0	0	107.3
577	E	34.6	Very low	36	Very low	161 Å²	161	122.7 Å²	122.7	75%	0.752	73%	0.733	S	S	*	*			trans	-149.4	129.6	160.7	-150.2	147.4	-116.5	0	0	111.8	Q575	Q575-E577 PolarHBondContact NE2-OE1 2.87Å; Q575-E577 PolarHBondContact NE2-OE2 2.71Å
578	S	28.6	Very low	37.6	Very low	112 Å²	112	120.3 Å²	120.3	78%	0.783	72%	0.722	S	S	*	*			trans	-76.7	134.3	-179.7	54.6	0	0	0	0	111.5
579	V	38	Very low	39.5	Very low	130 Å²	130	119 Å²	119	79%	0.788	71%	0.705	S	S	*	*			trans	-108.4	86.3	168.4	-173.9	0	0	0	0	109.9
580	A	30	Very low	42.1	Very low	84 Å²	84	113.8 Å²	113.8	69%	0.694	67%	0.674	S	S	*	*			trans	-74.3	152.4	153.5	0	0	0	0	0	109.1
581	N	30.3	Very low	44.5	Very low	126 Å²	126	113.3 Å²	113.3	67%	0.674	67%	0.673	S	S	*	*	S	Bend	trans	61	122.5	-174.9	-59	-21.5	0	0	0	115.2	E583	N581-E583 PolarHBondContact O-N 3.34Å
582	A	35.6	Very low	46.8	Very low	84 Å²	84	115.1 Å²	115.1	69%	0.694	67%	0.668	S	S	*	*			trans	-76.2	55.2	163.4	0	0	0	0	0	111.2
583	E	38	Very low	49.3	Very low	159 Å²	159	112.4 Å²	112.4	74%	0.743	66%	0.655	S	S	*	*			trans	-61.8	141.3	154.9	-81.8	-170.8	94.2	0	0	108.4	N581 S585	N581-E583 PolarHBondContact O-N 3.34Å; E583-S585 PolarHBondContact O-N 3.49Å
584	M	48	Very low	52.2	Low	59 Å²	59	106.1 Å²	106.1	29%	0.291	62%	0.616	S	S	.	*			trans	-59.7	106.7	-178.3	-175.2	172.3	-175.7	0	0	109.7	P586 M589 L624	M584-P586 WeakPolarHBondContact O-CD 3.32Å; M584-P586 VanDerWaalsContact O-N 3.09Å; M584-M589 HydrophobicContact SD-CE 3.92Å; M584-L624 HydrophobicContact SD-CD2 3.68Å
585	S	42.6	Very low	55.4	Low	80 Å²	80	102.9 Å²	102.9	56%	0.559	58%	0.582	S	S	*	*			trans	-49.7	117.5	-168.8	-48.6	0	0	0	0	110.9	E583 S587 K588	E583-S585 PolarHBondContact O-N 3.49Å; S585-S587 PolarHBondContact O-N 2.81Å; S585-K588 PolarHBondContact O-N 3.4Å; S585-K588 VanDerWaalsContact O-N 3.11Å
586	P	52	Low	58.4	Low	111 Å²	111	95.4 Å²	95.4	72%	0.721	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-53.7	-30.4	-165.2	-32.2	36.1	0	0	0	114.6	M584 K588 M589	M584-P586 WeakPolarHBondContact O-CD 3.32Å; M584-P586 VanDerWaalsContact O-N 3.09Å; P586-K588 PolarHBondContact O-N 2.73Å; P586-M589 PolarHBondContact O-N 2.92Å
587	S	51.5	Low	61.5	Low	120 Å²	120	86.7 Å²	86.7	84%	0.839	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-56.6	-6.1	177.4	-40.8	0	0	0	0	116.6	S585	S585-S587 PolarHBondContact O-N 2.81Å
588	K	68.4	Low	64.3	Low	132 Å²	132	80.8 Å²	80.8	57%	0.574	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-115.5	-0.6	174	-77.2	-170.2	177	-177.8	0	115.2	S585 P586	S585-K588 PolarHBondContact O-N 3.4Å; S585-K588 VanDerWaalsContact O-N 3.11Å; P586-K588 PolarHBondContact O-N 2.73Å
589	M	76.7	Confident	67.2	Low	83 Å²	83	77 Å²	77	41%	0.409	45%	0.452	S	S	.	.	S	Bend	trans	-73.9	148.4	168.7	-72.2	-163.6	166.2	0	0	110.8	M584 P586 P591	M584-M589 HydrophobicContact SD-CE 3.92Å; P586-M589 PolarHBondContact O-N 2.92Å; M589-P591 WeakPolarHBondContact O-CD 3.2Å
590	C	85.2	Confident	69.4	Low	14 Å²	14	75.5 Å²	75.5	10%	0.095	45%	0.446	C	S	.	.			trans	-67.8	121.7	174	170.2	0	0	0	0	110	E592 Y626 C679	C590-E592 VanDerWaalsContact C-N 3.29Å; C590-E592 PolarHBondContact O-N 3.43Å; C590-E592 PolarHBondContact SG-O 3.43Å; C590-Y626 HydrophobicContact CB-CD1 4.02Å; C590-Y626 HydrophobicContact CB-CE1 3.92Å; C590-C679 WeakPolarHBondContact CA-SG 3.27Å; C590-C679 HydrophobicContact CB-CB 3.74Å; C590-C679 WeakPolarHBondContact CB-SG 3.26Å; C590-C679 WeakPolarHBondContact SG-CA 3.37Å; C590-C679 WeakPolarHBondContact SG-CB 3.27Å; C590-C679 CovalentContact SG-SG 2.03Å; C590-C679 PolarHBondContact SG-SG 3.07Å
591	P	81.1	Confident	71.7	Confident	128 Å²	128	73.1 Å²	73.1	83%	0.831	43%	0.426	S	S	*	.	S	Bend	trans	-78.1	-10.8	179.8	31.4	-37.6	0	0	0	114	M589	M589-P591 WeakPolarHBondContact O-CD 3.2Å
592	E	82	Confident	73.5	Confident	117 Å²	117	70 Å²	70	55%	0.547	41%	0.414	S	S	.	.	S	Bend	trans	-106.5	-178.8	174.2	-71.2	-168.1	-148.6	0	0	111.3	C590 I594 G680 I681	C590-E592 VanDerWaalsContact C-N 3.29Å; C590-E592 PolarHBondContact O-N 3.43Å; C590-E592 PolarHBondContact SG-O 3.43Å; E592-I594 PolarHBondContact O-N 3.04Å; E592-G680 WeakPolarHBondContact OE2-CA 3.45Å; E592-I681 PolarHBondContact OE2-N 2.93Å
593	N	88	Confident	74.3	Confident	103 Å²	103	69.2 Å²	69.2	55%	0.551	40%	0.403	S	S	*	.			trans	-62.9	133.2	167.4	-71.7	-44	0	0	0	110.5	G680 I681	N593-G680 CarbonylContact O-C 3.48Å; N593-G680 VanDerWaalsContact O-C 3.31Å; N593-G680 WeakPolarHBondContact O-CA 3.35Å; N593-G680 PolarHBondContact O-N 2.67Å; N593-I681 HydrophobicContact CB-CG1 4.44Å
594	I	93.7	Very high	74.8	Confident	8 Å²	8	66 Å²	66	4%	0.041	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	143.9	175.4	-161.1	160.6	0	0	0	111	E592 F596 A622 Q623 Y626 T664 I677	E592-I594 PolarHBondContact O-N 3.04Å; I594-F596 HydrophobicContact CG2-CD1 4.33Å; I594-F596 HydrophobicContact CG2-CE1 4.25Å; I594-A622 VanDerWaalsContact CD1-C 3.45Å; I594-A622 HydrophobicContact CD1-CB 4.04Å; I594-A622 VanDerWaalsContact CD1-O 3.26Å; I594-A622 WeakPolarHBondContact CD1-O 3.43Å; I594-A622 HydrophobicContact CG2-CB 4.4Å; I594-Q623 HydrophobicContact CD1-CB 4.46Å; I594-Q623 HydrophobicContact CD1-CG 4.05Å; I594-Q623 HydrophobicContact CG2-CG 4.19Å; I594-Y626 HydrophobicContact CD1-CG 4.24Å; I594-T664 WeakPolarHBondContact O-CA 3.32Å; I594-T664 WeakPolarHBondContact O-CB 3.5Å; I594-T664 WeakPolarHBondContact O-CG2 3.3Å; I594-I677 HydrophobicContact CD1-CG2 3.61Å; I594-I677 HydrophobicContact CG1-CG2 3.75Å
595	S	95.6	Very high	75.3	Confident	4 Å²	4	65.5 Å²	65.5	3%	0.028	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	133.8	176.3	75	0	0	0	0	112.3	R662 V663 R678	S595-R662 PolarHBondContact O-NH1 3.42Å; S595-R662 VanDerWaalsContact O-NH1 3.11Å; S595-R662 PolarHBondContact OG-NH1 3.05Å; S595-V663 WeakPolarHBondContact CA-O 3.01Å; S595-R678 PolarHBondContact N-O 2.85Å; S595-R678 PolarHBondContact O-N 2.8Å; S595-R678 PolarHBondContact OG-O 2.89Å
596	F	96	Very high	76.3	Confident	0 Å²	0	65 Å²	65	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	156.9	-173.9	49.2	-87.5	0	0	0	110.8	I594 T598 T618 E619 A622 R662 V663 I674 I677	I594-F596 HydrophobicContact CG2-CD1 4.33Å; I594-F596 HydrophobicContact CG2-CE1 4.25Å; F596-T598 HydrophobicContact CD2-CG2 3.57Å; F596-T598 HydrophobicContact CE2-CG2 3.52Å; F596-T618 HydrophobicContact CE2-CG2 3.75Å; F596-T618 HydrophobicContact CZ-CG2 4Å; F596-E619 HydrophobicContact CE1-CG 4.44Å; F596-E619 HydrophobicContact CZ-CG 4.32Å; F596-A622 HydrophobicContact CD1-CB 3.6Å; F596-A622 HydrophobicContact CE1-CB 3.87Å; F596-A622 HydrophobicContact CG-CB 4.17Å; F596-R662 CarbonylContact O-C 3.59Å; F596-R662 WeakPolarHBondContact O-CA 3.34Å; F596-V663 HydrophobicContact CD2-CG2 4Å; F596-V663 HydrophobicContact CE2-CG2 3.73Å; F596-V663 HydrophobicContact CZ-CG2 4.26Å; F596-V663 PolarHBondContact N-O 3.06Å; F596-V663 PolarHBondContact O-N 2.03Å; F596-I674 HydrophobicContact CD2-CB 4.11Å; F596-I674 HydrophobicContact CD2-CG2 3.51Å; F596-I674 HydrophobicContact CE2-CG2 3.77Å; F596-I674 HydrophobicContact CG-CG2 4.34Å; F596-I677 HydrophobicContact CB-CG1 4.21Å
597	L	95.1	Very high	77.4	Confident	6 Å²	6	62.6 Å²	62.6	3%	0.031	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	151.7	164.4	-64.2	-176.3	0	0	0	109	D657 K660 R662 I674 S675 C676	L597-D657 HydrophobicContact CD1-CB 4.47Å; L597-D657 WeakPolarHBondContact CD1-O 3.01Å; L597-K660 HydrophobicContact CD1-CB 4.23Å; L597-K660 HydrophobicContact CD2-CB 3.76Å; L597-K660 WeakPolarHBondContact CD2-O 3.45Å; L597-R662 HydrophobicContact CD2-CB 4.47Å; L597-R662 HydrophobicContact CD2-CG 3.77Å; L597-R662 HydrophobicContact CG-CG 4.42Å; L597-I674 WeakPolarHBondContact O-CA 3.36Å; L597-S675 PolarHBondContact N-O 2.76Å; L597-S675 PolarHBondContact O-N 3.31Å; L597-S675 VanDerWaalsContact O-N 3.11Å; L597-C676 HydrophobicContact CB-CB 4.2Å; L597-C676 HydrophobicContact CD1-CB 3.76Å; L597-C676 HydrophobicContact CG-CB 3.71Å
598	T	93.7	Very high	78.7	Confident	37 Å²	37	61 Å²	61	23%	0.227	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	122.4	177.6	57.1	0	0	0	0	110.8	F596 V663 Y666 V672 E673 I674	F596-T598 HydrophobicContact CD2-CG2 3.57Å; F596-T598 HydrophobicContact CE2-CG2 3.52Å; T598-V663 HydrophobicContact CG2-CG2 3.66Å; T598-Y666 HydrophobicContact CG2-CD2 3.57Å; T598-Y666 HydrophobicContact CG2-CE2 4.06Å; T598-Y666 HydrophobicContact CG2-CG 4.14Å; T598-V672 HydrophobicContact CG2-CG2 4.19Å; T598-E673 CarbonylContact C-O 3.43Å; T598-E673 WeakPolarHBondContact CA-O 3.37Å; T598-I674 HydrophobicContact CG2-CG2 4.26Å
599	N	90	Very high	79.6	Confident	31 Å²	31	57.6 Å²	57.6	17%	0.166	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	149.2	169.2	-59.8	-48.2	0	0	0	109.2	A601 K660 E673	N599-A601 PolarHBondContact O-N 3.16Å; N599-K660 PolarHBondContact OD1-NZ 2.65Å; N599-E673 HydrophobicContact CB-CB 4.2Å; N599-E673 PolarHBondContact N-O 2.67Å; N599-E673 PolarHBondContact ND2-OE1 2.78Å; N599-E673 PolarHBondContact O-N 3.11Å
600	P	83.1	Confident	79.7	Confident	99 Å²	99	54.7 Å²	54.7	64%	0.643	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.8	122.2	161	28.4	-31.8	0	0	0	107.9	S602	P600-S602 PolarHBondContact O-N 2.79Å
601	A	78.3	Confident	79.8	Confident	34 Å²	34	56.3 Å²	56.3	28%	0.281	35%	0.345	S	S	.	.			trans	-62.6	126.3	-176	0	0	0	0	0	110	N599 V634 P671 E673	N599-A601 PolarHBondContact O-N 3.16Å; A601-V634 HydrophobicContact CB-CG1 4.09Å; A601-V634 HydrophobicContact CB-CG2 4.04Å; A601-P671 HydrophobicContact CB-CB 4.03Å; A601-P671 HydrophobicContact CB-CG 4.08Å; A601-P671 PolarHBondContact N-O 3.25Å; A601-E673 HydrophobicContact CB-CB 4.04Å
602	S	68.9	Low	80.3	Confident	62 Å²	62	55.6 Å²	55.6	43%	0.434	33%	0.33	S	S	.	.			trans	-131.8	150	-174.2	79.1	0	0	0	0	111.7	P600 Q604	P600-S602 PolarHBondContact O-N 2.79Å; S602-Q604 PolarHBondContact O-N 3.08Å; S602-Q604 PolarHBondContact OG-N 2.88Å
603	S	53.1	Low	80.9	Confident	66 Å²	66	51.2 Å²	51.2	46%	0.462	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-9.2	174.4	4.4	0	0	0	0	114.1	D64	D64-S603 WeakPolarHBondContact OD2-CB 3.45Å; D64-S603 PolarHBondContact OD2-OG 3.04Å
604	Q	46.9	Very low	81.2	Confident	92 Å²	92	49 Å²	49	43%	0.43	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-6.4	-169.2	-61.5	-177.3	22.4	0	0	114.6	L21 S602 G606	L21-Q604 PolarHBondContact O-NE2 2.03Å; L21-Q604 PolarHBondContact O-OE1 2.79Å; S602-Q604 PolarHBondContact O-N 3.08Å; S602-Q604 PolarHBondContact OG-N 2.88Å; Q604-G606 PolarHBondContact O-N 2.84Å
605	S	58.7	Low	81.3	Confident	48 Å²	48	48.6 Å²	48.6	34%	0.336	30%	0.304	S	S	.	.	S	Bend	trans	-69.7	-16.1	-178.1	55.1	0	0	0	0	113.7	I607 E673	S605-I607 PolarHBondContact O-N 2.79Å; S605-I607 VanDerWaalsContact O-N 3.14Å; S605-E673 PolarHBondContact OG-OE2 3.48Å
606	G	65	Low	81.2	Confident	71 Å²	71	53.4 Å²	53.4	73%	0.732	33%	0.329	S	S	*	.			trans	70.7	-0.7	-178	0	0	0	0	0	114.2	Q604 V608	Q604-G606 PolarHBondContact O-N 2.84Å; G606-V608 PolarHBondContact O-N 2.83Å
607	I	74.5	Confident	81.2	Confident	60 Å²	60	54.9 Å²	54.9	31%	0.308	34%	0.34	S	S	.	.			trans	-75.4	122.7	-177.7	-62.2	173.8	0	0	0	109.4	S605 Y609 A650	S605-I607 PolarHBondContact O-N 2.79Å; S605-I607 VanDerWaalsContact O-N 3.14Å; I607-Y609 HydrophobicContact CB-CE2 4.12Å; I607-Y609 HydrophobicContact CG2-CD1 4.31Å; I607-Y609 HydrophobicContact CG2-CD2 4.37Å; I607-Y609 HydrophobicContact CG2-CE1 3.82Å; I607-Y609 HydrophobicContact CG2-CE2 3.89Å; I607-Y609 WeakPolarHBondContact O-CE2 3.15Å; I607-A650 HydrophobicContact CG2-CB 3.21Å
608	V	79.7	Confident	81.2	Confident	86 Å²	86	54.7 Å²	54.7	52%	0.521	34%	0.339	S	S	.	.			trans	-88.1	127.3	169.1	-178.5	0	0	0	0	108.3	G606 A650	G606-V608 PolarHBondContact O-N 2.83Å; V608-A650 WeakPolarHBondContact O-CB 3.28Å
609	Y	86.3	Confident	81.3	Confident	61 Å²	61	55.1 Å²	55.1	24%	0.239	34%	0.339	C	S	.	.			trans	-99	104.1	177.3	-57.9	-91.9	0	0	0	108.9	I607 V634 L648 M649 A650	I607-Y609 HydrophobicContact CB-CE2 4.12Å; I607-Y609 HydrophobicContact CG2-CD1 4.31Å; I607-Y609 HydrophobicContact CG2-CD2 4.37Å; I607-Y609 HydrophobicContact CG2-CE1 3.82Å; I607-Y609 HydrophobicContact CG2-CE2 3.89Å; I607-Y609 WeakPolarHBondContact O-CE2 3.15Å; Y609-V634 HydrophobicContact CD1-CG2 4.49Å; Y609-V634 HydrophobicContact CE1-CB 4.31Å; Y609-V634 HydrophobicContact CE1-CG2 3.67Å; Y609-V634 HydrophobicContact CE2-CG2 4.17Å; Y609-V634 VanDerWaalsContact CZ-CG2 3.49Å; Y609-V634 WeakPolarHBondContact OH-CG2 3.01Å; Y609-L648 HydrophobicContact CD1-CB 4.08Å; Y609-L648 HydrophobicContact CG-CB 4.08Å; Y609-M649 CarbonylContact C-O 3.34Å; Y609-M649 WeakPolarHBondContact CA-O 3.02Å; Y609-A650 HydrophobicContact CD1-CB 3.81Å; Y609-A650 HydrophobicContact CE1-CB 4.09Å; Y609-A650 HydrophobicContact CG-CB 4.37Å
610	G	78.9	Confident	81.6	Confident	22 Å²	22	55.9 Å²	55.9	23%	0.227	34%	0.341	C	S	.	.			trans	-85.7	-14.3	-173.5	0	0	0	0	0	115.4	M649	G610-M649 PolarHBondContact N-O 3.23Å
611	F	87.2	Confident	82.2	Confident	47 Å²	47	51.2 Å²	51.2	21%	0.206	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	141.3	-173.9	-174.3	-102.5	0	0	0	111.9	I613 K628 L648 M649 F651	F611-I613 HydrophobicContact CE1-CB 3.92Å; F611-I613 HydrophobicContact CE1-CD1 4.35Å; F611-I613 HydrophobicContact CE1-CG2 4.47Å; F611-K628 HydrophobicContact CE1-CD 4.42Å; F611-L648 CarbonylContact O-C 3.56Å; F611-L648 WeakPolarHBondContact O-CA 3.44Å; F611-M649 HydrophobicContact CB-CB 4.42Å; F611-M649 HydrophobicContact CD1-CE 4.05Å; F611-M649 HydrophobicContact CD1-CG 4.34Å; F611-M649 HydrophobicContact CD1-SD 3.97Å; F611-M649 HydrophobicContact CE1-CE 4.09Å; F611-M649 HydrophobicContact CE1-SD 4.48Å; F611-M649 PolarHBondContact N-O 2.91Å; F611-M649 PolarHBondContact O-N 2.92Å; F611-F651 HydrophobicContact CB-CE2 3.94Å; F611-F651 HydrophobicContact CB-CZ 4.37Å
612	E	92.5	Very high	83.1	Confident	113 Å²	113	49.6 Å²	49.6	53%	0.528	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	136	176.2	178.1	169.1	-178.8	0	0	110.2	S646 L648	E612-S646 WeakPolarHBondContact OE1-CB 3.33Å; E612-S646 PolarHBondContact OE1-OG 2.27Å; E612-L648 HydrophobicContact CB-CD2 3.74Å; E612-L648 HydrophobicContact CG-CD2 3.71Å
613	I	93.5	Very high	84.5	Confident	26 Å²	26	49.9 Å²	49.9	13%	0.133	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	153.7	172.7	-163.6	164.3	0	0	0	111.1	F611 L624 C647 M649	F611-I613 HydrophobicContact CE1-CB 3.92Å; F611-I613 HydrophobicContact CE1-CD1 4.35Å; F611-I613 HydrophobicContact CE1-CG2 4.47Å; I613-L624 HydrophobicContact CD1-CD2 4.44Å; I613-L624 HydrophobicContact CG2-CB 4.32Å; I613-L624 HydrophobicContact CG2-CD1 3.7Å; I613-C647 HydrophobicContact CG2-CB 3.87Å; I613-C647 PolarHBondContact N-O 2.84Å; I613-C647 PolarHBondContact O-N 2.75Å; I613-M649 HydrophobicContact CB-CE 4.33Å; I613-M649 HydrophobicContact CG2-CE 3.34Å
614	A	94.7	Very high	86.5	Confident	55 Å²	55	47.2 Å²	47.2	46%	0.455	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	131.8	175	0	0	0	0	0	111.8	L644 G645	A614-L644 HydrophobicContact CB-CB 4.1Å; A614-L644 HydrophobicContact CB-CD1 3.76Å; A614-G645 CarbonylContact C-O 3.46Å; A614-G645 WeakPolarHBondContact CA-O 3.39Å
615	A	95.1	Very high	88.9	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	148.1	177.2	0	0	0	0	0	111.4	C621 L624 F635 G645 C647	A615-C621 HydrophobicContact CB-CB 4.1Å; A615-L624 HydrophobicContact CB-CD1 4.01Å; A615-F635 HydrophobicContact CB-CD2 4.08Å; A615-F635 HydrophobicContact CB-CE2 3.85Å; A615-G645 PolarHBondContact N-O 2.79Å; A615-G645 CarbonylContact O-C 3.6Å; A615-G645 WeakPolarHBondContact O-CA 3.49Å; A615-G645 PolarHBondContact O-N 2.88Å; A615-C647 HydrophobicContact CB-CB 3.79Å
616	N	93.8	Very high	90.7	Very high	105 Å²	105	44.7 Å²	44.7	56%	0.561	25%	0.252	S	S	*	.	S	Bend	trans	-90.6	-20.1	179.1	60.9	6.8	0	0	0	113.4	H620 L644	N616-H620 WeakPolarHBondContact OD1-CB 3.04Å; N616-H620 VanDerWaalsContact OD1-CG 3.31Å; N616-H620 PolarHBondContact OD1-ND1 3.23Å; N616-L644 HydrophobicContact CB-CD2 3.73Å
617	S	95.2	Very high	92.1	Very high	32 Å²	32	41.8 Å²	41.8	22%	0.224	22%	0.222	C	C	.	.	S	Bend	trans	-155.7	173.5	179.3	82.6	0	0	0	0	112.5	E619 H620 C621	S617-E619 VanDerWaalsContact C-N 3.31Å; S617-E619 WeakPolarHBondContact CB-OE2 3.34Å; S617-E619 PolarHBondContact O-N 2.85Å; S617-E619 PolarHBondContact OG-N 3.4Å; S617-E619 PolarHBondContact OG-OE2 3.28Å; S617-H620 PolarHBondContact O-N 2.55Å; S617-H620 PolarHBondContact OG-N 3.04Å; S617-C621 WeakPolarHBondContact O-CB 3.34Å; S617-C621 PolarHBondContact O-N 2.78Å
618	T	96.2	Very high	93.1	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.012	22%	0.224	C	C	.	.	H	α-helix	trans	-63.3	-36.2	173.7	-59.1	0	0	0	0	112.1	F596 C621 A622 F635 Y666 V672 I674	F596-T618 HydrophobicContact CE2-CG2 3.75Å; F596-T618 HydrophobicContact CZ-CG2 4Å; T618-C621 WeakPolarHBondContact O-CB 3.35Å; T618-C621 PolarHBondContact O-N 2.79Å; T618-A622 PolarHBondContact O-N 3.46Å; T618-F635 VanDerWaalsContact OG1-CD1 3.31Å; T618-F635 WeakPolarHBondContact OG1-CD1 3.04Å; T618-Y666 HydrophobicContact CG2-CD1 4.47Å; T618-Y666 HydrophobicContact CG2-CG 4.44Å; T618-V672 HydrophobicContact CG2-CG1 3.84Å; T618-V672 WeakPolarHBondContact OG1-CG1 3.41Å; T618-I674 HydrophobicContact CG2-CG2 3.48Å; T618-I674 VanDerWaalsContact CG2-CG2 3.48Å
619	E	95.5	Very high	93.8	Very high	46 Å²	46	45.9 Å²	45.9	22%	0.215	23%	0.233	C	C	.	.	H	α-helix	trans	-68.5	-42.1	178.5	-55	72.8	-156.9	0	0	111.2	F596 S617 A622 Q623 S665 Y666	F596-E619 HydrophobicContact CE1-CG 4.44Å; F596-E619 HydrophobicContact CZ-CG 4.32Å; S617-E619 VanDerWaalsContact C-N 3.31Å; S617-E619 WeakPolarHBondContact CB-OE2 3.34Å; S617-E619 PolarHBondContact O-N 2.85Å; S617-E619 PolarHBondContact OG-N 3.4Å; S617-E619 PolarHBondContact OG-OE2 3.28Å; E619-A622 WeakPolarHBondContact O-CB 3.49Å; E619-A622 PolarHBondContact O-N 3.11Å; E619-Q623 WeakPolarHBondContact O-CG 3.34Å; E619-Q623 PolarHBondContact O-N 2.96Å; E619-S665 WeakPolarHBondContact OE1-CA 3.43Å; E619-Y666 PolarHBondContact OE1-N 2.99Å
620	H	95.8	Very high	94.2	Very high	47 Å²	47	43.7 Å²	43.7	22%	0.218	23%	0.227	C	C	.	.	H	α-helix	trans	-68.2	-39.6	174.3	-175	-168.8	0	0	0	111.1	N616 S617 A622 Q623 L624	N616-H620 WeakPolarHBondContact OD1-CB 3.04Å; N616-H620 VanDerWaalsContact OD1-CG 3.31Å; N616-H620 PolarHBondContact OD1-ND1 3.23Å; S617-H620 PolarHBondContact O-N 2.55Å; S617-H620 PolarHBondContact OG-N 3.04Å; H620-A622 VanDerWaalsContact C-N 3.28Å; H620-A622 PolarHBondContact O-N 3.06Å; H620-Q623 WeakPolarHBondContact O-CB 3.35Å; H620-Q623 PolarHBondContact O-N 2.59Å; H620-Q623 VanDerWaalsContact O-N 3.1Å; H620-L624 VanDerWaalsContact O-CG 3.32Å; H620-L624 WeakPolarHBondContact O-CG 3.5Å; H620-L624 PolarHBondContact O-N 2.93Å
621	C	97.3	Very high	94.9	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-55.6	-45.2	169.7	-179.7	0	0	0	0	111	A615 S617 T618 Q623 L624 C625 F635 C647 I674	A615-C621 HydrophobicContact CB-CB 4.1Å; S617-C621 WeakPolarHBondContact O-CB 3.34Å; S617-C621 PolarHBondContact O-N 2.78Å; T618-C621 WeakPolarHBondContact O-CB 3.35Å; T618-C621 PolarHBondContact O-N 2.79Å; C621-Q623 PolarHBondContact O-N 3.06Å; C621-L624 PolarHBondContact O-N 3.23Å; C621-C625 WeakPolarHBondContact O-CB 2.99Å; C621-C625 PolarHBondContact O-N 3.43Å; C621-F635 HydrophobicContact CB-CB 3.99Å; C621-F635 HydrophobicContact CB-CD2 3.88Å; C621-F635 HydrophobicContact CB-CG 4.2Å; C621-C647 WeakPolarHBondContact CA-SG 3.37Å; C621-C647 HydrophobicContact CB-CB 3.65Å; C621-C647 WeakPolarHBondContact CB-SG 3.5Å; C621-C647 PolarHBondContact O-SG 3.35Å; C621-C647 WeakPolarHBondContact SG-CB 3.4Å; C621-C647 CovalentContact SG-SG 2.04Å; C621-C647 PolarHBondContact SG-SG 3.34Å; C621-I674 HydrophobicContact CB-CD1 4.24Å
622	A	97.1	Very high	95.2	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.6	-38.7	174.9	0	0	0	0	0	113.2	I594 F596 T618 E619 H620 Y626 I674 I677	I594-A622 VanDerWaalsContact CD1-C 3.45Å; I594-A622 HydrophobicContact CD1-CB 4.04Å; I594-A622 VanDerWaalsContact CD1-O 3.26Å; I594-A622 WeakPolarHBondContact CD1-O 3.43Å; I594-A622 HydrophobicContact CG2-CB 4.4Å; F596-A622 HydrophobicContact CD1-CB 3.6Å; F596-A622 HydrophobicContact CE1-CB 3.87Å; F596-A622 HydrophobicContact CG-CB 4.17Å; T618-A622 PolarHBondContact O-N 3.46Å; E619-A622 WeakPolarHBondContact O-CB 3.49Å; E619-A622 PolarHBondContact O-N 3.11Å; H620-A622 VanDerWaalsContact C-N 3.28Å; H620-A622 PolarHBondContact O-N 3.06Å; A622-Y626 VanDerWaalsContact O-CB 3.27Å; A622-Y626 WeakPolarHBondContact O-CB 2.95Å; A622-Y626 PolarHBondContact O-N 2.81Å; A622-I674 VanDerWaalsContact CA-CD1 3.44Å; A622-I674 HydrophobicContact CB-CD1 3.67Å; A622-I677 HydrophobicContact CB-CD1 4.44Å; A622-I677 HydrophobicContact CB-CG2 4.33Å
623	Q	96.6	Very high	95.3	Very high	68 Å²	68	35.8 Å²	35.8	32%	0.318	19%	0.186	S	C	.	.	H	α-helix	trans	-65.2	-44.8	176.6	-73.5	172	-31.4	0	0	112.2	I594 E619 H620 C621 G627	I594-Q623 HydrophobicContact CD1-CB 4.46Å; I594-Q623 HydrophobicContact CD1-CG 4.05Å; I594-Q623 HydrophobicContact CG2-CG 4.19Å; E619-Q623 WeakPolarHBondContact O-CG 3.34Å; E619-Q623 PolarHBondContact O-N 2.96Å; H620-Q623 WeakPolarHBondContact O-CB 3.35Å; H620-Q623 PolarHBondContact O-N 2.59Å; H620-Q623 VanDerWaalsContact O-N 3.1Å; C621-Q623 PolarHBondContact O-N 3.06Å; Q623-G627 PolarHBondContact O-N 2.92Å
624	L	96.7	Very high	95.4	Very high	10 Å²	10	35 Å²	35	5%	0.052	18%	0.183	C	C	.	.	H	α-helix	trans	-62.8	-47.6	176.2	-64.5	170.2	0	0	0	110.6	M584 I613 A615 H620 C621 Y626 G627 K628 M649	M584-L624 HydrophobicContact SD-CD2 3.68Å; I613-L624 HydrophobicContact CD1-CD2 4.44Å; I613-L624 HydrophobicContact CG2-CB 4.32Å; I613-L624 HydrophobicContact CG2-CD1 3.7Å; A615-L624 HydrophobicContact CB-CD1 4.01Å; H620-L624 VanDerWaalsContact O-CG 3.32Å; H620-L624 WeakPolarHBondContact O-CG 3.5Å; H620-L624 PolarHBondContact O-N 2.93Å; C621-L624 PolarHBondContact O-N 3.23Å; L624-Y626 PolarHBondContact O-N 3.11Å; L624-G627 PolarHBondContact O-N 3.14Å; L624-K628 WeakPolarHBondContact O-CB 3.49Å; L624-K628 VanDerWaalsContact O-CG 3.3Å; L624-K628 WeakPolarHBondContact O-CG 3.22Å; L624-K628 PolarHBondContact O-N 2.98Å; L624-M649 HydrophobicContact CB-CE 3.78Å
625	C	96.7	Very high	95.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.7	-44.3	179	-152.5	0	0	0	0	111.4	C621 K628 Q629 C630 M649 I677	C621-C625 WeakPolarHBondContact O-CB 2.99Å; C621-C625 PolarHBondContact O-N 3.43Å; C625-K628 PolarHBondContact O-N 2.9Å; C625-Q629 PolarHBondContact O-N 3.28Å; C625-C630 VanDerWaalsContact CA-SG 3.52Å; C625-C630 HydrophobicContact CB-CB 4.05Å; C625-C630 WeakPolarHBondContact CB-SG 3.32Å; C625-C630 WeakPolarHBondContact O-CB 3.31Å; C625-C630 PolarHBondContact O-N 2.6Å; C625-C630 PolarHBondContact O-SG 2.81Å; C625-C630 VanDerWaalsContact O-SG 3.35Å; C625-C630 WeakPolarHBondContact SG-CB 3.29Å; C625-C630 CovalentContact SG-SG 2.01Å; C625-C630 PolarHBondContact SG-SG 2.83Å; C625-M649 HydrophobicContact CB-CG 4.42Å; C625-M649 HydrophobicContact CB-SD 4.27Å; C625-I677 HydrophobicContact CB-CD1 3.79Å
626	Y	96.1	Very high	95.5	Very high	87 Å²	87	35.9 Å²	35.9	34%	0.341	18%	0.179	S	C	.	.	H	α-helix	trans	-63.6	-47	173.9	179	-100.8	0	0	0	112.9	C590 I594 A622 L624 K628 Q629 I677 C679	C590-Y626 HydrophobicContact CB-CD1 4.02Å; C590-Y626 HydrophobicContact CB-CE1 3.92Å; I594-Y626 HydrophobicContact CD1-CG 4.24Å; A622-Y626 VanDerWaalsContact O-CB 3.27Å; A622-Y626 WeakPolarHBondContact O-CB 2.95Å; A622-Y626 PolarHBondContact O-N 2.81Å; L624-Y626 PolarHBondContact O-N 3.11Å; Y626-K628 VanDerWaalsContact C-N 3.28Å; Y626-K628 PolarHBondContact O-N 3.38Å; Y626-Q629 PolarHBondContact O-N 3Å; Y626-I677 HydrophobicContact CD2-CG2 4.3Å; Y626-I677 HydrophobicContact CG-CG2 4.5Å; Y626-C679 HydrophobicContact CE1-CB 3.97Å; Y626-C679 HydrophobicContact CE2-CB 4.2Å; Y626-C679 WeakPolarHBondContact OH-CB 3.23Å
627	G	95	Very high	95.4	Very high	10 Å²	10	36.9 Å²	36.9	10%	0.103	18%	0.178	C	C	.	.	H	α-helix	trans	-68.6	-24.9	-179.9	0	0	0	0	0	113.9	Q623 L624	Q623-G627 PolarHBondContact O-N 2.92Å; L624-G627 PolarHBondContact O-N 3.14Å
628	K	95.1	Very high	95	Very high	81 Å²	81	37.2 Å²	37.2	35%	0.352	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-3.2	170.9	-65.1	-93.6	-172.4	165	0	113.4	F611 L624 C625 Y626 M649 E911	F611-K628 HydrophobicContact CE1-CD 4.42Å; L624-K628 WeakPolarHBondContact O-CB 3.49Å; L624-K628 VanDerWaalsContact O-CG 3.3Å; L624-K628 WeakPolarHBondContact O-CG 3.22Å; L624-K628 PolarHBondContact O-N 2.98Å; C625-K628 PolarHBondContact O-N 2.9Å; Y626-K628 VanDerWaalsContact C-N 3.28Å; Y626-K628 PolarHBondContact O-N 3.38Å; K628-M649 HydrophobicContact CB-SD 3.9Å; K628-M649 HydrophobicContact CG-CE 4.16Å; K628-M649 HydrophobicContact CG-SD 4.1Å; K628-E911 IonicContact NZ-OE2 2.67Å
629	Q	93.7	Very high	94.3	Very high	152 Å²	152	41.5 Å²	41.5	71%	0.71	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.9	39.9	-178.3	-55.7	-176.8	-10.4	0	0	114.9	C625 Y626	C625-Q629 PolarHBondContact O-N 3.28Å; Y626-Q629 PolarHBondContact O-N 3Å
630	C	94.9	Very high	93.4	Very high	15 Å²	15	44 Å²	44	10%	0.101	22%	0.219	C	C	.	.			trans	-65.4	162.8	171.2	84.1	0	0	0	0	112.8	C625 M649 A650 F651	C625-C630 VanDerWaalsContact CA-SG 3.52Å; C625-C630 HydrophobicContact CB-CB 4.05Å; C625-C630 WeakPolarHBondContact CB-SG 3.32Å; C625-C630 WeakPolarHBondContact O-CB 3.31Å; C625-C630 PolarHBondContact O-N 2.6Å; C625-C630 PolarHBondContact O-SG 2.81Å; C625-C630 VanDerWaalsContact O-SG 3.35Å; C625-C630 WeakPolarHBondContact SG-CB 3.29Å; C625-C630 CovalentContact SG-SG 2.01Å; C625-C630 PolarHBondContact SG-SG 2.83Å; C630-M649 HydrophobicContact CB-CB 4.26Å; C630-M649 HydrophobicContact CB-SD 4.49Å; C630-A650 WeakPolarHBondContact CA-O 3.43Å; C630-A650 WeakPolarHBondContact CB-O 3.43Å; C630-F651 HydrophobicContact CB-CD1 4.43Å; C630-F651 HydrophobicContact CB-CE1 4.24Å
631	S	93.9	Very high	92.6	Very high	13 Å²	13	47.7 Å²	47.7	9%	0.091	25%	0.25	C	S	.	.	S	Bend	trans	-97.8	-32.9	168.1	62.1	0	0	0	0	112.7	A650 G652	S631-A650 PolarHBondContact N-O 3.41Å; S631-A650 PolarHBondContact OG-O 2.85Å; S631-G652 WeakPolarHBondContact CB-O 3.49Å
632	S	94.5	Very high	91.9	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.021	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	161.3	177	-168.3	0	0	0	0	110.1	A650 I674	S632-A650 PolarHBondContact N-O 2.8Å; S632-A650 PolarHBondContact O-N 3.3Å; S632-I674 CarbonylContact C-O 3.54Å; S632-I674 WeakPolarHBondContact CA-O 2.97Å; S632-I674 PolarHBondContact OG-O 3.48Å
633	G	94.9	Very high	91.3	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	162.3	170.8	0	0	0	0	0	112.6	L648 E673 I674	G633-L648 CarbonylContact C-O 3.51Å; G633-L648 WeakPolarHBondContact CA-O 3.47Å; G633-E673 CarbonylContact O-C 3.56Å; G633-E673 WeakPolarHBondContact O-CA 3.07Å; G633-I674 PolarHBondContact N-O 3.23Å; G633-I674 VanDerWaalsContact O-CG1 3.28Å; G633-I674 WeakPolarHBondContact O-CG1 3.3Å; G633-I674 PolarHBondContact O-N 3.23Å
634	V	95.7	Very high	90.9	Very high	10 Å²	10	59.1 Å²	59.1	6%	0.061	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	121.4	176.2	169.7	0	0	0	0	109.5	A601 Y609 I636 L648 P671 V672 E673	A601-V634 HydrophobicContact CB-CG1 4.09Å; A601-V634 HydrophobicContact CB-CG2 4.04Å; Y609-V634 HydrophobicContact CD1-CG2 4.49Å; Y609-V634 HydrophobicContact CE1-CB 4.31Å; Y609-V634 HydrophobicContact CE1-CG2 3.67Å; Y609-V634 HydrophobicContact CE2-CG2 4.17Å; Y609-V634 VanDerWaalsContact CZ-CG2 3.49Å; Y609-V634 WeakPolarHBondContact OH-CG2 3.01Å; V634-I636 HydrophobicContact CG1-CG1 4.06Å; V634-L648 HydrophobicContact CB-CB 4.37Å; V634-L648 PolarHBondContact N-O 3.1Å; V634-L648 PolarHBondContact O-N 3.37Å; V634-P671 HydrophobicContact CG1-CB 3.83Å; V634-V672 CarbonylContact C-O 3.55Å; V634-V672 VanDerWaalsContact CA-O 3.31Å; V634-V672 WeakPolarHBondContact CA-O 3.3Å; V634-E673 HydrophobicContact CG2-CB 3.91Å; V634-E673 HydrophobicContact CG2-CG 4.1Å
635	F	96.6	Very high	90.7	Very high	4 Å²	4	59 Å²	59	2%	0.018	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	121.4	173.1	-177.7	-111	0	0	0	111.4	A615 T618 C621 K637 S646 F670 V672	A615-F635 HydrophobicContact CB-CD2 4.08Å; A615-F635 HydrophobicContact CB-CE2 3.85Å; T618-F635 VanDerWaalsContact OG1-CD1 3.31Å; T618-F635 WeakPolarHBondContact OG1-CD1 3.04Å; C621-F635 HydrophobicContact CB-CB 3.99Å; C621-F635 HydrophobicContact CB-CD2 3.88Å; C621-F635 HydrophobicContact CB-CG 4.2Å; F635-K637 HydrophobicContact CE1-CB 4.03Å; F635-S646 WeakPolarHBondContact CA-O 3.35Å; F635-S646 WeakPolarHBondContact CD2-O 3.37Å; F635-F670 AromaticContact CD1-CD1 3.83Å; F635-F670 HydrophobicContact CD1-CD1 3.83Å; F635-F670 AromaticContact CD1-CE1 3.67Å; F635-F670 HydrophobicContact CD1-CE1 3.67Å; F635-F670 HydrophobicContact CE1-CD1 4.22Å; F635-F670 AromaticContact CE1-CE1 3.91Å; F635-F670 HydrophobicContact CE1-CE1 3.91Å; F635-V672 HydrophobicContact CB-CG1 4.13Å; F635-V672 PolarHBondContact N-O 3.01Å; F635-V672 PolarHBondContact O-N 2.87Å
636	I	94	Very high	90.5	Very high	69 Å²	69	60.5 Å²	60.5	35%	0.354	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	102.9	177.2	-52.1	-178.2	0	0	0	108.1	V634 G645 S646 L648 P671	V634-I636 HydrophobicContact CG1-CG1 4.06Å; I636-G645 CarbonylContact O-C 3.52Å; I636-G645 WeakPolarHBondContact O-CA 3.39Å; I636-S646 PolarHBondContact N-O 2.82Å; I636-S646 PolarHBondContact O-N 3.03Å; I636-L648 HydrophobicContact CD1-CD1 3.81Å; I636-L648 HydrophobicContact CD1-CG 4.21Å; I636-P671 HydrophobicContact CG1-CB 4.37Å
637	K	91.1	Very high	90.6	Very high	126 Å²	126	56.3 Å²	56.3	55%	0.548	33%	0.325	S	S	.	.			trans	-61.9	136.9	176.1	-171	174	-177.7	167.3	0	110.8	F635 F670	F635-K637 HydrophobicContact CE1-CB 4.03Å; K637-F670 HydrophobicContact CB-CB 4.07Å; K637-F670 HydrophobicContact CB-CD1 3.85Å; K637-F670 HydrophobicContact CB-CD2 3.99Å; K637-F670 HydrophobicContact CB-CE1 4.32Å; K637-F670 HydrophobicContact CB-CE2 4.46Å; K637-F670 HydrophobicContact CB-CG 3.67Å; K637-F670 HydrophobicContact CD-CD2 3.73Å; K637-F670 HydrophobicContact CD-CE2 3.62Å; K637-F670 HydrophobicContact CD-CG 4.3Å; K637-F670 HydrophobicContact CD-CZ 4.07Å; K637-F670 HydrophobicContact CG-CD2 4.5Å
638	P	88.2	Confident	90.6	Very high	38 Å²	38	57.8 Å²	57.8	25%	0.247	33%	0.33	C	S	.	.			trans	-69.9	152.6	-173.4	25.8	-30.9	0	0	0	113	I640 Q643 L644	P638-I640 VanDerWaalsContact C-N 3.33Å; P638-Q643 HydrophobicContact CB-CB 4.15Å; P638-Q643 WeakPolarHBondContact CG-O 3.06Å; P638-L644 WeakPolarHBondContact CB-O 3.12Å
639	V	80.6	Confident	90.6	Very high	93 Å²	93	53.9 Å²	53.9	56%	0.564	31%	0.313	S	S	*	.	S	Bend	trans	-74.9	-24.6	-178.1	-176.2	0	0	0	0	112.3	R48	R48-V639 PolarHBondContact NH2-O 2.83Å
640	I	77.7	Confident	90.5	Very high	97 Å²	97	46.7 Å²	46.7	50%	0.497	28%	0.279	S	S	.	.	S	Bend	trans	-111.7	125.5	179.1	-53.8	179.9	0	0	0	109.1	P638 G642 Q643	P638-I640 VanDerWaalsContact C-N 3.33Å; I640-G642 PolarHBondContact O-N 2.03Å; I640-Q643 HydrophobicContact CB-CG 4.32Å; I640-Q643 PolarHBondContact O-N 2.96Å
641	S	79	Confident	90.4	Very high	125 Å²	125	49.9 Å²	49.9	87%	0.874	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	124.8	174.6	-57.5	0	0	0	0	110.8
642	G	82.3	Confident	90.1	Very high	86 Å²	86	52.3 Å²	52.3	89%	0.887	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.9	-11	179.4	0	0	0	0	0	115	I640	I640-G642 PolarHBondContact O-N 2.03Å
643	Q	83.9	Confident	89.6	Confident	116 Å²	116	61.1 Å²	61.1	54%	0.542	36%	0.359	S	S	.	.	S	Bend	trans	-80.5	166.6	163.9	-71	-177.4	-33.1	0	0	111	P638 I640	P638-Q643 HydrophobicContact CB-CB 4.15Å; P638-Q643 WeakPolarHBondContact CG-O 3.06Å; I640-Q643 HydrophobicContact CB-CG 4.32Å; I640-Q643 PolarHBondContact O-N 2.96Å
644	L	89	Confident	89.1	Confident	107 Å²	107	63.6 Å²	63.6	56%	0.56	37%	0.371	S	S	*	.			trans	-81.4	150.9	165.3	-62.6	175.7	0	0	0	109.9	A614 N616 P638	A614-L644 HydrophobicContact CB-CB 4.1Å; A614-L644 HydrophobicContact CB-CD1 3.76Å; N616-L644 HydrophobicContact CB-CD2 3.73Å; P638-L644 WeakPolarHBondContact CB-O 3.12Å
645	G	91.6	Very high	88.5	Confident	6 Å²	6	69.3 Å²	69.3	6%	0.062	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	178.1	169.2	0	0	0	0	0	112.2	A614 A615 I636	A614-G645 CarbonylContact C-O 3.46Å; A614-G645 WeakPolarHBondContact CA-O 3.39Å; A615-G645 PolarHBondContact N-O 2.79Å; A615-G645 CarbonylContact O-C 3.6Å; A615-G645 WeakPolarHBondContact O-CA 3.49Å; A615-G645 PolarHBondContact O-N 2.88Å; I636-G645 CarbonylContact O-C 3.52Å; I636-G645 WeakPolarHBondContact O-CA 3.39Å
646	S	93.2	Very high	88.2	Confident	32 Å²	32	71.3 Å²	71.3	22%	0.224	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	138.1	176.7	-56.4	0	0	0	0	111	E612 F635 I636	E612-S646 WeakPolarHBondContact OE1-CB 3.33Å; E612-S646 PolarHBondContact OE1-OG 2.27Å; F635-S646 WeakPolarHBondContact CA-O 3.35Å; F635-S646 WeakPolarHBondContact CD2-O 3.37Å; I636-S646 PolarHBondContact N-O 2.82Å; I636-S646 PolarHBondContact O-N 3.03Å
647	C	97.1	Very high	87.9	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	101.5	166.5	-176	0	0	0	0	107.8	I613 A615 C621	I613-C647 HydrophobicContact CG2-CB 3.87Å; I613-C647 PolarHBondContact N-O 2.84Å; I613-C647 PolarHBondContact O-N 2.75Å; A615-C647 HydrophobicContact CB-CB 3.79Å; C621-C647 WeakPolarHBondContact CA-SG 3.37Å; C621-C647 HydrophobicContact CB-CB 3.65Å; C621-C647 WeakPolarHBondContact CB-SG 3.5Å; C621-C647 PolarHBondContact O-SG 3.35Å; C621-C647 WeakPolarHBondContact SG-CB 3.4Å; C621-C647 CovalentContact SG-SG 2.04Å; C621-C647 PolarHBondContact SG-SG 3.34Å
648	L	95	Very high	87.7	Confident	40 Å²	40	73.9 Å²	73.9	21%	0.209	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	134.3	171.5	-54.4	-178.4	0	0	0	108.1	Y609 F611 E612 G633 V634 I636	Y609-L648 HydrophobicContact CD1-CB 4.08Å; Y609-L648 HydrophobicContact CG-CB 4.08Å; F611-L648 CarbonylContact O-C 3.56Å; F611-L648 WeakPolarHBondContact O-CA 3.44Å; E612-L648 HydrophobicContact CB-CD2 3.74Å; E612-L648 HydrophobicContact CG-CD2 3.71Å; G633-L648 CarbonylContact C-O 3.51Å; G633-L648 WeakPolarHBondContact CA-O 3.47Å; V634-L648 HydrophobicContact CB-CB 4.37Å; V634-L648 PolarHBondContact N-O 3.1Å; V634-L648 PolarHBondContact O-N 3.37Å; I636-L648 HydrophobicContact CD1-CD1 3.81Å; I636-L648 HydrophobicContact CD1-CG 4.21Å
649	M	95.2	Very high	87.6	Confident	0 Å²	0	78 Å²	78	0%	0	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	146.6	178.7	-55.8	-173.2	-156.6	0	0	111.1	Y609 G610 F611 I613 L624 C625 K628 C630 F651	Y609-M649 CarbonylContact C-O 3.34Å; Y609-M649 WeakPolarHBondContact CA-O 3.02Å; G610-M649 PolarHBondContact N-O 3.23Å; F611-M649 HydrophobicContact CB-CB 4.42Å; F611-M649 HydrophobicContact CD1-CE 4.05Å; F611-M649 HydrophobicContact CD1-CG 4.34Å; F611-M649 HydrophobicContact CD1-SD 3.97Å; F611-M649 HydrophobicContact CE1-CE 4.09Å; F611-M649 HydrophobicContact CE1-SD 4.48Å; F611-M649 PolarHBondContact N-O 2.91Å; F611-M649 PolarHBondContact O-N 2.92Å; I613-M649 HydrophobicContact CB-CE 4.33Å; I613-M649 HydrophobicContact CG2-CE 3.34Å; L624-M649 HydrophobicContact CB-CE 3.78Å; C625-M649 HydrophobicContact CB-CG 4.42Å; C625-M649 HydrophobicContact CB-SD 4.27Å; K628-M649 HydrophobicContact CB-SD 3.9Å; K628-M649 HydrophobicContact CG-CE 4.16Å; K628-M649 HydrophobicContact CG-SD 4.1Å; C630-M649 HydrophobicContact CB-CB 4.26Å; C630-M649 HydrophobicContact CB-SD 4.49Å; M649-F651 HydrophobicContact CB-CE2 4.46Å; M649-F651 HydrophobicContact CB-CZ 4.27Å
650	A	92.7	Very high	88.1	Confident	1 Å²	1	78 Å²	78	1%	0.008	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	146.8	170.5	0	0	0	0	0	110.2	I607 V608 Y609 C630 S631 S632	I607-A650 HydrophobicContact CG2-CB 3.21Å; V608-A650 WeakPolarHBondContact O-CB 3.28Å; Y609-A650 HydrophobicContact CD1-CB 3.81Å; Y609-A650 HydrophobicContact CE1-CB 4.09Å; Y609-A650 HydrophobicContact CG-CB 4.37Å; C630-A650 WeakPolarHBondContact CA-O 3.43Å; C630-A650 WeakPolarHBondContact CB-O 3.43Å; S631-A650 PolarHBondContact N-O 3.41Å; S631-A650 PolarHBondContact OG-O 2.85Å; S632-A650 PolarHBondContact N-O 2.8Å; S632-A650 PolarHBondContact O-N 3.3Å
651	F	91.3	Very high	88.6	Confident	82 Å²	82	81.4 Å²	81.4	36%	0.36	47%	0.465	S	S	.	.			trans	-114.3	155.2	177.7	-54	-82.7	0	0	0	109.5	E512 F611 C630 M649	E512-F651 WeakPolarHBondContact OE1-CD2 3.18Å; F611-F651 HydrophobicContact CB-CE2 3.94Å; F611-F651 HydrophobicContact CB-CZ 4.37Å; C630-F651 HydrophobicContact CB-CD1 4.43Å; C630-F651 HydrophobicContact CB-CE1 4.24Å; M649-F651 HydrophobicContact CB-CE2 4.46Å; M649-F651 HydrophobicContact CB-CZ 4.27Å
652	G	87.9	Confident	89.3	Confident	64 Å²	64	78.7 Å²	78.7	66%	0.66	44%	0.436	S	S	*	.	S	Bend	trans	136.2	-156.4	-175.8	0	0	0	0	0	112.9	S631	S631-G652 WeakPolarHBondContact CB-O 3.49Å
653	E	84.6	Confident	89.9	Confident	187 Å²	187	76.7 Å²	76.7	87%	0.874	41%	0.406	S	S	*	.			trans	-81.8	136.3	178.3	-63.5	-162.5	156	0	0	112.6	V655	E653-V655 PolarHBondContact O-N 3.25Å
654	E	84.2	Confident	90.3	Very high	52 Å²	52	74 Å²	74	24%	0.243	40%	0.398	C	S	.	.			trans	-92.5	98	-175.7	-173.2	-164.5	-124.5	0	0	111.5	C656 C676 I677 R678	E654-C656 PolarHBondContact O-N 2.97Å; E654-C676 VanDerWaalsContact CD-CA 3.41Å; E654-C676 VanDerWaalsContact OE1-C 3.23Å; E654-C676 WeakPolarHBondContact OE1-CA 3.07Å; E654-C676 PolarHBondContact OE1-N 3.37Å; E654-I677 PolarHBondContact OE1-N 3.28Å; E654-R678 IonicContact OE1-CZ 2.65Å; E654-R678 IonicContact OE1-NH1 2.96Å; E654-R678 PolarHBondContact OE1-NH1 3.21Å; E654-R678 IonicContact OE2-CZ 2.81Å; E654-R678 IonicContact OE2-NH1 2.69Å; E654-R678 PolarHBondContact OE2-NH1 3.33Å; E654-R678 IonicContact OE2-NH2 3.22Å; E654-R678 PolarHBondContact OE2-NH2 2.83Å
655	V	83.3	Confident	90.6	Very high	130 Å²	130	72.6 Å²	72.6	79%	0.788	40%	0.397	S	S	*	.			trans	-81.3	105.1	-178	-177.4	0	0	0	0	111.4	E653	E653-V655 PolarHBondContact O-N 3.25Å
656	C	90.6	Very high	90.7	Very high	47 Å²	47	74.3 Å²	74.3	32%	0.318	40%	0.402	S	S	.	.			trans	-98.6	110.5	-176.9	-67.4	0	0	0	0	116.1	E654 Q658 C676	E654-C656 PolarHBondContact O-N 2.97Å; C656-Q658 PolarHBondContact O-N 2.92Å; C656-Q658 VanDerWaalsContact O-N 3.08Å; C656-C676 WeakPolarHBondContact CA-SG 3.46Å; C656-C676 HydrophobicContact CB-CB 4.21Å; C656-C676 WeakPolarHBondContact CB-SG 3.43Å; C656-C676 VanDerWaalsContact SG-CA 3.58Å; C656-C676 WeakPolarHBondContact SG-CB 3.49Å; C656-C676 CovalentContact SG-SG 2.04Å; C656-C676 PolarHBondContact SG-SG 3.39Å
657	D	87.4	Confident	90.6	Very high	57 Å²	57	78.8 Å²	78.8	31%	0.305	43%	0.433	S	S	.	.			trans	-66	98.6	164.6	-177.5	-9.4	0	0	0	110.8	L597 T659 K660	L597-D657 HydrophobicContact CD1-CB 4.47Å; L597-D657 WeakPolarHBondContact CD1-O 3.01Å; D657-T659 PolarHBondContact O-N 3.46Å; D657-T659 VanDerWaalsContact O-N 3.14Å; D657-T659 WeakPolarHBondContact OD1-CB 3.02Å; D657-T659 PolarHBondContact OD1-N 3.38Å; D657-T659 PolarHBondContact OD1-OG1 3.48Å; D657-K660 HydrophobicContact CB-CD 4.14Å; D657-K660 HydrophobicContact CB-CG 4.48Å; D657-K660 PolarHBondContact O-N 3.3Å; D657-K660 WeakPolarHBondContact OD2-CD 3.48Å; D657-K660 WeakPolarHBondContact OD2-CE 3.39Å; D657-K660 WeakPolarHBondContact OD2-CG 3.03Å; D657-K660 IonicContact OD2-NZ 3.72Å; D657-K660 PolarHBondContact OD2-NZ 3.2Å
658	Q	86.7	Confident	90.3	Very high	192 Å²	192	80 Å²	80	90%	0.897	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-10.1	-179.6	-59	-176.7	9.9	0	0	113.8	C656	C656-Q658 PolarHBondContact O-N 2.92Å; C656-Q658 VanDerWaalsContact O-N 3.08Å
659	T	86.4	Confident	89.8	Confident	125 Å²	125	82.7 Å²	82.7	77%	0.767	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-19.8	179.7	74.6	0	0	0	0	113	D657	D657-T659 PolarHBondContact O-N 3.46Å; D657-T659 VanDerWaalsContact O-N 3.14Å; D657-T659 WeakPolarHBondContact OD1-CB 3.02Å; D657-T659 PolarHBondContact OD1-N 3.38Å; D657-T659 PolarHBondContact OD1-OG1 3.48Å
660	K	90.3	Very high	89.5	Confident	92 Å²	92	86 Å²	86	40%	0.4	48%	0.48	S	S	.	.	S	Bend	trans	-85	141.6	179.5	-71.9	172.5	-176.2	147.7	0	111.5	L597 N599 D657	L597-K660 HydrophobicContact CD1-CB 4.23Å; L597-K660 HydrophobicContact CD2-CB 3.76Å; L597-K660 WeakPolarHBondContact CD2-O 3.45Å; N599-K660 PolarHBondContact OD1-NZ 2.65Å; D657-K660 HydrophobicContact CB-CD 4.14Å; D657-K660 HydrophobicContact CB-CG 4.48Å; D657-K660 PolarHBondContact O-N 3.3Å; D657-K660 WeakPolarHBondContact OD2-CD 3.48Å; D657-K660 WeakPolarHBondContact OD2-CE 3.39Å; D657-K660 WeakPolarHBondContact OD2-CG 3.03Å; D657-K660 IonicContact OD2-NZ 3.72Å; D657-K660 PolarHBondContact OD2-NZ 3.2Å
661	Q	90	Very high	89.4	Confident	168 Å²	168	87.9 Å²	87.9	79%	0.785	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-79.8	132.5	176.1	-175.9	174	-9.2	0	0	110.9
662	R	92.8	Very high	89.5	Confident	69 Å²	69	84 Å²	84	26%	0.26	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-69.7	132.3	170.1	-68.2	165.5	163.1	-76.8	-13.7	110.9	S595 F596 L597 C676	S595-R662 PolarHBondContact O-NH1 3.42Å; S595-R662 VanDerWaalsContact O-NH1 3.11Å; S595-R662 PolarHBondContact OG-NH1 3.05Å; F596-R662 CarbonylContact O-C 3.59Å; F596-R662 WeakPolarHBondContact O-CA 3.34Å; L597-R662 HydrophobicContact CD2-CB 4.47Å; L597-R662 HydrophobicContact CD2-CG 3.77Å; L597-R662 HydrophobicContact CG-CG 4.42Å; R662-C676 PolarHBondContact NH1-O 3.47Å; R662-C676 PolarHBondContact NH2-O 2.77Å
663	V	94.1	Very high	89.8	Confident	44 Å²	44	81.4 Å²	81.4	27%	0.267	45%	0.446	S	S	.	.	B	Isolated β-bridge	trans	-108.9	155.7	172.6	-61.7	0	0	0	0	110.4	S595 F596 T598	S595-V663 WeakPolarHBondContact CA-O 3.01Å; F596-V663 HydrophobicContact CD2-CG2 4Å; F596-V663 HydrophobicContact CE2-CG2 3.73Å; F596-V663 HydrophobicContact CZ-CG2 4.26Å; F596-V663 PolarHBondContact N-O 3.06Å; F596-V663 PolarHBondContact O-N 2.03Å; T598-V663 HydrophobicContact CG2-CG2 3.66Å
664	T	93.8	Very high	90.3	Very high	60 Å²	60	72.5 Å²	72.5	37%	0.368	40%	0.404	S	S	.	.	S	Bend	trans	-109.2	-0.3	172	63.7	0	0	0	0	112.2	I594 P682	I594-T664 WeakPolarHBondContact O-CA 3.32Å; I594-T664 WeakPolarHBondContact O-CB 3.5Å; I594-T664 WeakPolarHBondContact O-CG2 3.3Å; T664-P682 HydrophobicContact CG2-CG 4.42Å
665	S	93.6	Very high	90.8	Very high	77 Å²	77	70.6 Å²	70.6	54%	0.538	40%	0.396	S	S	.	.			trans	-156.6	150.9	174.7	54.8	0	0	0	0	110.3	E619	E619-S665 WeakPolarHBondContact OE1-CA 3.43Å
666	Y	94.4	Very high	91.4	Very high	42 Å²	42	64.4 Å²	64.4	17%	0.165	36%	0.359	C	S	.	.			trans	-137	120.3	-176.6	-175.5	-96.8	0	0	0	112.8	T598 T618 E619 G668 P669 F670 V672	T598-Y666 HydrophobicContact CG2-CD2 3.57Å; T598-Y666 HydrophobicContact CG2-CE2 4.06Å; T598-Y666 HydrophobicContact CG2-CG 4.14Å; T618-Y666 HydrophobicContact CG2-CD1 4.47Å; T618-Y666 HydrophobicContact CG2-CG 4.44Å; E619-Y666 PolarHBondContact OE1-N 2.99Å; Y666-G668 VanDerWaalsContact CE1-CA 3.45Å; Y666-G668 VanDerWaalsContact CE1-N 3.34Å; Y666-G668 VanDerWaalsContact CZ-CA 3.45Å; Y666-P669 WeakPolarHBondContact CE1-O 3.49Å; Y666-P669 WeakPolarHBondContact OH-CD 3.34Å; Y666-P669 PolarHBondContact OH-O 3.01Å; Y666-F670 HydrophobicContact CD1-CE1 4.3Å; Y666-F670 HydrophobicContact CD1-CZ 4.45Å; Y666-F670 HydrophobicContact CE1-CE1 4.44Å; Y666-V672 HydrophobicContact CD1-CB 4.11Å; Y666-V672 HydrophobicContact CD1-CG1 3.87Å; Y666-V672 HydrophobicContact CD1-CG2 4Å; Y666-V672 HydrophobicContact CD2-CG2 4.33Å; Y666-V672 HydrophobicContact CE1-CB 3.54Å; Y666-V672 HydrophobicContact CE1-CG1 3.76Å; Y666-V672 HydrophobicContact CE1-CG2 3.56Å; Y666-V672 HydrophobicContact CE2-CG2 3.9Å; Y666-V672 HydrophobicContact CG-CG2 4.34Å; Y666-V672 VanDerWaalsContact CZ-CG2 3.46Å
667	S	91.5	Very high	91.6	Very high	126 Å²	126	62.4 Å²	62.4	88%	0.881	35%	0.345	S	S	*	.			trans	-118	21.1	178.6	65	0	0	0	0	113.2
668	G	89.5	Confident	91.9	Very high	26 Å²	26	65 Å²	65	27%	0.268	35%	0.351	S	S	.	.	S	Bend	trans	-85.6	-167.2	-177	0	0	0	0	0	114.5	Y666 F670	Y666-G668 VanDerWaalsContact CE1-CA 3.45Å; Y666-G668 VanDerWaalsContact CE1-N 3.34Å; Y666-G668 VanDerWaalsContact CZ-CA 3.45Å; G668-F670 WeakPolarHBondContact O-CE2 3.42Å
669	P	86.5	Confident	92.2	Very high	96 Å²	96	57.8 Å²	57.8	62%	0.623	32%	0.321	S	S	*	.			trans	-67.1	152.1	176.9	28.9	-36.4	0	0	0	113	Y666	Y666-P669 WeakPolarHBondContact CE1-O 3.49Å; Y666-P669 WeakPolarHBondContact OH-CD 3.34Å; Y666-P669 PolarHBondContact OH-O 3.01Å
670	F	87	Confident	92.2	Very high	70 Å²	70	52.4 Å²	52.4	31%	0.307	29%	0.29	S	S	.	.	S	Bend	trans	-115.4	147.1	176.1	-57.2	-86.6	0	0	0	110.4	F635 K637 Y666 G668 V672	F635-F670 AromaticContact CD1-CD1 3.83Å; F635-F670 HydrophobicContact CD1-CD1 3.83Å; F635-F670 AromaticContact CD1-CE1 3.67Å; F635-F670 HydrophobicContact CD1-CE1 3.67Å; F635-F670 HydrophobicContact CE1-CD1 4.22Å; F635-F670 AromaticContact CE1-CE1 3.91Å; F635-F670 HydrophobicContact CE1-CE1 3.91Å; K637-F670 HydrophobicContact CB-CB 4.07Å; K637-F670 HydrophobicContact CB-CD1 3.85Å; K637-F670 HydrophobicContact CB-CD2 3.99Å; K637-F670 HydrophobicContact CB-CE1 4.32Å; K637-F670 HydrophobicContact CB-CE2 4.46Å; K637-F670 HydrophobicContact CB-CG 3.67Å; K637-F670 HydrophobicContact CD-CD2 3.73Å; K637-F670 HydrophobicContact CD-CE2 3.62Å; K637-F670 HydrophobicContact CD-CG 4.3Å; K637-F670 HydrophobicContact CD-CZ 4.07Å; K637-F670 HydrophobicContact CG-CD2 4.5Å; Y666-F670 HydrophobicContact CD1-CE1 4.3Å; Y666-F670 HydrophobicContact CD1-CZ 4.45Å; Y666-F670 HydrophobicContact CE1-CE1 4.44Å; G668-F670 WeakPolarHBondContact O-CE2 3.42Å; F670-V672 HydrophobicContact CD1-CG1 4.02Å; F670-V672 HydrophobicContact CE1-CG1 4.16Å
671	P	91.1	Very high	91.2	Very high	39 Å²	39	53.3 Å²	53.3	25%	0.253	30%	0.298	S	S	.	.	S	Bend	cis	-70.4	147.6	-0.3	29.3	-35.2	0	0	0	113.4	A601 V634 I636	A601-P671 HydrophobicContact CB-CB 4.03Å; A601-P671 HydrophobicContact CB-CG 4.08Å; A601-P671 PolarHBondContact N-O 3.25Å; V634-P671 HydrophobicContact CG1-CB 3.83Å; I636-P671 HydrophobicContact CG1-CB 4.37Å
672	V	94	Very high	89.9	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.4	176.1	58.8	0	0	0	0	109.4	T598 T618 V634 F635 Y666 F670	T598-V672 HydrophobicContact CG2-CG2 4.19Å; T618-V672 HydrophobicContact CG2-CG1 3.84Å; T618-V672 WeakPolarHBondContact OG1-CG1 3.41Å; V634-V672 CarbonylContact C-O 3.55Å; V634-V672 VanDerWaalsContact CA-O 3.31Å; V634-V672 WeakPolarHBondContact CA-O 3.3Å; F635-V672 HydrophobicContact CB-CG1 4.13Å; F635-V672 PolarHBondContact N-O 3.01Å; F635-V672 PolarHBondContact O-N 2.87Å; Y666-V672 HydrophobicContact CD1-CB 4.11Å; Y666-V672 HydrophobicContact CD1-CG1 3.87Å; Y666-V672 HydrophobicContact CD1-CG2 4Å; Y666-V672 HydrophobicContact CD2-CG2 4.33Å; Y666-V672 HydrophobicContact CE1-CB 3.54Å; Y666-V672 HydrophobicContact CE1-CG1 3.76Å; Y666-V672 HydrophobicContact CE1-CG2 3.56Å; Y666-V672 HydrophobicContact CE2-CG2 3.9Å; Y666-V672 HydrophobicContact CG-CG2 4.34Å; Y666-V672 VanDerWaalsContact CZ-CG2 3.46Å; F670-V672 HydrophobicContact CD1-CG1 4.02Å; F670-V672 HydrophobicContact CE1-CG1 4.16Å
673	E	94.4	Very high	88.5	Confident	11 Å²	11	53.9 Å²	53.9	5%	0.051	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	132	170.5	-177.4	-166.5	120.2	0	0	108.6	T598 N599 A601 S605 G633 V634	T598-E673 CarbonylContact C-O 3.43Å; T598-E673 WeakPolarHBondContact CA-O 3.37Å; N599-E673 HydrophobicContact CB-CB 4.2Å; N599-E673 PolarHBondContact N-O 2.67Å; N599-E673 PolarHBondContact ND2-OE1 2.78Å; N599-E673 PolarHBondContact O-N 3.11Å; A601-E673 HydrophobicContact CB-CB 4.04Å; S605-E673 PolarHBondContact OG-OE2 3.48Å; G633-E673 CarbonylContact O-C 3.56Å; G633-E673 WeakPolarHBondContact O-CA 3.07Å; V634-E673 HydrophobicContact CG2-CB 3.91Å; V634-E673 HydrophobicContact CG2-CG 4.1Å
674	I	95.3	Very high	86.7	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	132.4	175.9	53.7	167	0	0	0	109.6	F596 L597 T598 T618 C621 A622 S632 G633 I677	F596-I674 HydrophobicContact CD2-CB 4.11Å; F596-I674 HydrophobicContact CD2-CG2 3.51Å; F596-I674 HydrophobicContact CE2-CG2 3.77Å; F596-I674 HydrophobicContact CG-CG2 4.34Å; L597-I674 WeakPolarHBondContact O-CA 3.36Å; T598-I674 HydrophobicContact CG2-CG2 4.26Å; T618-I674 HydrophobicContact CG2-CG2 3.48Å; T618-I674 VanDerWaalsContact CG2-CG2 3.48Å; C621-I674 HydrophobicContact CB-CD1 4.24Å; A622-I674 VanDerWaalsContact CA-CD1 3.44Å; A622-I674 HydrophobicContact CB-CD1 3.67Å; S632-I674 CarbonylContact C-O 3.54Å; S632-I674 WeakPolarHBondContact CA-O 2.97Å; S632-I674 PolarHBondContact OG-O 3.48Å; G633-I674 PolarHBondContact N-O 3.23Å; G633-I674 VanDerWaalsContact O-CG1 3.28Å; G633-I674 WeakPolarHBondContact O-CG1 3.3Å; G633-I674 PolarHBondContact O-N 3.23Å; I674-I677 HydrophobicContact CD1-CD1 4.04Å; I674-I677 HydrophobicContact CG1-CD1 4.41Å
675	S	94.7	Very high	84.4	Confident	12 Å²	12	66.8 Å²	66.8	8%	0.084	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	178.4	176.3	68	0	0	0	0	110.6	L597 I677	L597-S675 PolarHBondContact N-O 2.76Å; L597-S675 PolarHBondContact O-N 3.31Å; L597-S675 VanDerWaalsContact O-N 3.11Å; S675-I677 VanDerWaalsContact C-N 3.34Å; S675-I677 PolarHBondContact O-N 3.33Å
676	C	95	Very high	81.7	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	60.7	44	175.5	-65.1	0	0	0	0	112.3	L597 E654 C656 R662 R678	L597-C676 HydrophobicContact CB-CB 4.2Å; L597-C676 HydrophobicContact CD1-CB 3.76Å; L597-C676 HydrophobicContact CG-CB 3.71Å; E654-C676 VanDerWaalsContact CD-CA 3.41Å; E654-C676 VanDerWaalsContact OE1-C 3.23Å; E654-C676 WeakPolarHBondContact OE1-CA 3.07Å; E654-C676 PolarHBondContact OE1-N 3.37Å; C656-C676 WeakPolarHBondContact CA-SG 3.46Å; C656-C676 HydrophobicContact CB-CB 4.21Å; C656-C676 WeakPolarHBondContact CB-SG 3.43Å; C656-C676 VanDerWaalsContact SG-CA 3.58Å; C656-C676 WeakPolarHBondContact SG-CB 3.49Å; C656-C676 CovalentContact SG-SG 2.04Å; C656-C676 PolarHBondContact SG-SG 3.39Å; R662-C676 PolarHBondContact NH1-O 3.47Å; R662-C676 PolarHBondContact NH2-O 2.77Å; C676-R678 PolarHBondContact O-N 3.44Å
677	I	95	Very high	79.2	Confident	5 Å²	5	72.7 Å²	72.7	3%	0.026	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	124.7	-166.4	-46.1	-175.8	0	0	0	109.4	I594 F596 A622 C625 Y626 E654 I674 S675	I594-I677 HydrophobicContact CD1-CG2 3.61Å; I594-I677 HydrophobicContact CG1-CG2 3.75Å; F596-I677 HydrophobicContact CB-CG1 4.21Å; A622-I677 HydrophobicContact CB-CD1 4.44Å; A622-I677 HydrophobicContact CB-CG2 4.33Å; C625-I677 HydrophobicContact CB-CD1 3.79Å; Y626-I677 HydrophobicContact CD2-CG2 4.3Å; Y626-I677 HydrophobicContact CG-CG2 4.5Å; E654-I677 PolarHBondContact OE1-N 3.28Å; I674-I677 HydrophobicContact CD1-CD1 4.04Å; I674-I677 HydrophobicContact CG1-CD1 4.41Å; S675-I677 VanDerWaalsContact C-N 3.34Å; S675-I677 PolarHBondContact O-N 3.33Å
678	R	94	Very high	76.5	Confident	112 Å²	112	73.2 Å²	73.2	42%	0.423	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	137	179.2	-65.6	-67.5	179.3	-79.7	-4.7	110.7	S595 E654 C676	S595-R678 PolarHBondContact N-O 2.85Å; S595-R678 PolarHBondContact O-N 2.8Å; S595-R678 PolarHBondContact OG-O 2.89Å; E654-R678 IonicContact OE1-CZ 2.65Å; E654-R678 IonicContact OE1-NH1 2.96Å; E654-R678 PolarHBondContact OE1-NH1 3.21Å; E654-R678 IonicContact OE2-CZ 2.81Å; E654-R678 IonicContact OE2-NH1 2.69Å; E654-R678 PolarHBondContact OE2-NH1 3.33Å; E654-R678 IonicContact OE2-NH2 3.22Å; E654-R678 PolarHBondContact OE2-NH2 2.83Å; C676-R678 PolarHBondContact O-N 3.44Å
679	C	93.1	Very high	74	Confident	40 Å²	40	77.7 Å²	77.7	27%	0.27	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	135.6	165.5	-169	0	0	0	0	110.3	C590 Y626	C590-C679 WeakPolarHBondContact CA-SG 3.27Å; C590-C679 HydrophobicContact CB-CB 3.74Å; C590-C679 WeakPolarHBondContact CB-SG 3.26Å; C590-C679 WeakPolarHBondContact SG-CA 3.37Å; C590-C679 WeakPolarHBondContact SG-CB 3.27Å; C590-C679 CovalentContact SG-SG 2.03Å; C590-C679 PolarHBondContact SG-SG 3.07Å; Y626-C679 HydrophobicContact CE1-CB 3.97Å; Y626-C679 HydrophobicContact CE2-CB 4.2Å; Y626-C679 WeakPolarHBondContact OH-CB 3.23Å
680	G	85.6	Confident	71.6	Confident	12 Å²	12	81.5 Å²	81.5	12%	0.124	41%	0.413	C	S	.	.	S	Bend	trans	113.7	151.6	172.1	0	0	0	0	0	114.8	E592 N593	E592-G680 WeakPolarHBondContact OE2-CA 3.45Å; N593-G680 CarbonylContact O-C 3.48Å; N593-G680 VanDerWaalsContact O-C 3.31Å; N593-G680 WeakPolarHBondContact O-CA 3.35Å; N593-G680 PolarHBondContact O-N 2.67Å
681	I	69.8	Low	68.9	Low	110 Å²	110	82.4 Å²	82.4	56%	0.564	43%	0.433	S	S	*	.			trans	-63.7	128.4	-178.7	-58.6	176.7	0	0	0	109.9	E592 N593 K683	E592-I681 PolarHBondContact OE2-N 2.93Å; N593-I681 HydrophobicContact CB-CG1 4.44Å; I681-K683 PolarHBondContact O-N 2.82Å
682	P	63.1	Low	66.4	Low	53 Å²	53	88.2 Å²	88.2	34%	0.344	46%	0.462	S	S	.	.			trans	-64.6	103.9	173.8	26.4	-33.2	0	0	0	109.7	T664 K684	T664-P682 HydrophobicContact CG2-CG 4.42Å; P682-K684 PolarHBondContact O-N 2.92Å
683	K	62.5	Low	63.4	Low	197 Å²	197	95.1 Å²	95.1	86%	0.857	50%	0.504	S	S	*	.			trans	-55.6	112.2	175.7	-67.1	-178.8	-179.1	177.5	0	108.6	I681 Q685	I681-K683 PolarHBondContact O-N 2.82Å; K683-Q685 PolarHBondContact O-N 3.19Å
684	K	56.1	Low	60.7	Low	205 Å²	205	98.9 Å²	98.9	89%	0.891	54%	0.537	S	S	*	.			trans	-54.7	102.9	175.5	-82.7	-175.5	174.5	178.5	0	109.2	P682 S686	P682-K684 PolarHBondContact O-N 2.92Å; K684-S686 PolarHBondContact O-N 3.01Å
685	Q	47	Very low	57.6	Low	169 Å²	169	105.4 Å²	105.4	79%	0.79	58%	0.577	S	S	*	*			trans	-69.7	103.6	165.4	-74.2	-173.7	-11.6	0	0	107.4	K683 I687	K683-Q685 PolarHBondContact O-N 3.19Å; Q685-I687 HydrophobicContact CB-CG1 4.3Å; Q685-I687 PolarHBondContact O-N 2.91Å
686	S	36.5	Very low	54.8	Low	114 Å²	114	110.4 Å²	110.4	80%	0.797	61%	0.612	S	S	*	*			trans	-69.8	84.3	168	53.3	0	0	0	0	108.6	K684 D688	K684-S686 PolarHBondContact O-N 3.01Å; S686-D688 VanDerWaalsContact C-N 3.29Å; S686-D688 PolarHBondContact O-N 2.78Å
687	I	41.3	Very low	51.8	Low	130 Å²	130	121.1 Å²	121.1	67%	0.667	65%	0.653	S	S	*	*			trans	-74	89.1	172.7	-46.8	-178.2	0	0	0	107.5	Q685 V689	Q685-I687 HydrophobicContact CB-CG1 4.3Å; Q685-I687 PolarHBondContact O-N 2.91Å; I687-V689 VanDerWaalsContact C-N 3.3Å; I687-V689 HydrophobicContact CB-CG2 4.33Å; I687-V689 HydrophobicContact CG2-CG2 3.57Å; I687-V689 PolarHBondContact O-N 2.57Å
688	D	34.2	Very low	48.9	Very low	136 Å²	136	128.5 Å²	128.5	73%	0.727	69%	0.691	S	S	*	*			trans	-71.1	86.7	169.3	-175.4	9.2	0	0	0	108.7	S686 K690	S686-D688 VanDerWaalsContact C-N 3.29Å; S686-D688 PolarHBondContact O-N 2.78Å; D688-K690 PolarHBondContact O-N 3.02Å
689	V	38.3	Very low	46.1	Very low	120 Å²	120	129.4 Å²	129.4	73%	0.727	70%	0.702	S	S	*	*			trans	-75	65	-179.5	-170.1	0	0	0	0	110.2	I687 A691	I687-V689 VanDerWaalsContact C-N 3.3Å; I687-V689 HydrophobicContact CB-CG2 4.33Å; I687-V689 HydrophobicContact CG2-CG2 3.57Å; I687-V689 PolarHBondContact O-N 2.57Å; V689-A691 PolarHBondContact O-N 2.97Å
690	K	35	Very low	43.2	Very low	177 Å²	177	133.7 Å²	133.7	77%	0.77	73%	0.731	S	S	*	*			trans	-79.5	99.3	171.4	-158.5	165.8	-167.6	167.2	0	109.2	D688 N692	D688-K690 PolarHBondContact O-N 3.02Å; K690-N692 PolarHBondContact O-N 2.8Å
691	A	31.4	Very low	40.8	Very low	89 Å²	89	144.1 Å²	144.1	74%	0.736	77%	0.767	S	S	*	*			trans	-56.5	130.9	-171.8	0	0	0	0	0	113.4	V689	V689-A691 PolarHBondContact O-N 2.97Å
692	N	37.3	Very low	39.1	Very low	161 Å²	161	148.7 Å²	148.7	86%	0.861	78%	0.777	S	S	*	*			trans	-152.2	127.7	159.7	-104	-43.7	0	0	0	110.7	K690	K690-N692 PolarHBondContact O-N 2.8Å
693	V	32.4	Very low	38	Very low	144 Å²	144	152.2 Å²	152.2	87%	0.873	80%	0.8	S	S	*	*			trans	-88.1	112.3	177.7	175.7	0	0	0	0	108.9
694	A	36.2	Very low	36.7	Very low	91 Å²	91	148.9 Å²	148.9	75%	0.752	79%	0.792	S	S	*	*			trans	-142.6	90.5	177.3	0	0	0	0	0	111.9	S696	A694-S696 PolarHBondContact O-N 3.06Å
695	T	31.5	Very low	35.7	Very low	136 Å²	136	143.6 Å²	143.6	83%	0.834	79%	0.786	S	S	*	*			trans	-67.7	118.8	176.6	-48.6	0	0	0	0	111
696	S	35.2	Very low	35.3	Very low	118 Å²	118	145.4 Å²	145.4	83%	0.825	79%	0.791	S	S	*	*			trans	-154.2	160.8	169.3	-89.6	0	0	0	0	113.7	A694	A694-S696 PolarHBondContact O-N 3.06Å
697	R	32	Very low	35.3	Very low	225 Å²	225	144.5 Å²	144.5	85%	0.849	79%	0.785	S	S	*	*			trans	-105.9	137	-160.7	-57.8	169.8	179.8	152.2	-2.4	112.7
698	I	35.1	Very low	35.2	Very low	160 Å²	160	145.3 Å²	145.3	82%	0.821	79%	0.791	S	S	*	*			trans	-134.7	101.9	161.3	-54.4	177.2	0	0	0	104.5
699	I	34	Very low	35.3	Very low	131 Å²	131	145.6 Å²	145.6	67%	0.672	80%	0.797	S	S	*	*				61.2	71.7	62.4	-46.8	178.8	0	0	0	111.8
700	C	31.8	Very low	35.3	Very low	130 Å²	130	147.8 Å²	147.8	88%	0.878	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-86.8	121.4	157.2	-65.3	0	0	0	0	108.7
701	R	35.5	Very low	35.3	Very low	231 Å²	231	145.5 Å²	145.5	87%	0.872	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-87.5	141.8	170.5	-78.9	178.5	168.1	154.9	-5.3	109.8
702	R	33.7	Very low	35.5	Very low	205 Å²	205	149 Å²	149	77%	0.774	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-80.5	157	157.7	-65.7	-174.6	-173.5	168.6	0	110.5	D704	R702-D704 IonicContact NH1-OD1 2.56Å
703	P	40.1	Very low	35.3	Very low	127 Å²	127	149.7 Å²	149.7	83%	0.825	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-103.7	149.4	131.7	-0.9	21.2	0	0	0	109.8
704	D	36.3	Very low	35.3	Very low	128 Å²	128	149.3 Å²	149.3	68%	0.684	80%	0.797	S	S	*	*			trans	-104.6	163.9	178.2	-61.7	-74.7	0	0	0	112.2	R702	R702-D704 IonicContact NH1-OD1 2.56Å
705	A	35.5	Very low	35.3	Very low	94 Å²	94	149.5 Å²	149.5	78%	0.777	80%	0.798	S	S	*	*			trans	-48.9	161.8	-167.4	0	0	0	0	0	120.4
706	K	38.3	Very low	35.4	Very low	207 Å²	207	149.7 Å²	149.7	90%	0.9	80%	0.799	S	S	*	*				-160.9	177.1	119	-108.2	172.7	-176.2	-169.4	0	114.3
707	S	35.7	Very low	35.8	Very low	95 Å²	95	153.6 Å²	153.6	66%	0.664	80%	0.802	S	S	*	*			trans	-84	179	-165.6	50	0	0	0	0	113.5
708	D	39.3	Very low	36	Very low	146 Å²	146	148.6 Å²	148.6	78%	0.781	80%	0.798	S	S	*	*				-156.7	164.6	66.6	-68.5	-33.1	0	0	0	114
709	V	36.9	Very low	35.9	Very low	142 Å²	142	149.1 Å²	149.1	86%	0.861	80%	0.802	S	S	*	*			trans	-149.4	124.8	-179.9	175.4	0	0	0	0	111.6
710	E	37.8	Very low	35.7	Very low	167 Å²	167	151.1 Å²	151.1	78%	0.78	81%	0.808	S	S	*	*			trans	-169	154.5	158.2	-82.5	-153.5	131.7	0	0	106.8
711	N	35.6	Very low	35.7	Very low	129 Å²	129	153.8 Å²	153.8	69%	0.69	81%	0.808	S	S	*	*			cis	-161.4	163.6	-9.8	-112.4	-24.6	0	0	0	109.9
712	L	34.9	Very low	35.6	Very low	163 Å²	163	150.5 Å²	150.5	85%	0.853	81%	0.806	S	S	*	*			trans	144.4	113.8	130.6	-167.1	69.7	0	0	0	114.5
713	H	33.2	Very low	35.5	Very low	174 Å²	174	144.9 Å²	144.9	81%	0.806	80%	0.798	S	S	*	*			trans	-94.5	169.1	162.7	-76.4	-51.2	0	0	0	109.6
714	T	32.7	Very low	35	Very low	137 Å²	137	146.5 Å²	146.5	84%	0.84	80%	0.8	S	S	*	*				177.8	144.1	61	-48.8	0	0	0	0	110.4
715	A	35.8	Very low	34.7	Very low	94 Å²	94	145.1 Å²	145.1	78%	0.777	81%	0.806	S	S	*	*			trans	167	126.6	136.3	0	0	0	0	0	112.5
716	T	34.5	Very low	34.5	Very low	140 Å²	140	147.1 Å²	147.1	86%	0.859	81%	0.809	S	S	*	*			trans	-140.8	148.9	175.2	-47.8	0	0	0	0	110.1
717	K	42.2	Very low	34.7	Very low	200 Å²	200	144.9 Å²	144.9	87%	0.87	81%	0.805	S	S	*	*			trans	-137.8	135.9	161.4	-106.7	-174	175.7	-177	0	110.3
718	P	36.2	Very low	35	Very low	121 Å²	121	144 Å²	144	79%	0.786	80%	0.804	S	S	*	*			trans	-95.8	165.2	-177.1	38.1	-35.7	0	0	0	112.9
719	L	33.8	Very low	35.5	Very low	170 Å²	170	142.7 Å²	142.7	89%	0.89	79%	0.793	S	S	*	*			trans	-149.8	156.5	158.3	-116.4	159.4	0	0	0	109.8
720	Q	30.8	Very low	37.3	Very low	173 Å²	173	143.1 Å²	143.1	81%	0.808	78%	0.779	S	S	*	*			trans	-88.3	176.2	-179.7	-67.6	165.4	-102.1	0	0	111
721	E	30.2	Very low	39.5	Very low	186 Å²	186	139.3 Å²	139.3	87%	0.869	77%	0.767	S	S	*	*			trans	70.6	142	-176.5	-47.9	-178	132.7	0	0	110.5
722	I	34.8	Very low	42	Very low	162 Å²	162	133.1 Å²	133.1	83%	0.831	73%	0.734	S	S	*	*			cis	-140.6	151.5	44.8	-78	156.2	0	0	0	110.9
723	S	30.2	Very low	44.3	Very low	88 Å²	88	133 Å²	133	62%	0.615	73%	0.733	S	S	*	*			trans	-78.3	158.2	171.6	49.1	0	0	0	0	112.6
724	N	30.3	Very low	46.8	Very low	160 Å²	160	127 Å²	127	86%	0.856	71%	0.707	S	S	*	*			trans	78.9	92.1	177.9	-41	-46.4	0	0	0	114.8
725	A	29.3	Very low	49.5	Very low	99 Å²	99	125.8 Å²	125.8	82%	0.818	70%	0.696	S	S	*	*			trans	-144.1	152.6	163.3	0	0	0	0	0	111.6
726	T	31.6	Very low	52.2	Low	137 Å²	137	121.8 Å²	121.8	84%	0.84	66%	0.661	S	S	*	*			trans	-20.4	148.8	172.7	-36.2	0	0	0	0	118.4	A728	T726-A728 PolarHBondContact O-N 2.82Å
727	I	43.9	Very low	55.1	Low	159 Å²	159	115.1 Å²	115.1	82%	0.815	62%	0.621	S	S	*	*			trans	-70.2	85.2	176.5	-51.5	177	0	0	0	110.8
728	A	40.9	Very low	57.6	Low	77 Å²	77	105.6 Å²	105.6	64%	0.636	58%	0.579	S	S	*	*			trans	-69.6	152.3	166.6	0	0	0	0	0	111.5	T726 R730	T726-A728 PolarHBondContact O-N 2.82Å; A728-R730 PolarHBondContact O-N 2.93Å
729	H	50.9	Low	60.4	Low	118 Å²	118	99.9 Å²	99.9	55%	0.546	54%	0.542	S	S	.	.			trans	-56.1	128.2	-179.4	-86.7	-82.2	0	0	0	112.6	L519 T731	L519-H729 HydrophobicContact CD2-CB 4.4Å; H729-T731 PolarHBondContact O-N 3.44Å
730	R	73.5	Confident	63.1	Low	151 Å²	151	93.9 Å²	93.9	57%	0.57	51%	0.51	S	S	*	.			trans	-98.9	70.5	-177.5	-69.2	-172.2	174	-174.1	-0.6	112.4	A728 C732 Y768	A728-R730 PolarHBondContact O-N 2.93Å; R730-C732 PolarHBondContact O-N 3.22Å; R730-Y768 HydrophobicContact CB-CD1 4.3Å; R730-Y768 HydrophobicContact CB-CE1 3.72Å; R730-Y768 VanDerWaalsContact O-CD1 3.31Å; R730-Y768 WeakPolarHBondContact O-CD1 3.28Å; R730-Y768 VanDerWaalsContact O-CE1 3.24Å; R730-Y768 WeakPolarHBondContact O-CE1 3.48Å
731	T	84.6	Confident	65.8	Low	87 Å²	87	87.1 Å²	87.1	53%	0.534	48%	0.481	S	S	.	.			trans	-63.9	127.2	170.8	-41.8	0	0	0	0	110.2	H729 L733	H729-T731 PolarHBondContact O-N 3.44Å; T731-L733 HydrophobicContact CG2-CD2 4.13Å
732	C	88	Confident	68.1	Low	0 Å²	0	86.4 Å²	86.4	0%	0	48%	0.477	C	S	.	.			trans	-97.6	105.1	173.1	-171.8	0	0	0	0	110.5	R730 L734 V736 K765 Y768 E769 C821	R730-C732 PolarHBondContact O-N 3.22Å; C732-L734 PolarHBondContact O-N 2.57Å; C732-L734 PolarHBondContact SG-O 3.26Å; C732-V736 HydrophobicContact CB-CG2 3.92Å; C732-V736 WeakPolarHBondContact SG-CG2 3.48Å; C732-K765 PolarHBondContact O-NZ 3.32Å; C732-Y768 HydrophobicContact CB-CD1 3.73Å; C732-Y768 HydrophobicContact CB-CE1 3.85Å; C732-E769 PolarHBondContact N-OE1 2.85Å; C732-C821 WeakPolarHBondContact CA-SG 3.33Å; C732-C821 HydrophobicContact CB-CB 3.86Å; C732-C821 WeakPolarHBondContact CB-SG 3.37Å; C732-C821 WeakPolarHBondContact SG-CB 3.26Å; C732-C821 CovalentContact SG-SG 2.04Å; C732-C821 PolarHBondContact SG-SG 3.44Å
733	L	82.6	Confident	69.7	Low	159 Å²	159	81.9 Å²	81.9	83%	0.832	46%	0.459	S	S	*	.			trans	-81.5	-1.2	176.1	-59.4	179.2	0	0	0	113.3	T731	T731-L733 HydrophobicContact CG2-CD2 4.13Å
734	L	86	Confident	70.9	Confident	50 Å²	50	81.3 Å²	81.3	26%	0.262	46%	0.455	S	S	.	.	S	Bend	trans	-127.4	-172	-175.5	-78.4	170.6	0	0	0	110.9	C732 V823 F826	C732-L734 PolarHBondContact O-N 2.57Å; C732-L734 PolarHBondContact SG-O 3.26Å; L734-V823 HydrophobicContact CD1-CG1 4.28Å; L734-F826 HydrophobicContact CD1-CE2 4.3Å; L734-F826 HydrophobicContact CD2-CD2 4.34Å; L734-F826 HydrophobicContact CD2-CE2 3.79Å; L734-F826 HydrophobicContact CD2-CZ 4.4Å; L734-F826 HydrophobicContact CG-CE2 4.49Å
735	N	88.9	Confident	71.8	Confident	111 Å²	111	83.2 Å²	83.2	59%	0.594	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-67.4	140.4	174.7	-66.3	-24.9	0	0	0	110.5	T805 D822	N735-T805 HydrophobicContact CB-CG2 4.28Å; N735-D822 PolarHBondContact O-N 3.48Å
736	V	93.7	Very high	72.7	Confident	9 Å²	9	82 Å²	82	6%	0.055	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	126.7	172.1	176.5	0	0	0	0	108.3	C732 F738 A764 K765 T805 I819 R820	C732-V736 HydrophobicContact CB-CG2 3.92Å; C732-V736 WeakPolarHBondContact SG-CG2 3.48Å; V736-F738 HydrophobicContact CG1-CD1 4.49Å; V736-A764 HydrophobicContact CG1-CB 3.94Å; V736-K765 HydrophobicContact CG2-CB 3.96Å; V736-K765 HydrophobicContact CG2-CG 4.27Å; V736-T805 WeakPolarHBondContact O-CA 3.45Å; V736-I819 HydrophobicContact CG1-CG2 3.47Å; V736-I819 VanDerWaalsContact CG1-CG2 3.47Å; V736-R820 CarbonylContact C-O 3.51Å; V736-R820 VanDerWaalsContact CA-O 3.26Å; V736-R820 WeakPolarHBondContact CA-O 3.48Å; V736-R820 WeakPolarHBondContact CG1-O 3.37Å
737	S	94.5	Very high	73.6	Confident	1 Å²	1	78.7 Å²	78.7	1%	0.007	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	142.4	172.6	72.4	0	0	0	0	110.8	Y804 I819 R820 D822	S737-Y804 WeakPolarHBondContact CA-O 3.35Å; S737-I819 WeakPolarHBondContact O-CA 3.35Å; S737-R820 PolarHBondContact N-O 2.89Å; S737-R820 PolarHBondContact O-N 2.04Å; S737-D822 WeakPolarHBondContact CB-OD1 3.11Å; S737-D822 VanDerWaalsContact CB-OD2 3.27Å; S737-D822 WeakPolarHBondContact CB-OD2 3.18Å; S737-D822 VanDerWaalsContact OG-CG 3.26Å; S737-D822 PolarHBondContact OG-OD1 3.43Å; S737-D822 PolarHBondContact OG-OD2 2.91Å
738	F	95.2	Very high	74.1	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	150.1	-174.5	51.9	-89.6	0	0	0	111.9	V736 I740 V760 A761 A764 R803 Y804 A807 I816 I819	V736-F738 HydrophobicContact CG1-CD1 4.49Å; F738-I740 HydrophobicContact CD2-CG1 4Å; F738-I740 HydrophobicContact CE2-CD1 4.09Å; F738-I740 HydrophobicContact CE2-CG1 3.96Å; F738-V760 HydrophobicContact CE2-CG1 3.74Å; F738-V760 HydrophobicContact CZ-CG1 4.01Å; F738-A761 HydrophobicContact CE1-CB 4.16Å; F738-A761 HydrophobicContact CZ-CB 4.43Å; F738-A764 HydrophobicContact CB-CB 4.26Å; F738-A764 HydrophobicContact CD1-CB 3.43Å; F738-A764 VanDerWaalsContact CD1-CB 3.43Å; F738-A764 HydrophobicContact CE1-CB 3.87Å; F738-A764 HydrophobicContact CG-CB 3.88Å; F738-R803 WeakPolarHBondContact O-CA 3.18Å; F738-Y804 WeakPolarHBondContact CD1-O 3.04Å; F738-Y804 WeakPolarHBondContact CE1-O 3.24Å; F738-Y804 PolarHBondContact N-O 2.96Å; F738-Y804 PolarHBondContact O-N 3.23Å; F738-A807 HydrophobicContact CE2-CB 4.26Å; F738-A807 HydrophobicContact CZ-CB 4.4Å; F738-I816 HydrophobicContact CB-CG2 3.57Å; F738-I816 HydrophobicContact CD2-CG2 3.74Å; F738-I816 HydrophobicContact CG-CG2 3.78Å; F738-I819 HydrophobicContact CB-CG1 4.28Å
739	E	93.7	Very high	74.5	Confident	1 Å²	1	78 Å²	78	1%	0.005	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	130.2	171.5	-73.9	166	-129.5	0	0	108.3	S799 G800 T801 R803 Q817 C818	E739-S799 PolarHBondContact OE2-N 3.48Å; E739-G800 PolarHBondContact OE2-N 2.83Å; E739-T801 WeakPolarHBondContact CB-OG1 3.16Å; E739-T801 WeakPolarHBondContact CG-OG1 3.28Å; E739-T801 PolarHBondContact OE2-N 2.04Å; E739-T801 PolarHBondContact OE2-OG1 3.41Å; E739-R803 HydrophobicContact CG-CG 3.71Å; E739-R803 IonicContact OE1-CZ 2.76Å; E739-R803 VanDerWaalsContact OE1-CZ 3.31Å; E739-R803 IonicContact OE1-NE 2.6Å; E739-R803 PolarHBondContact OE1-NE 3.43Å; E739-R803 VanDerWaalsContact OE1-NE 3.07Å; E739-R803 IonicContact OE1-NH2 3.33Å; E739-R803 PolarHBondContact OE1-NH2 2.94Å; E739-Q817 HydrophobicContact CB-CG 4.05Å; E739-Q817 PolarHBondContact N-O 3.14Å; E739-Q817 PolarHBondContact O-N 3.03Å; E739-C818 HydrophobicContact CB-CB 3.97Å; E739-C818 VanDerWaalsContact CD-CB 3.48Å; E739-C818 HydrophobicContact CG-CB 3.86Å; E739-C818 WeakPolarHBondContact OE1-CB 3.35Å; E739-C818 PolarHBondContact OE1-SG 2.88Å; E739-C818 VanDerWaalsContact OE1-SG 3.39Å; E739-C818 PolarHBondContact OE2-SG 3.35Å
740	I	91.8	Very high	75.4	Confident	43 Å²	43	73 Å²	73	22%	0.221	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	136.5	170	-61.9	174.3	0	0	0	108.2	F738 Y804 A807 I814 Q815	F738-I740 HydrophobicContact CD2-CG1 4Å; F738-I740 HydrophobicContact CE2-CD1 4.09Å; F738-I740 HydrophobicContact CE2-CG1 3.96Å; I740-Y804 HydrophobicContact CB-CD2 4.18Å; I740-Y804 HydrophobicContact CB-CE2 4.08Å; I740-Y804 HydrophobicContact CD1-CD2 3.85Å; I740-Y804 HydrophobicContact CD1-CE2 4.21Å; I740-Y804 HydrophobicContact CD1-CG 4.14Å; I740-Y804 HydrophobicContact CG1-CD2 3.78Å; I740-Y804 HydrophobicContact CG1-CE2 4.16Å; I740-Y804 HydrophobicContact CG1-CG 4.47Å; I740-A807 HydrophobicContact CD1-CB 3.48Å; I740-A807 VanDerWaalsContact CD1-CB 3.48Å; I740-I814 HydrophobicContact CG2-CB 4.43Å; I740-Q815 WeakPolarHBondContact CA-O 3.35Å
741	V	87.4	Confident	75.7	Confident	32 Å²	32	68 Å²	68	19%	0.194	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	146.9	173.8	-167.4	0	0	0	0	108.5	Q815 Q817	V741-Q815 PolarHBondContact N-O 2.85Å; V741-Q815 PolarHBondContact O-N 3.26Å; V741-Q817 VanDerWaalsContact CG2-CD 3.47Å; V741-Q817 HydrophobicContact CG2-CG 3.87Å
742	E	77.5	Confident	75.5	Confident	170 Å²	170	66.3 Å²	66.3	79%	0.794	35%	0.352	S	S	*	.			trans	-55.6	143.5	165.8	-66.5	-173.4	147.2	0	0	109.5	S744	E742-S744 VanDerWaalsContact C-N 3.32Å; E742-S744 PolarHBondContact O-N 2.89Å
743	P	69.7	Low	75.3	Confident	68 Å²	68	68.3 Å²	68.3	44%	0.442	37%	0.367	S	S	.	.			trans	-68.1	87.4	-175.5	28.8	-36.7	0	0	0	111.3	F745 P813	P743-F745 PolarHBondContact O-N 3.47Å; P743-P813 WeakPolarHBondContact CG-O 3.39Å
744	S	55.9	Low	75.5	Confident	75 Å²	75	66 Å²	66	52%	0.524	35%	0.352	S	S	.	.			trans	-76.6	46.4	-172.3	49	0	0	0	0	113.5	E742 H746	E742-S744 VanDerWaalsContact C-N 3.32Å; E742-S744 PolarHBondContact O-N 2.89Å; S744-H746 VanDerWaalsContact C-N 3.25Å; S744-H746 PolarHBondContact O-N 2.78Å; S744-H746 VanDerWaalsContact O-N 3.09Å
745	F	48	Very low	75.6	Confident	200 Å²	200	70 Å²	70	88%	0.877	36%	0.363	S	S	*	.			trans	45.7	41.4	173.9	-81.1	-81.7	0	0	0	115.7	P743 S747	P743-F745 PolarHBondContact O-N 3.47Å; F745-S747 PolarHBondContact O-N 2.78Å
746	H	48.2	Very low	75.8	Confident	73 Å²	73	70.3 Å²	70.3	34%	0.338	36%	0.359	S	S	.	.			trans	-50.6	118.1	150.4	-78.5	-86.1	0	0	0	108.8	S744 D750 Q815	S744-H746 VanDerWaalsContact C-N 3.25Å; S744-H746 PolarHBondContact O-N 2.78Å; S744-H746 VanDerWaalsContact O-N 3.09Å; H746-D750 HydrophobicContact CB-CB 4.24Å; H746-D750 IonicContact CE1-OD2 3.42Å; H746-D750 IonicContact CG-OD2 2.68Å; H746-D750 IonicContact ND1-OD2 3.55Å; H746-D750 PolarHBondContact ND1-OD2 2.01Å; H746-Q815 PolarHBondContact CD2-NE2 2.85Å; H746-Q815 VanDerWaalsContact CD2-NE2 3.31Å; H746-Q815 PolarHBondContact CD2-OE1 3.39Å; H746-Q815 VanDerWaalsContact CD2-OE1 3.22Å; H746-Q815 PolarHBondContact NE2-NE2 3.04Å
747	S	51.7	Low	75.7	Confident	68 Å²	68	70 Å²	70	48%	0.476	36%	0.358	S	S	.	.			trans	-54.2	139.2	175.2	35	0	0	0	0	109.5	F745 S749 D750	F745-S747 PolarHBondContact O-N 2.78Å; S747-S749 VanDerWaalsContact CB-OG 3.31Å; S747-S749 WeakPolarHBondContact CB-OG 3.41Å; S747-S749 PolarHBondContact O-N 2.86Å; S747-S749 PolarHBondContact O-OG 3.01Å; S747-S749 PolarHBondContact OG-OG 2.68Å; S747-S749 VanDerWaalsContact OG-OG 3.08Å; S747-D750 WeakPolarHBondContact O-CB 3.19Å; S747-D750 VanDerWaalsContact O-CG 3.24Å; S747-D750 PolarHBondContact O-N 3.01Å; S747-D750 PolarHBondContact OG-OD1 3.39Å
748	K	53.8	Low	75.4	Confident	132 Å²	132	75.5 Å²	75.5	57%	0.574	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-57.4	-21.1	-174.2	-69.2	-167.7	-170.2	167.9	0	114.4	Y89 D750 F751	Y89-K748 HydrophobicContact CE1-CD 4.09Å; Y89-K748 HydrophobicContact CE2-CD 4.34Å; Y89-K748 WeakPolarHBondContact OH-CD 3.01Å; Y89-K748 WeakPolarHBondContact OH-CG 3.32Å; K748-D750 PolarHBondContact O-N 3.38Å; K748-F751 PolarHBondContact O-N 2.85Å
749	S	48.5	Very low	75.3	Confident	90 Å²	90	76.9 Å²	76.9	63%	0.629	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-52.8	-23.1	167.1	51.9	0	0	0	0	114.8	S747 F751	S747-S749 VanDerWaalsContact CB-OG 3.31Å; S747-S749 WeakPolarHBondContact CB-OG 3.41Å; S747-S749 PolarHBondContact O-N 2.86Å; S747-S749 PolarHBondContact O-OG 3.01Å; S747-S749 PolarHBondContact OG-OG 2.68Å; S747-S749 VanDerWaalsContact OG-OG 3.08Å; S749-F751 VanDerWaalsContact C-N 3.31Å
750	D	70.1	Confident	75.3	Confident	12 Å²	12	76.9 Å²	76.9	6%	0.064	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-76	-22.6	-175.9	-70.1	19.1	0	0	0	112.1	H746 S747 K748 S792 K794	H746-D750 HydrophobicContact CB-CB 4.24Å; H746-D750 IonicContact CE1-OD2 3.42Å; H746-D750 IonicContact CG-OD2 2.68Å; H746-D750 IonicContact ND1-OD2 3.55Å; H746-D750 PolarHBondContact ND1-OD2 2.01Å; S747-D750 WeakPolarHBondContact O-CB 3.19Å; S747-D750 VanDerWaalsContact O-CG 3.24Å; S747-D750 PolarHBondContact O-N 3.01Å; S747-D750 PolarHBondContact OG-OD1 3.39Å; K748-D750 PolarHBondContact O-N 3.38Å; D750-S792 WeakPolarHBondContact O-CB 3.26Å; D750-S792 PolarHBondContact O-OG 2.93Å; D750-K794 HydrophobicContact CB-CD 4.42Å; D750-K794 VanDerWaalsContact CG-CE 3.43Å; D750-K794 IonicContact OD1-NZ 2.7Å; D750-K794 PolarHBondContact OD1-NZ 2.88Å; D750-K794 WeakPolarHBondContact OD2-CE 3.42Å; D750-K794 IonicContact OD2-NZ 3.65Å; D750-K794 PolarHBondContact OD2-NZ 3.35Å
751	F	80.6	Confident	75.4	Confident	47 Å²	47	75.8 Å²	75.8	21%	0.206	40%	0.399	C	S	.	.			trans	-93.7	124.2	174.6	-64.5	-75	0	0	0	109.8	K748 S749 L790 L791	K748-F751 PolarHBondContact O-N 2.85Å; S749-F751 VanDerWaalsContact C-N 3.31Å; F751-L790 HydrophobicContact CB-CB 3.95Å; F751-L790 HydrophobicContact CD1-CB 3.56Å; F751-L790 HydrophobicContact CD2-CB 4.5Å; F751-L790 HydrophobicContact CD2-CD1 4.39Å; F751-L790 HydrophobicContact CE1-CB 4.21Å; F751-L790 HydrophobicContact CG-CB 3.74Å; F751-L790 HydrophobicContact CG-CD1 4.34Å; F751-L791 CarbonylContact C-O 3.58Å; F751-L791 WeakPolarHBondContact CA-O 3.31Å
752	V	78.9	Confident	75.7	Confident	51 Å²	51	77.9 Å²	77.9	31%	0.309	41%	0.406	S	S	.	.			trans	-120.5	-13.5	-160.2	-104.7	0	0	0	0	112.7	L791 F793 G950	V752-L791 WeakPolarHBondContact CG2-O 3.42Å; V752-L791 PolarHBondContact N-O 3.35Å; V752-F793 HydrophobicContact CG2-CD2 3.71Å; V752-F793 HydrophobicContact CG2-CE2 4.38Å; V752-G950 WeakPolarHBondContact CB-O 3.33Å; V752-G950 WeakPolarHBondContact CG1-O 3.48Å; V752-G950 CarbonylContact O-C 3.54Å; V752-G950 WeakPolarHBondContact O-CA 3.4Å
753	S	84.2	Confident	76.6	Confident	43 Å²	43	69.8 Å²	69.8	30%	0.301	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	165	168.7	-175.8	0	0	0	0	110.2	L791	S753-L791 PolarHBondContact N-O 2.91Å; S753-L791 PolarHBondContact O-N 3.06Å
754	H	86.2	Confident	77.9	Confident	111 Å²	111	66.5 Å²	66.5	51%	0.514	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	146.3	173.2	68.3	-81.3	0	0	0	111.4	C789 L790	H754-C789 CarbonylContact C-O 3.57Å; H754-C789 VanDerWaalsContact CA-O 3.31Å; H754-C789 WeakPolarHBondContact CA-O 3.45Å; H754-L790 HydrophobicContact CB-CD2 3.94Å
755	R	90.1	Very high	79.8	Confident	132 Å²	132	66.5 Å²	66.5	50%	0.498	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	161.1	172.4	-62.3	-66.2	-166.9	-176.1	3.2	108.8	L766 C789 L791	R755-L766 HydrophobicContact CB-CD1 4.05Å; R755-C789 HydrophobicContact CB-CB 4.46Å; R755-C789 PolarHBondContact N-O 3.16Å; R755-C789 PolarHBondContact O-N 2.82Å; R755-L791 HydrophobicContact CG-CD1 3.93Å
756	F	91.1	Very high	82	Confident	118 Å²	118	59 Å²	59	52%	0.518	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	142.3	164.1	-61.3	-62.5	0	0	0	109.7	L766 P786 S787 F788	F756-L766 VanDerWaalsContact O-CD1 3.31Å; F756-L766 WeakPolarHBondContact O-CD1 3.34Å; F756-P786 HydrophobicContact CB-CB 4.12Å; F756-P786 HydrophobicContact CD1-CB 3.6Å; F756-P786 HydrophobicContact CD1-CG 3.58Å; F756-P786 HydrophobicContact CE1-CB 4.24Å; F756-P786 HydrophobicContact CE1-CG 3.68Å; F756-P786 HydrophobicContact CG-CB 3.97Å; F756-P786 HydrophobicContact CG-CG 4.2Å; F756-P786 HydrophobicContact CZ-CG 4.4Å; F756-S787 WeakPolarHBondContact CA-O 3.02Å; F756-F788 HydrophobicContact CD1-CD1 4.42Å; F756-F788 HydrophobicContact CD1-CE1 4.37Å; F756-F788 HydrophobicContact CE1-CD1 4.12Å; F756-F788 AromaticContact CE1-CE1 3.67Å; F756-F788 HydrophobicContact CE1-CE1 3.67Å; F756-F788 HydrophobicContact CE1-CZ 4.19Å
757	A	91.7	Very high	84.3	Confident	4 Å²	4	55.5 Å²	55.5	3%	0.033	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	143	173.6	0	0	0	0	0	109.4	E762 C763 L766 F777 S787 C789	A757-E762 HydrophobicContact CB-CB 4.33Å; A757-E762 HydrophobicContact CB-CG 4.24Å; A757-C763 HydrophobicContact CB-CB 3.95Å; A757-L766 HydrophobicContact CB-CD1 3.99Å; A757-F777 HydrophobicContact CB-CD2 4.43Å; A757-F777 HydrophobicContact CB-CE2 4.19Å; A757-S787 PolarHBondContact N-O 3.22Å; A757-S787 CarbonylContact O-C 3.56Å; A757-S787 VanDerWaalsContact O-CB 3.29Å; A757-S787 WeakPolarHBondContact O-CB 3.26Å; A757-S787 VanDerWaalsContact O-O 3.12Å; A757-C789 HydrophobicContact CB-CB 3.92Å
758	T	89.5	Confident	86.3	Confident	115 Å²	115	54.3 Å²	54.3	71%	0.706	28%	0.276	S	S	*	.	S	Bend	trans	-83.6	-21.9	174.3	68.1	0	0	0	0	112.4	E762	T758-E762 WeakPolarHBondContact CA-OE2 3.19Å; T758-E762 VanDerWaalsContact CB-OE2 3.3Å; T758-E762 WeakPolarHBondContact CB-OE2 3.22Å; T758-E762 PolarHBondContact N-OE2 2.84Å; T758-E762 PolarHBondContact OG1-OE2 3.16Å
759	S	92.5	Very high	88.3	Confident	30 Å²	30	50.8 Å²	50.8	21%	0.21	26%	0.261	C	S	.	.	S	Bend	trans	-147	164.9	-175	68	0	0	0	0	113.5	A761 E762 C763	S759-A761 VanDerWaalsContact C-N 3.33Å; S759-A761 PolarHBondContact O-N 3.45Å; S759-E762 PolarHBondContact O-N 2.95Å; S759-E762 VanDerWaalsContact OG-CB 3.32Å; S759-E762 WeakPolarHBondContact OG-CB 3.22Å; S759-E762 PolarHBondContact OG-N 3.31Å; S759-E762 VanDerWaalsContact OG-N 3.12Å; S759-C763 PolarHBondContact O-N 3.05Å
760	V	94.5	Very high	90.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-60.2	-43.2	174.8	-168.9	0	0	0	0	111.2	F738 C763 A764 F777 A807 P809 I814 I816	F738-V760 HydrophobicContact CE2-CG1 3.74Å; F738-V760 HydrophobicContact CZ-CG1 4.01Å; V760-C763 WeakPolarHBondContact O-CB 3.09Å; V760-C763 PolarHBondContact O-N 3.4Å; V760-A764 PolarHBondContact O-N 2.6Å; V760-F777 HydrophobicContact CG2-CD1 4.04Å; V760-F777 HydrophobicContact CG2-CE1 4.27Å; V760-F777 HydrophobicContact CG2-CG 4.45Å; V760-A807 HydrophobicContact CB-CB 4.22Å; V760-A807 HydrophobicContact CG1-CB 4.19Å; V760-A807 HydrophobicContact CG2-CB 4.3Å; V760-A807 WeakPolarHBondContact CG2-O 3.44Å; V760-P809 HydrophobicContact CG2-CB 4.41Å; V760-I814 HydrophobicContact CB-CD1 4.34Å; V760-I814 HydrophobicContact CG1-CD1 3.64Å; V760-I814 HydrophobicContact CG2-CD1 3.71Å; V760-I816 HydrophobicContact CG1-CD1 3.64Å; V760-I816 HydrophobicContact CG1-CG1 4.12Å
761	A	94	Very high	91.5	Very high	21 Å²	21	50.2 Å²	50.2	17%	0.174	27%	0.266	C	S	.	.	H	α-helix	trans	-68.3	-36.1	179.6	0	0	0	0	0	112.6	F738 S759 A764 K765	F738-A761 HydrophobicContact CE1-CB 4.16Å; F738-A761 HydrophobicContact CZ-CB 4.43Å; S759-A761 VanDerWaalsContact C-N 3.33Å; S759-A761 PolarHBondContact O-N 3.45Å; A761-A764 PolarHBondContact O-N 3.44Å; A761-K765 WeakPolarHBondContact O-CB 3.04Å; A761-K765 PolarHBondContact O-N 2.93Å
762	E	94	Very high	92.1	Very high	75 Å²	75	48.4 Å²	48.4	35%	0.35	26%	0.259	S	S	.	.	H	α-helix	trans	-66.6	-38.7	172	-175.1	176	-162.6	0	0	111.5	A757 T758 S759 K765 L766	A757-E762 HydrophobicContact CB-CB 4.33Å; A757-E762 HydrophobicContact CB-CG 4.24Å; T758-E762 WeakPolarHBondContact CA-OE2 3.19Å; T758-E762 VanDerWaalsContact CB-OE2 3.3Å; T758-E762 WeakPolarHBondContact CB-OE2 3.22Å; T758-E762 PolarHBondContact N-OE2 2.84Å; T758-E762 PolarHBondContact OG1-OE2 3.16Å; S759-E762 PolarHBondContact O-N 2.95Å; S759-E762 VanDerWaalsContact OG-CB 3.32Å; S759-E762 WeakPolarHBondContact OG-CB 3.22Å; S759-E762 PolarHBondContact OG-N 3.31Å; S759-E762 VanDerWaalsContact OG-N 3.12Å; E762-K765 PolarHBondContact O-N 3.06Å; E762-L766 HydrophobicContact CG-CD1 4.07Å; E762-L766 HydrophobicContact CG-CG 4.46Å; E762-L766 WeakPolarHBondContact O-CB 3.47Å; E762-L766 VanDerWaalsContact O-CG 3.29Å; E762-L766 WeakPolarHBondContact O-CG 3.31Å; E762-L766 PolarHBondContact O-N 2.75Å
763	C	95.9	Very high	92.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63.9	-43.1	173.5	-178.5	0	0	0	0	112.4	A757 S759 V760 K765 L766 C767 F777 C789 I816	A757-C763 HydrophobicContact CB-CB 3.95Å; S759-C763 PolarHBondContact O-N 3.05Å; V760-C763 WeakPolarHBondContact O-CB 3.09Å; V760-C763 PolarHBondContact O-N 3.4Å; C763-K765 VanDerWaalsContact C-N 3.34Å; C763-K765 PolarHBondContact O-N 3.47Å; C763-L766 PolarHBondContact O-N 2.75Å; C763-C767 WeakPolarHBondContact O-CB 3.39Å; C763-C767 PolarHBondContact O-N 2.86Å; C763-F777 HydrophobicContact CB-CB 4.34Å; C763-F777 HydrophobicContact CB-CD2 3.82Å; C763-C789 WeakPolarHBondContact CA-SG 3.18Å; C763-C789 HydrophobicContact CB-CB 3.68Å; C763-C789 WeakPolarHBondContact CB-SG 3.39Å; C763-C789 PolarHBondContact O-SG 3.3Å; C763-C789 VanDerWaalsContact SG-CA 3.54Å; C763-C789 WeakPolarHBondContact SG-CB 3.38Å; C763-C789 CovalentContact SG-SG 2.03Å; C763-C789 PolarHBondContact SG-SG 2.93Å; C763-I816 HydrophobicContact CB-CD1 4.08Å
764	A	95.8	Very high	93.1	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.6	-44.2	172.7	0	0	0	0	0	111.6	V736 F738 V760 A761 C767 Y768 I816 I819	V736-A764 HydrophobicContact CG1-CB 3.94Å; F738-A764 HydrophobicContact CB-CB 4.26Å; F738-A764 HydrophobicContact CD1-CB 3.43Å; F738-A764 VanDerWaalsContact CD1-CB 3.43Å; F738-A764 HydrophobicContact CE1-CB 3.87Å; F738-A764 HydrophobicContact CG-CB 3.88Å; V760-A764 PolarHBondContact O-N 2.6Å; A761-A764 PolarHBondContact O-N 3.44Å; A764-C767 PolarHBondContact O-N 2.76Å; A764-Y768 PolarHBondContact O-N 2.81Å; A764-I816 HydrophobicContact CB-CG2 4.01Å; A764-I819 HydrophobicContact CB-CG2 4.34Å; A764-I819 WeakPolarHBondContact O-CG2 3.36Å
765	K	95.6	Very high	93.5	Very high	75 Å²	75	40.7 Å²	40.7	33%	0.326	22%	0.218	S	C	.	.	H	α-helix	trans	-63.2	-49.6	176.5	177.4	169.1	173.1	157.2	0	112.7	C732 V736 A761 E762 C763 C767 Y768 E769	C732-K765 PolarHBondContact O-NZ 3.32Å; V736-K765 HydrophobicContact CG2-CB 3.96Å; V736-K765 HydrophobicContact CG2-CG 4.27Å; A761-K765 WeakPolarHBondContact O-CB 3.04Å; A761-K765 PolarHBondContact O-N 2.93Å; E762-K765 PolarHBondContact O-N 3.06Å; C763-K765 VanDerWaalsContact C-N 3.34Å; C763-K765 PolarHBondContact O-N 3.47Å; K765-C767 PolarHBondContact O-N 2.93Å; K765-Y768 PolarHBondContact O-N 2.86Å; K765-Y768 VanDerWaalsContact O-N 3.15Å; K765-E769 WeakPolarHBondContact CE-OE1 3.27Å; K765-E769 WeakPolarHBondContact CE-OE2 3.5Å; K765-E769 HydrophobicContact CG-CG 4.24Å; K765-E769 IonicContact NZ-OE1 3.31Å; K765-E769 PolarHBondContact NZ-OE1 3.4Å; K765-E769 WeakPolarHBondContact O-CG 3.03Å; K765-E769 PolarHBondContact O-N 2.97Å
766	L	95	Very high	93.6	Very high	41 Å²	41	34.7 Å²	34.7	22%	0.215	20%	0.198	C	C	.	.	H	α-helix	trans	-55.1	-35.8	174.9	-76.6	164.5	0	0	0	111.5	R755 F756 A757 E762 C763 S770	R755-L766 HydrophobicContact CB-CD1 4.05Å; F756-L766 VanDerWaalsContact O-CD1 3.31Å; F756-L766 WeakPolarHBondContact O-CD1 3.34Å; A757-L766 HydrophobicContact CB-CD1 3.99Å; E762-L766 HydrophobicContact CG-CD1 4.07Å; E762-L766 HydrophobicContact CG-CG 4.46Å; E762-L766 WeakPolarHBondContact O-CB 3.47Å; E762-L766 VanDerWaalsContact O-CG 3.29Å; E762-L766 WeakPolarHBondContact O-CG 3.31Å; E762-L766 PolarHBondContact O-N 2.75Å; C763-L766 PolarHBondContact O-N 2.75Å; L766-S770 WeakPolarHBondContact O-CB 3.44Å; L766-S770 PolarHBondContact O-N 3.11Å; L766-S770 PolarHBondContact O-OG 3.44Å
767	C	95.8	Very high	93.8	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-71.2	-47.5	176.4	-169.3	0	0	0	0	112.7	C763 A764 K765 E769 S770 G771 C772 A775 L791 I819	C763-C767 WeakPolarHBondContact O-CB 3.39Å; C763-C767 PolarHBondContact O-N 2.86Å; A764-C767 PolarHBondContact O-N 2.76Å; K765-C767 PolarHBondContact O-N 2.93Å; C767-E769 VanDerWaalsContact C-N 3.33Å; C767-E769 PolarHBondContact O-N 3.32Å; C767-S770 CarbonylContact O-C 3.43Å; C767-S770 PolarHBondContact O-N 3.15Å; C767-G771 PolarHBondContact O-N 3.23Å; C767-C772 WeakPolarHBondContact CA-SG 3.06Å; C767-C772 WeakPolarHBondContact CB-SG 3.31Å; C767-C772 PolarHBondContact O-N 3.28Å; C767-C772 PolarHBondContact O-SG 2.7Å; C767-C772 VanDerWaalsContact O-SG 3.4Å; C767-C772 WeakPolarHBondContact SG-CB 3.13Å; C767-C772 PolarHBondContact SG-O 3.11Å; C767-C772 CovalentContact SG-SG 2.04Å; C767-C772 PolarHBondContact SG-SG 2.85Å; C767-A775 HydrophobicContact CB-CB 3.94Å; C767-L791 HydrophobicContact CB-CD2 3.96Å; C767-I819 HydrophobicContact CB-CD1 3.75Å
768	Y	95.1	Very high	93.7	Very high	44 Å²	44	31.3 Å²	31.3	17%	0.173	19%	0.186	C	C	.	.	H	α-helix	trans	-56.6	-46	175.6	-176.5	-91.4	0	0	0	112.1	R730 C732 A764 K765 G771 I819 C821	R730-Y768 HydrophobicContact CB-CD1 4.3Å; R730-Y768 HydrophobicContact CB-CE1 3.72Å; R730-Y768 VanDerWaalsContact O-CD1 3.31Å; R730-Y768 WeakPolarHBondContact O-CD1 3.28Å; R730-Y768 VanDerWaalsContact O-CE1 3.24Å; R730-Y768 WeakPolarHBondContact O-CE1 3.48Å; C732-Y768 HydrophobicContact CB-CD1 3.73Å; C732-Y768 HydrophobicContact CB-CE1 3.85Å; A764-Y768 PolarHBondContact O-N 2.81Å; K765-Y768 PolarHBondContact O-N 2.86Å; K765-Y768 VanDerWaalsContact O-N 3.15Å; Y768-G771 PolarHBondContact O-N 2.88Å; Y768-G771 VanDerWaalsContact O-N 3.09Å; Y768-I819 HydrophobicContact CD2-CG2 4.42Å; Y768-C821 HydrophobicContact CD1-CB 4.38Å; Y768-C821 HydrophobicContact CE1-CB 3.7Å; Y768-C821 HydrophobicContact CE2-CB 3.91Å; Y768-C821 VanDerWaalsContact CZ-CB 3.45Å
769	E	94.6	Very high	93.6	Very high	57 Å²	57	30.7 Å²	30.7	27%	0.266	17%	0.171	S	C	.	.	H	α-helix	trans	-73.3	-27.7	-178.6	-64.5	-173.5	143.5	0	0	112.7	C732 K765 C767 G771	C732-E769 PolarHBondContact N-OE1 2.85Å; K765-E769 WeakPolarHBondContact CE-OE1 3.27Å; K765-E769 WeakPolarHBondContact CE-OE2 3.5Å; K765-E769 HydrophobicContact CG-CG 4.24Å; K765-E769 IonicContact NZ-OE1 3.31Å; K765-E769 PolarHBondContact NZ-OE1 3.4Å; K765-E769 WeakPolarHBondContact O-CG 3.03Å; K765-E769 PolarHBondContact O-N 2.97Å; C767-E769 VanDerWaalsContact C-N 3.33Å; C767-E769 PolarHBondContact O-N 3.32Å; E769-G771 VanDerWaalsContact C-N 3.29Å
770	S	93.3	Very high	93.1	Very high	45 Å²	45	29.9 Å²	29.9	32%	0.315	17%	0.166	S	C	.	.	H	α-helix	trans	-78	-11.5	168.9	-57.3	0	0	0	0	113.2	L766 C767 F793	L766-S770 WeakPolarHBondContact O-CB 3.44Å; L766-S770 PolarHBondContact O-N 3.11Å; L766-S770 PolarHBondContact O-OG 3.44Å; C767-S770 CarbonylContact O-C 3.43Å; C767-S770 PolarHBondContact O-N 3.15Å; S770-F793 WeakPolarHBondContact O-CE1 3.18Å
771	G	93.1	Very high	92.2	Very high	46 Å²	46	37.6 Å²	37.6	47%	0.474	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.4	19.7	-176.1	0	0	0	0	0	115.2	C767 Y768 E769	C767-G771 PolarHBondContact O-N 3.23Å; Y768-G771 PolarHBondContact O-N 2.88Å; Y768-G771 VanDerWaalsContact O-N 3.09Å; E769-G771 VanDerWaalsContact C-N 3.29Å
772	C	93.5	Very high	91.3	Very high	8 Å²	8	40.7 Å²	40.7	5%	0.054	22%	0.224	C	C	.	.			trans	-87	167.5	171.8	60.4	0	0	0	0	112.8	C767 S792 F793	C767-C772 WeakPolarHBondContact CA-SG 3.06Å; C767-C772 WeakPolarHBondContact CB-SG 3.31Å; C767-C772 PolarHBondContact O-N 3.28Å; C767-C772 PolarHBondContact O-SG 2.7Å; C767-C772 VanDerWaalsContact O-SG 3.4Å; C767-C772 WeakPolarHBondContact SG-CB 3.13Å; C767-C772 PolarHBondContact SG-O 3.11Å; C767-C772 CovalentContact SG-SG 2.04Å; C767-C772 PolarHBondContact SG-SG 2.85Å; C772-S792 WeakPolarHBondContact CB-O 3.36Å; C772-F793 HydrophobicContact CB-CD1 3.6Å; C772-F793 HydrophobicContact CB-CD2 4.42Å; C772-F793 HydrophobicContact CB-CE1 3.56Å; C772-F793 HydrophobicContact CB-CE2 4.38Å; C772-F793 HydrophobicContact CB-CG 4.04Å; C772-F793 HydrophobicContact CB-CZ 3.96Å
773	T	91.8	Very high	90.1	Very high	35 Å²	35	44.2 Å²	44.2	22%	0.215	25%	0.245	C	C	.	.	S	Bend	trans	-112.1	-37.2	-170.3	45.6	0	0	0	0	112.3	S792 K794 D796	T773-S792 PolarHBondContact N-O 2.93Å; T773-S792 VanDerWaalsContact N-O 3.15Å; T773-S792 PolarHBondContact OG1-O 3.43Å; T773-S792 VanDerWaalsContact OG1-O 3.07Å; T773-K794 WeakPolarHBondContact CB-O 3.45Å; T773-K794 WeakPolarHBondContact CG2-O 3.31Å; T773-K794 PolarHBondContact OG1-O 3.17Å; T773-D796 HydrophobicContact CG2-CB 4.01Å
774	V	92.3	Very high	88.9	Confident	8 Å²	8	48.2 Å²	48.2	5%	0.048	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	138.1	179.9	-180	0	0	0	0	108.8	S792 Q815 I816 Q817	V774-S792 PolarHBondContact N-O 3.18Å; V774-S792 WeakPolarHBondContact O-CA 3.37Å; V774-S792 WeakPolarHBondContact O-CB 3.44Å; V774-S792 PolarHBondContact O-N 2.88Å; V774-Q815 HydrophobicContact CG1-CG 3.77Å; V774-I816 CarbonylContact C-O 3.33Å; V774-I816 VanDerWaalsContact CA-O 3.29Å; V774-I816 WeakPolarHBondContact CA-O 2.97Å; V774-I816 WeakPolarHBondContact CG1-O 3.2Å; V774-Q817 HydrophobicContact CG2-CB 4.06Å
775	A	93.7	Very high	87.8	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	150.2	174.5	0	0	0	0	0	111.8	C767 L790 L791 I816 I819	C767-A775 HydrophobicContact CB-CB 3.94Å; A775-L790 CarbonylContact C-O 3.48Å; A775-L790 WeakPolarHBondContact CA-O 3.4Å; A775-L790 WeakPolarHBondContact CB-O 3.21Å; A775-L791 HydrophobicContact CB-CD2 4.3Å; A775-I816 HydrophobicContact CB-CB 4.32Å; A775-I816 PolarHBondContact N-O 3.5Å; A775-I816 WeakPolarHBondContact O-CB 3.44Å; A775-I816 PolarHBondContact O-N 2.92Å; A775-I819 HydrophobicContact CB-CD1 4.47Å
776	G	93.5	Very high	87	Confident	7 Å²	7	52.9 Å²	52.9	7%	0.072	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	113	175.1	0	0	0	0	0	110.3	L790 I814	G776-L790 PolarHBondContact N-O 3.48Å; G776-L790 PolarHBondContact O-N 2.89Å; G776-I814 WeakPolarHBondContact CA-O 3.49Å
777	F	93.8	Very high	86.7	Confident	1 Å²	1	51.6 Å²	51.6	0%	0.004	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	127	175.7	-180	-93.8	0	0	0	110.5	A757 V760 C763 R779 F788 P809 P813 I814 I816	A757-F777 HydrophobicContact CB-CD2 4.43Å; A757-F777 HydrophobicContact CB-CE2 4.19Å; V760-F777 HydrophobicContact CG2-CD1 4.04Å; V760-F777 HydrophobicContact CG2-CE1 4.27Å; V760-F777 HydrophobicContact CG2-CG 4.45Å; C763-F777 HydrophobicContact CB-CB 4.34Å; C763-F777 HydrophobicContact CB-CD2 3.82Å; F777-R779 HydrophobicContact CE1-CB 4.21Å; F777-F788 WeakPolarHBondContact CA-O 3.46Å; F777-P809 HydrophobicContact CE1-CB 3.64Å; F777-P809 HydrophobicContact CZ-CB 4.16Å; F777-P813 WeakPolarHBondContact O-CA 3.41Å; F777-I814 HydrophobicContact CB-CD1 4.49Å; F777-I814 HydrophobicContact CB-CG1 4.02Å; F777-I814 HydrophobicContact CD1-CD1 4.44Å; F777-I814 HydrophobicContact CD1-CG1 4.38Å; F777-I814 PolarHBondContact N-O 2.77Å; F777-I814 PolarHBondContact O-N 3.45Å; F777-I816 HydrophobicContact CB-CD1 4.05Å
778	T	90.5	Very high	86.4	Confident	49 Å²	49	55.7 Å²	55.7	30%	0.301	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	114.4	175.8	-55.4	0	0	0	0	109.6	S787 F788 P813	T778-S787 WeakPolarHBondContact O-CB 3.27Å; T778-F788 PolarHBondContact N-O 3.34Å; T778-F788 PolarHBondContact O-N 3.12Å; T778-P813 HydrophobicContact CG2-CB 4.43Å
779	R	87.4	Confident	86.4	Confident	102 Å²	102	53.6 Å²	53.6	39%	0.385	32%	0.319	S	S	.	.			trans	-63.7	139.9	175.8	-166.8	-179.5	175.4	146.5	0	110.6	F777 S787 P809	F777-R779 HydrophobicContact CE1-CB 4.21Å; R779-S787 WeakPolarHBondContact CA-OG 3Å; R779-P809 PolarHBondContact NH1-O 2.65Å
780	A	83	Confident	86.3	Confident	14 Å²	14	53.6 Å²	53.6	12%	0.116	32%	0.321	C	S	.	.			trans	-64.7	145.2	170.6	0	0	0	0	0	111.3	V782 E785 S787	A780-V782 VanDerWaalsContact C-N 3.28Å; A780-V782 PolarHBondContact O-N 2.89Å; A780-E785 HydrophobicContact CB-CB 3.76Å; A780-E785 VanDerWaalsContact CB-O 3.28Å; A780-E785 WeakPolarHBondContact CB-O 3.43Å; A780-S787 PolarHBondContact N-OG 2.72Å
781	N	74.4	Confident	86.4	Confident	161 Å²	161	51.5 Å²	51.5	86%	0.861	31%	0.306	S	S	*	.	S	Bend	trans	-81.2	-6.9	-178.7	-72	-66.5	0	0	0	113.7
782	V	76.1	Confident	86.3	Confident	87 Å²	87	49.5 Å²	49.5	53%	0.527	28%	0.284	S	S	.	.	S	Bend	trans	-127.5	127.4	-177.4	-175.5	0	0	0	0	108.3	A780 G784 E785	A780-V782 VanDerWaalsContact C-N 3.28Å; A780-V782 PolarHBondContact O-N 2.89Å; V782-G784 PolarHBondContact O-N 2.91Å; V782-G784 VanDerWaalsContact O-N 3.15Å; V782-E785 HydrophobicContact CB-CG 4.28Å; V782-E785 PolarHBondContact O-N 3.01Å; V782-E785 VanDerWaalsContact O-N 3.1Å
783	D	68.4	Low	86.1	Confident	149 Å²	149	53.5 Å²	53.5	80%	0.797	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	116.3	176	-68.4	-55	0	0	0	110
784	G	69.8	Low	85.6	Confident	83 Å²	83	56.7 Å²	56.7	86%	0.856	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	111.3	-15	-175.5	0	0	0	0	0	114.9	V782	V782-G784 PolarHBondContact O-N 2.91Å; V782-G784 VanDerWaalsContact O-N 3.15Å
785	E	74.1	Confident	85	Confident	107 Å²	107	65.5 Å²	65.5	50%	0.5	35%	0.35	S	S	.	.	S	Bend	trans	-80.8	143.6	165.9	-76.4	-164	139.1	0	0	111	A780 V782	A780-E785 HydrophobicContact CB-CB 3.76Å; A780-E785 VanDerWaalsContact CB-O 3.28Å; A780-E785 WeakPolarHBondContact CB-O 3.43Å; V782-E785 HydrophobicContact CB-CG 4.28Å; V782-E785 PolarHBondContact O-N 3.01Å; V782-E785 VanDerWaalsContact O-N 3.1Å
786	P	77.3	Confident	83.9	Confident	66 Å²	66	68.2 Å²	68.2	43%	0.429	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-71.1	138.7	179.6	30.5	-35.4	0	0	0	111	F756	F756-P786 HydrophobicContact CB-CB 4.12Å; F756-P786 HydrophobicContact CD1-CB 3.6Å; F756-P786 HydrophobicContact CD1-CG 3.58Å; F756-P786 HydrophobicContact CE1-CB 4.24Å; F756-P786 HydrophobicContact CE1-CG 3.68Å; F756-P786 HydrophobicContact CG-CB 3.97Å; F756-P786 HydrophobicContact CG-CG 4.2Å; F756-P786 HydrophobicContact CZ-CG 4.4Å
787	S	88.5	Confident	83	Confident	14 Å²	14	72.8 Å²	72.8	10%	0.098	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	151.6	176.5	-60.4	0	0	0	0	111	F756 A757 T778 R779 A780	F756-S787 WeakPolarHBondContact CA-O 3.02Å; A757-S787 PolarHBondContact N-O 3.22Å; A757-S787 CarbonylContact O-C 3.56Å; A757-S787 VanDerWaalsContact O-CB 3.29Å; A757-S787 WeakPolarHBondContact O-CB 3.26Å; A757-S787 VanDerWaalsContact O-O 3.12Å; T778-S787 WeakPolarHBondContact O-CB 3.27Å; R779-S787 WeakPolarHBondContact CA-OG 3Å; A780-S787 PolarHBondContact N-OG 2.72Å
788	F	90	Very high	82.7	Confident	87 Å²	87	75.7 Å²	75.7	38%	0.382	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	133.3	-170.5	-65	-92.3	0	0	0	111.2	F756 F777 T778	F756-F788 HydrophobicContact CD1-CD1 4.42Å; F756-F788 HydrophobicContact CD1-CE1 4.37Å; F756-F788 HydrophobicContact CE1-CD1 4.12Å; F756-F788 AromaticContact CE1-CE1 3.67Å; F756-F788 HydrophobicContact CE1-CE1 3.67Å; F756-F788 HydrophobicContact CE1-CZ 4.19Å; F777-F788 WeakPolarHBondContact CA-O 3.46Å; T778-F788 PolarHBondContact N-O 3.34Å; T778-F788 PolarHBondContact O-N 3.12Å
789	C	95	Very high	82.1	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	108.9	170.6	-175.3	0	0	0	0	109	H754 R755 A757 C763 L791	H754-C789 CarbonylContact C-O 3.57Å; H754-C789 VanDerWaalsContact CA-O 3.31Å; H754-C789 WeakPolarHBondContact CA-O 3.45Å; R755-C789 HydrophobicContact CB-CB 4.46Å; R755-C789 PolarHBondContact N-O 3.16Å; R755-C789 PolarHBondContact O-N 2.82Å; A757-C789 HydrophobicContact CB-CB 3.92Å; C763-C789 WeakPolarHBondContact CA-SG 3.18Å; C763-C789 HydrophobicContact CB-CB 3.68Å; C763-C789 WeakPolarHBondContact CB-SG 3.39Å; C763-C789 PolarHBondContact O-SG 3.3Å; C763-C789 VanDerWaalsContact SG-CA 3.54Å; C763-C789 WeakPolarHBondContact SG-CB 3.38Å; C763-C789 CovalentContact SG-SG 2.03Å; C763-C789 PolarHBondContact SG-SG 2.93Å; C789-L791 VanDerWaalsContact SG-CD2 3.56Å
790	L	93.5	Very high	81.8	Confident	57 Å²	57	75.1 Å²	75.1	30%	0.298	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	135.3	176.6	-56.4	-180	0	0	0	109.1	F751 H754 A775 G776	F751-L790 HydrophobicContact CB-CB 3.95Å; F751-L790 HydrophobicContact CD1-CB 3.56Å; F751-L790 HydrophobicContact CD2-CB 4.5Å; F751-L790 HydrophobicContact CD2-CD1 4.39Å; F751-L790 HydrophobicContact CE1-CB 4.21Å; F751-L790 HydrophobicContact CG-CB 3.74Å; F751-L790 HydrophobicContact CG-CD1 4.34Å; H754-L790 HydrophobicContact CB-CD2 3.94Å; A775-L790 CarbonylContact C-O 3.48Å; A775-L790 WeakPolarHBondContact CA-O 3.4Å; A775-L790 WeakPolarHBondContact CB-O 3.21Å; G776-L790 PolarHBondContact N-O 3.48Å; G776-L790 PolarHBondContact O-N 2.89Å
791	L	93.8	Very high	81.8	Confident	1 Å²	1	77.6 Å²	77.6	1%	0.005	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	136.7	-172	-54.9	-173.2	0	0	0	111.4	F751 V752 S753 R755 C767 A775 C789	F751-L791 CarbonylContact C-O 3.58Å; F751-L791 WeakPolarHBondContact CA-O 3.31Å; V752-L791 WeakPolarHBondContact CG2-O 3.42Å; V752-L791 PolarHBondContact N-O 3.35Å; S753-L791 PolarHBondContact N-O 2.91Å; S753-L791 PolarHBondContact O-N 3.06Å; R755-L791 HydrophobicContact CG-CD1 3.93Å; C767-L791 HydrophobicContact CB-CD2 3.96Å; A775-L791 HydrophobicContact CB-CD2 4.3Å; C789-L791 VanDerWaalsContact SG-CD2 3.56Å
792	S	91.3	Very high	82.5	Confident	3 Å²	3	74.5 Å²	74.5	2%	0.021	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	128.4	-179.8	-174.2	0	0	0	0	112.9	D750 C772 T773 V774	D750-S792 WeakPolarHBondContact O-CB 3.26Å; D750-S792 PolarHBondContact O-OG 2.93Å; C772-S792 WeakPolarHBondContact CB-O 3.36Å; T773-S792 PolarHBondContact N-O 2.93Å; T773-S792 VanDerWaalsContact N-O 3.15Å; T773-S792 PolarHBondContact OG1-O 3.43Å; T773-S792 VanDerWaalsContact OG1-O 3.07Å; V774-S792 PolarHBondContact N-O 3.18Å; V774-S792 WeakPolarHBondContact O-CA 3.37Å; V774-S792 WeakPolarHBondContact O-CB 3.44Å; V774-S792 PolarHBondContact O-N 2.88Å
793	F	89.2	Confident	83.2	Confident	92 Å²	92	75 Å²	75	40%	0.404	43%	0.427	S	S	.	.			trans	-99.1	25.1	-176.8	-59.8	-89	0	0	0	113.4	V752 S770 C772	V752-F793 HydrophobicContact CG2-CD2 3.71Å; V752-F793 HydrophobicContact CG2-CE2 4.38Å; S770-F793 WeakPolarHBondContact O-CE1 3.18Å; C772-F793 HydrophobicContact CB-CD1 3.6Å; C772-F793 HydrophobicContact CB-CD2 4.42Å; C772-F793 HydrophobicContact CB-CE1 3.56Å; C772-F793 HydrophobicContact CB-CE2 4.38Å; C772-F793 HydrophobicContact CB-CG 4.04Å; C772-F793 HydrophobicContact CB-CZ 3.96Å
794	K	81.7	Confident	84.3	Confident	103 Å²	103	72.5 Å²	72.5	45%	0.448	41%	0.408	S	S	.	.	S	Bend	trans	-71.1	176.2	176.4	-73.3	-165.3	174.5	-174.2	0	111.7	D750 T773 D796	D750-K794 HydrophobicContact CB-CD 4.42Å; D750-K794 VanDerWaalsContact CG-CE 3.43Å; D750-K794 IonicContact OD1-NZ 2.7Å; D750-K794 PolarHBondContact OD1-NZ 2.88Å; D750-K794 WeakPolarHBondContact OD2-CE 3.42Å; D750-K794 IonicContact OD2-NZ 3.65Å; D750-K794 PolarHBondContact OD2-NZ 3.35Å; T773-K794 WeakPolarHBondContact CB-O 3.45Å; T773-K794 WeakPolarHBondContact CG2-O 3.31Å; T773-K794 PolarHBondContact OG1-O 3.17Å; K794-D796 PolarHBondContact O-N 3.03Å
795	K	79.2	Confident	85.3	Confident	193 Å²	193	72 Å²	72	84%	0.839	39%	0.388	S	S	*	.			trans	-68.6	124	171.1	-71.7	-177.7	178.5	176.8	0	109.7	T797	K795-T797 PolarHBondContact O-OG1 2.89Å
796	D	70.9	Confident	86	Confident	57 Å²	57	72.8 Å²	72.8	31%	0.305	39%	0.391	S	S	.	.			trans	-61	135.7	175.2	-155.1	-11.8	0	0	0	110.2	T773 K794 C818	T773-D796 HydrophobicContact CG2-CB 4.01Å; K794-D796 PolarHBondContact O-N 3.03Å; D796-C818 PolarHBondContact OD1-N 2.8Å; D796-C818 WeakPolarHBondContact OD2-CA 3.4Å; D796-C818 PolarHBondContact OD2-N 2.88Å; D796-C818 VanDerWaalsContact OD2-N 3.12Å
797	T	75.8	Confident	86.5	Confident	103 Å²	103	70.3 Å²	70.3	63%	0.632	38%	0.376	S	S	*	.			trans	-128.1	78.8	-172.1	-54.9	0	0	0	0	110	K795 S799 Q817	K795-T797 PolarHBondContact O-OG1 2.89Å; T797-S799 PolarHBondContact O-N 2.84Å; T797-Q817 PolarHBondContact O-NE2 3.49Å
798	C	87.7	Confident	86.3	Confident	61 Å²	61	77.5 Å²	77.5	41%	0.412	41%	0.408	S	S	.	.			trans	-70.9	116.5	-170.2	-67	0	0	0	0	114.2	G800 C818	C798-G800 PolarHBondContact O-N 2.66Å; C798-C818 WeakPolarHBondContact CA-SG 3.29Å; C798-C818 HydrophobicContact CB-CB 4.27Å; C798-C818 WeakPolarHBondContact CB-SG 3.39Å; C798-C818 WeakPolarHBondContact SG-CB 3.04Å; C798-C818 CovalentContact SG-SG 2.03Å; C798-C818 PolarHBondContact SG-SG 3.25Å
799	S	77.1	Confident	85.7	Confident	75 Å²	75	75.3 Å²	75.3	52%	0.524	40%	0.403	S	S	.	.			trans	-68.1	-19.5	173.9	-50.9	0	0	0	0	112.6	E739 T797 T801 Q817	E739-S799 PolarHBondContact OE2-N 3.48Å; T797-S799 PolarHBondContact O-N 2.84Å; S799-T801 VanDerWaalsContact C-N 3.3Å; S799-Q817 PolarHBondContact OG-NE2 2.87Å
800	G	80.6	Confident	84.9	Confident	64 Å²	64	78.3 Å²	78.3	66%	0.66	42%	0.421	S	S	*	.			trans	75.1	24.1	-175.7	0	0	0	0	0	112.3	E739 C798	E739-G800 PolarHBondContact OE2-N 2.83Å; C798-G800 PolarHBondContact O-N 2.66Å
801	T	83.4	Confident	84.3	Confident	66 Å²	66	85.4 Å²	85.4	41%	0.405	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-76.4	172.5	179.3	50.9	0	0	0	0	111.2	E739 S799 R803	E739-T801 WeakPolarHBondContact CB-OG1 3.16Å; E739-T801 WeakPolarHBondContact CG-OG1 3.28Å; E739-T801 PolarHBondContact OE2-N 2.04Å; E739-T801 PolarHBondContact OE2-OG1 3.41Å; S799-T801 VanDerWaalsContact C-N 3.3Å; T801-R803 PolarHBondContact O-N 2.67Å
802	T	88.6	Confident	83.8	Confident	97 Å²	97	92.5 Å²	92.5	60%	0.595	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-56	128.6	175.6	-53.7	0	0	0	0	110.5	Y804	T802-Y804 VanDerWaalsContact O-CD2 3.32Å; T802-Y804 WeakPolarHBondContact O-CD2 3.34Å; T802-Y804 WeakPolarHBondContact O-CE2 3.19Å
803	R	90.7	Very high	83.6	Confident	97 Å²	97	95.6 Å²	95.6	37%	0.366	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	136.8	171.4	-78.8	-171	-166.7	123	20.2	111.8	F738 E739 T801	F738-R803 WeakPolarHBondContact O-CA 3.18Å; E739-R803 HydrophobicContact CG-CG 3.71Å; E739-R803 IonicContact OE1-CZ 2.76Å; E739-R803 VanDerWaalsContact OE1-CZ 3.31Å; E739-R803 IonicContact OE1-NE 2.6Å; E739-R803 PolarHBondContact OE1-NE 3.43Å; E739-R803 VanDerWaalsContact OE1-NE 3.07Å; E739-R803 IonicContact OE1-NH2 3.33Å; E739-R803 PolarHBondContact OE1-NH2 2.94Å; T801-R803 PolarHBondContact O-N 2.67Å
804	Y	91.8	Very high	83.6	Confident	97 Å²	97	92.2 Å²	92.2	38%	0.38	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	139.6	175.3	-55.8	-87.1	0	0	0	108.5	S737 F738 I740 T802	S737-Y804 WeakPolarHBondContact CA-O 3.35Å; F738-Y804 WeakPolarHBondContact CD1-O 3.04Å; F738-Y804 WeakPolarHBondContact CE1-O 3.24Å; F738-Y804 PolarHBondContact N-O 2.96Å; F738-Y804 PolarHBondContact O-N 3.23Å; I740-Y804 HydrophobicContact CB-CD2 4.18Å; I740-Y804 HydrophobicContact CB-CE2 4.08Å; I740-Y804 HydrophobicContact CD1-CD2 3.85Å; I740-Y804 HydrophobicContact CD1-CE2 4.21Å; I740-Y804 HydrophobicContact CD1-CG 4.14Å; I740-Y804 HydrophobicContact CG1-CD2 3.78Å; I740-Y804 HydrophobicContact CG1-CE2 4.16Å; I740-Y804 HydrophobicContact CG1-CG 4.47Å; T802-Y804 VanDerWaalsContact O-CD2 3.32Å; T802-Y804 WeakPolarHBondContact O-CD2 3.34Å; T802-Y804 WeakPolarHBondContact O-CE2 3.19Å
805	T	90.4	Very high	84.1	Confident	71 Å²	71	87.6 Å²	87.6	44%	0.436	47%	0.469	S	S	.	.	S	Bend	trans	-100.9	-16.2	165	50.7	0	0	0	0	111.9	N735 V736	N735-T805 HydrophobicContact CB-CG2 4.28Å; V736-T805 WeakPolarHBondContact O-CA 3.45Å
806	H	88.8	Confident	84.8	Confident	125 Å²	125	78.4 Å²	78.4	58%	0.579	43%	0.429	S	S	*	.			trans	-146.6	144.9	172	-175.1	-80.8	0	0	0	108.5
807	A	88.3	Confident	85.8	Confident	13 Å²	13	76.1 Å²	76.1	11%	0.107	42%	0.416	C	S	.	.			trans	-145.4	145	173.7	0	0	0	0	0	109.9	F738 I740 V760	F738-A807 HydrophobicContact CE2-CB 4.26Å; F738-A807 HydrophobicContact CZ-CB 4.4Å; I740-A807 HydrophobicContact CD1-CB 3.48Å; I740-A807 VanDerWaalsContact CD1-CB 3.48Å; V760-A807 HydrophobicContact CB-CB 4.22Å; V760-A807 HydrophobicContact CG1-CB 4.19Å; V760-A807 HydrophobicContact CG2-CB 4.3Å; V760-A807 WeakPolarHBondContact CG2-O 3.44Å
808	E	84.7	Confident	86.7	Confident	165 Å²	165	71.2 Å²	71.2	77%	0.771	39%	0.386	S	S	*	.			trans	-74.9	136.9	178.1	-65.4	-160.6	152.5	0	0	111.2	T810	E808-T810 PolarHBondContact O-N 3.09Å; E808-T810 VanDerWaalsContact O-N 3.09Å
809	P	76.2	Confident	87	Confident	41 Å²	41	69.1 Å²	69.1	27%	0.266	37%	0.371	S	S	.	.			trans	-74.5	103.1	-178.4	28.4	-33.4	0	0	0	111.5	V760 F777 R779	V760-P809 HydrophobicContact CG2-CB 4.41Å; F777-P809 HydrophobicContact CE1-CB 3.64Å; F777-P809 HydrophobicContact CZ-CB 4.16Å; R779-P809 PolarHBondContact NH1-O 2.65Å
810	T	80.1	Confident	87.7	Confident	64 Å²	64	71.6 Å²	71.6	39%	0.393	37%	0.369	S	S	.	.			trans	-58.1	165.3	173.7	46.3	0	0	0	0	113.3	E808 E812 I814	E808-T810 PolarHBondContact O-N 3.09Å; E808-T810 VanDerWaalsContact O-N 3.09Å; T810-E812 VanDerWaalsContact C-N 3.32Å; T810-E812 PolarHBondContact OG1-O 3.15Å; T810-I814 VanDerWaalsContact OG1-CG2 3.3Å; T810-I814 WeakPolarHBondContact OG1-CG2 3.34Å
811	K	80.7	Confident	88.4	Confident	205 Å²	205	69.9 Å²	69.9	89%	0.891	35%	0.346	S	S	*	.	S	Bend	trans	-75.9	-21.3	170.7	-68.5	-174.5	177.6	-178.5	0	113.3
812	E	82.8	Confident	88.6	Confident	151 Å²	151	69.2 Å²	69.2	71%	0.706	34%	0.34	S	S	*	.	S	Bend	trans	-101.6	149.6	-179.5	-63.7	-176.1	172	0	0	110.1	T810	T810-E812 VanDerWaalsContact C-N 3.32Å; T810-E812 PolarHBondContact OG1-O 3.15Å
813	P	86.4	Confident	88	Confident	67 Å²	67	70.1 Å²	70.1	44%	0.435	35%	0.345	S	S	.	.			trans	-67.5	135.9	178.4	29.7	-35.3	0	0	0	110.6	P743 F777 T778	P743-P813 WeakPolarHBondContact CG-O 3.39Å; F777-P813 WeakPolarHBondContact O-CA 3.41Å; T778-P813 HydrophobicContact CG2-CB 4.43Å
814	I	90.5	Very high	86.5	Confident	22 Å²	22	71 Å²	71	11%	0.113	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	145.8	-177.7	54.8	174.7	0	0	0	111.4	I740 V760 G776 F777 T810	I740-I814 HydrophobicContact CG2-CB 4.43Å; V760-I814 HydrophobicContact CB-CD1 4.34Å; V760-I814 HydrophobicContact CG1-CD1 3.64Å; V760-I814 HydrophobicContact CG2-CD1 3.71Å; G776-I814 WeakPolarHBondContact CA-O 3.49Å; F777-I814 HydrophobicContact CB-CD1 4.49Å; F777-I814 HydrophobicContact CB-CG1 4.02Å; F777-I814 HydrophobicContact CD1-CD1 4.44Å; F777-I814 HydrophobicContact CD1-CG1 4.38Å; F777-I814 PolarHBondContact N-O 2.77Å; F777-I814 PolarHBondContact O-N 3.45Å; T810-I814 VanDerWaalsContact OG1-CG2 3.3Å; T810-I814 WeakPolarHBondContact OG1-CG2 3.34Å
815	Q	91.8	Very high	84.6	Confident	6 Å²	6	69.1 Å²	69.1	3%	0.028	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	135.1	173.4	-175.6	164.8	-43.5	0	0	110.1	I740 V741 H746 V774	I740-Q815 WeakPolarHBondContact CA-O 3.35Å; V741-Q815 PolarHBondContact N-O 2.85Å; V741-Q815 PolarHBondContact O-N 3.26Å; H746-Q815 PolarHBondContact CD2-NE2 2.85Å; H746-Q815 VanDerWaalsContact CD2-NE2 3.31Å; H746-Q815 PolarHBondContact CD2-OE1 3.39Å; H746-Q815 VanDerWaalsContact CD2-OE1 3.22Å; H746-Q815 PolarHBondContact NE2-NE2 3.04Å; V774-Q815 HydrophobicContact CG1-CG 3.77Å
816	I	93.1	Very high	82.6	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	130.6	-178.8	-51	175.3	0	0	0	106.7	F738 V760 C763 A764 V774 A775 F777 I819	F738-I816 HydrophobicContact CB-CG2 3.57Å; F738-I816 HydrophobicContact CD2-CG2 3.74Å; F738-I816 HydrophobicContact CG-CG2 3.78Å; V760-I816 HydrophobicContact CG1-CD1 3.64Å; V760-I816 HydrophobicContact CG1-CG1 4.12Å; C763-I816 HydrophobicContact CB-CD1 4.08Å; A764-I816 HydrophobicContact CB-CG2 4.01Å; V774-I816 CarbonylContact C-O 3.33Å; V774-I816 VanDerWaalsContact CA-O 3.29Å; V774-I816 WeakPolarHBondContact CA-O 2.97Å; V774-I816 WeakPolarHBondContact CG1-O 3.2Å; A775-I816 HydrophobicContact CB-CB 4.32Å; A775-I816 PolarHBondContact N-O 3.5Å; A775-I816 WeakPolarHBondContact O-CB 3.44Å; A775-I816 PolarHBondContact O-N 2.92Å; F777-I816 HydrophobicContact CB-CD1 4.05Å; I816-I819 HydrophobicContact CG2-CD1 3.91Å; I816-I819 HydrophobicContact CG2-CG1 4.06Å
817	Q	93.3	Very high	80.4	Confident	9 Å²	9	77.2 Å²	77.2	4%	0.042	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	-178.1	178.8	62.9	174.9	40.5	0	0	111.3	E739 V741 V774 T797 S799 I819	E739-Q817 HydrophobicContact CB-CG 4.05Å; E739-Q817 PolarHBondContact N-O 3.14Å; E739-Q817 PolarHBondContact O-N 3.03Å; V741-Q817 VanDerWaalsContact CG2-CD 3.47Å; V741-Q817 HydrophobicContact CG2-CG 3.87Å; V774-Q817 HydrophobicContact CG2-CB 4.06Å; T797-Q817 PolarHBondContact O-NE2 3.49Å; S799-Q817 PolarHBondContact OG-NE2 2.87Å; Q817-I819 PolarHBondContact O-N 3.21Å
818	C	92.8	Very high	77.9	Confident	0 Å²	0	86.2 Å²	86.2	0%	0	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	57.4	35.3	177.1	-56	0	0	0	0	114.1	E739 D796 C798 R820	E739-C818 HydrophobicContact CB-CB 3.97Å; E739-C818 VanDerWaalsContact CD-CB 3.48Å; E739-C818 HydrophobicContact CG-CB 3.86Å; E739-C818 WeakPolarHBondContact OE1-CB 3.35Å; E739-C818 PolarHBondContact OE1-SG 2.88Å; E739-C818 VanDerWaalsContact OE1-SG 3.39Å; E739-C818 PolarHBondContact OE2-SG 3.35Å; D796-C818 PolarHBondContact OD1-N 2.8Å; D796-C818 WeakPolarHBondContact OD2-CA 3.4Å; D796-C818 PolarHBondContact OD2-N 2.88Å; D796-C818 VanDerWaalsContact OD2-N 3.12Å; C798-C818 WeakPolarHBondContact CA-SG 3.29Å; C798-C818 HydrophobicContact CB-CB 4.27Å; C798-C818 WeakPolarHBondContact CB-SG 3.39Å; C798-C818 WeakPolarHBondContact SG-CB 3.04Å; C798-C818 CovalentContact SG-SG 2.03Å; C798-C818 PolarHBondContact SG-SG 3.25Å; C818-R820 PolarHBondContact O-N 3.36Å
819	I	94.3	Very high	75.7	Confident	17 Å²	17	86.4 Å²	86.4	9%	0.087	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	120.3	-165.4	-52.2	179.7	0	0	0	109.9	V736 S737 F738 A764 C767 Y768 A775 I816 Q817	V736-I819 HydrophobicContact CG1-CG2 3.47Å; V736-I819 VanDerWaalsContact CG1-CG2 3.47Å; S737-I819 WeakPolarHBondContact O-CA 3.35Å; F738-I819 HydrophobicContact CB-CG1 4.28Å; A764-I819 HydrophobicContact CB-CG2 4.34Å; A764-I819 WeakPolarHBondContact O-CG2 3.36Å; C767-I819 HydrophobicContact CB-CD1 3.75Å; Y768-I819 HydrophobicContact CD2-CG2 4.42Å; A775-I819 HydrophobicContact CB-CD1 4.47Å; I816-I819 HydrophobicContact CG2-CD1 3.91Å; I816-I819 HydrophobicContact CG2-CG1 4.06Å; Q817-I819 PolarHBondContact O-N 3.21Å
820	R	93.2	Very high	73.8	Confident	127 Å²	127	93.4 Å²	93.4	48%	0.479	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	148.1	-176.6	-63.3	178.1	-170.6	-153.7	0.1	111	V736 S737 C818	V736-R820 CarbonylContact C-O 3.51Å; V736-R820 VanDerWaalsContact CA-O 3.26Å; V736-R820 WeakPolarHBondContact CA-O 3.48Å; V736-R820 WeakPolarHBondContact CG1-O 3.37Å; S737-R820 PolarHBondContact N-O 2.89Å; S737-R820 PolarHBondContact O-N 2.04Å; C818-R820 PolarHBondContact O-N 3.36Å
821	C	93.6	Very high	71.6	Confident	27 Å²	27	98.1 Å²	98.1	18%	0.182	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	114.9	167.2	-168.5	0	0	0	0	108.3	C732 Y768 V823	C732-C821 WeakPolarHBondContact CA-SG 3.33Å; C732-C821 HydrophobicContact CB-CB 3.86Å; C732-C821 WeakPolarHBondContact CB-SG 3.37Å; C732-C821 WeakPolarHBondContact SG-CB 3.26Å; C732-C821 CovalentContact SG-SG 2.04Å; C732-C821 PolarHBondContact SG-SG 3.44Å; Y768-C821 HydrophobicContact CD1-CB 4.38Å; Y768-C821 HydrophobicContact CE1-CB 3.7Å; Y768-C821 HydrophobicContact CE2-CB 3.91Å; Y768-C821 VanDerWaalsContact CZ-CB 3.45Å; C821-V823 PolarHBondContact O-N 3.29Å
822	D	87.8	Confident	69.4	Low	52 Å²	52	94.3 Å²	94.3	28%	0.278	49%	0.49	S	S	.	.			trans	-83	103.4	-174.6	-83.3	9.3	0	0	0	110.5	N735 S737 T824	N735-D822 PolarHBondContact O-N 3.48Å; S737-D822 WeakPolarHBondContact CB-OD1 3.11Å; S737-D822 VanDerWaalsContact CB-OD2 3.27Å; S737-D822 WeakPolarHBondContact CB-OD2 3.18Å; S737-D822 VanDerWaalsContact OG-CG 3.26Å; S737-D822 PolarHBondContact OG-OD1 3.43Å; S737-D822 PolarHBondContact OG-OD2 2.91Å; D822-T824 PolarHBondContact O-N 2.87Å
823	V	76.1	Confident	67.1	Low	117 Å²	117	91.8 Å²	91.8	71%	0.709	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-70.8	-12.8	-178.7	-146.7	0	0	0	0	113.1	L734 C821 G825	L734-V823 HydrophobicContact CD1-CG1 4.28Å; C821-V823 PolarHBondContact O-N 3.29Å; V823-G825 VanDerWaalsContact C-N 3.28Å; V823-G825 PolarHBondContact O-N 3.1Å
824	T	59.4	Low	64.8	Low	116 Å²	116	94.5 Å²	94.5	71%	0.712	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-81.6	7.6	-168.1	46.5	0	0	0	0	115.2	D822 F826	D822-T824 PolarHBondContact O-N 2.87Å; T824-F826 VanDerWaalsContact C-N 3.29Å; T824-F826 PolarHBondContact O-N 2.97Å
825	G	52.5	Low	62.5	Low	57 Å²	57	101 Å²	101	59%	0.588	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-69.3	-14.8	-175.1	0	0	0	0	0	116.5	V823	V823-G825 VanDerWaalsContact C-N 3.28Å; V823-G825 PolarHBondContact O-N 3.1Å
826	F	48.8	Very low	60.1	Low	186 Å²	186	109 Å²	109	82%	0.816	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-92.7	-9.6	-171.6	-79.6	-70.5	0	0	0	115.9	L734 T824	L734-F826 HydrophobicContact CD1-CE2 4.3Å; L734-F826 HydrophobicContact CD2-CD2 4.34Å; L734-F826 HydrophobicContact CD2-CE2 3.79Å; L734-F826 HydrophobicContact CD2-CZ 4.4Å; L734-F826 HydrophobicContact CG-CE2 4.49Å; T824-F826 VanDerWaalsContact C-N 3.29Å; T824-F826 PolarHBondContact O-N 2.97Å
827	E	42.3	Very low	57.6	Low	180 Å²	180	113.9 Å²	113.9	84%	0.841	61%	0.608	S	S	*	*	S	Bend	trans	-128.7	53.7	-169.8	-159.9	172.8	-148.7	0	0	113.2
828	K	36.2	Very low	54.9	Low	202 Å²	202	117.7 Å²	117.7	88%	0.878	64%	0.635	S	S	*	*			trans	-156.1	45.7	167.9	-120.8	158.1	-168.5	171.6	0	116.4
829	I	38.6	Very low	52.5	Low	169 Å²	169	125.4 Å²	125.4	87%	0.867	67%	0.672	S	S	*	*			trans	-107.2	79.7	161.2	-51.7	179.3	0	0	0	108.6
830	Q	35.1	Very low	49.7	Very low	188 Å²	188	134.5 Å²	134.5	88%	0.879	71%	0.711	S	S	*	*			trans	-130.9	144.6	167.6	-77.8	-171.8	-12.1	0	0	110.2
831	L	34.6	Very low	47.2	Very low	162 Å²	162	133.2 Å²	133.2	85%	0.848	72%	0.719	S	S	*	*			trans	-75.3	154.8	-175	-89	58.9	0	0	0	111.5
832	P	33.2	Very low	44.6	Very low	125 Å²	125	137 Å²	137	81%	0.812	75%	0.746	S	S	*	*			trans	-85.2	132.7	-174.2	33	-34.4	0	0	0	113.4
833	S	35.8	Very low	41.9	Very low	98 Å²	98	140.6 Å²	140.6	69%	0.685	77%	0.77	S	S	*	*			trans	-165.4	117.3	150.9	57.5	0	0	0	0	113
834	N	38.4	Very low	40.1	Very low	125 Å²	125	143.4 Å²	143.4	67%	0.668	78%	0.78	S	S	*	*			trans	68.1	119.7	139.7	-58.3	55.1	0	0	0	118.2
835	E	41.7	Very low	39	Very low	158 Å²	158	146.3 Å²	146.3	74%	0.738	79%	0.786	S	S	*	*				73	138	94.2	-65.2	165	162.5	0	0	113.6
836	E	40.9	Very low	38.5	Very low	175 Å²	175	149.2 Å²	149.2	82%	0.818	79%	0.794	S	S	*	*			cis	-163.1	151.5	-1.7	-123.4	-173.2	137	0	0	110.3
837	A	41.1	Very low	38.3	Very low	101 Å²	101	146.3 Å²	146.3	84%	0.835	79%	0.794	S	S	*	*			trans	59	168.1	164.1	0	0	0	0	0	118.6
838	S	36.7	Very low	38	Very low	89 Å²	89	147 Å²	147	62%	0.622	79%	0.794	S	S	*	*			cis	-148.5	158.8	-5.3	-148.6	0	0	0	0	113.5
839	E	42.7	Very low	38.4	Very low	163 Å²	163	144.5 Å²	144.5	76%	0.762	79%	0.79	S	S	*	*			trans	49.6	96	146.9	-72.8	157.3	124.6	0	0	123.6
840	F	35.8	Very low	38.4	Very low	207 Å²	207	145 Å²	145	91%	0.908	79%	0.789	S	S	*	*				65.6	157.7	110.3	-88.5	-109.8	0	0	0	123.3
841	P	40.8	Very low	38.8	Very low	100 Å²	100	142.7 Å²	142.7	65%	0.649	79%	0.787	S	S	*	*			trans	-131	-175.6	-152.6	45.7	-30.9	0	0	0	115.7
842	S	38	Very low	38.9	Very low	107 Å²	107	140 Å²	140	75%	0.748	78%	0.782	S	S	*	*			trans	168.1	122.2	143.5	-81.1	0	0	0	0	110.2
843	T	31.7	Very low	39.2	Very low	128 Å²	128	142.5 Å²	142.5	79%	0.785	78%	0.783	S	S	*	*				73.6	111.6	81.8	-54.5	0	0	0	0	114.6
844	L	37.1	Very low	39.3	Very low	176 Å²	176	143.9 Å²	143.9	92%	0.921	79%	0.787	S	S	*	*			trans	-159.6	145.2	152.1	-111.4	162.6	0	0	0	110.5
845	Q	36.1	Very low	39.3	Very low	177 Å²	177	143.8 Å²	143.8	83%	0.827	79%	0.793	S	S	*	*			trans	-104.3	162.2	-173.4	-86.8	-176.7	-19.6	0	0	113.2
846	P	42.2	Very low	39.1	Very low	117 Å²	117	140 Å²	140	76%	0.76	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-87.8	154.9	-176.8	35.4	-36.3	0	0	0	114.1
847	P	45.8	Very low	38.9	Very low	125 Å²	125	140.2 Å²	140.2	81%	0.812	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-92.1	160.2	169.2	36.3	-33.2	0	0	0	113.3
848	K	35.5	Very low	38.9	Very low	195 Å²	195	143.7 Å²	143.7	85%	0.848	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-95.7	164.3	169.5	-60.5	176.5	-179.5	178.1	0	111.2
849	N	44.6	Very low	38.9	Very low	149 Å²	149	147.7 Å²	147.7	80%	0.797	81%	0.809	S	S	*	*			trans	162.6	124.6	142.2	-78.9	-7.5	0	0	0	106.2
850	E	38.1	Very low	38.8	Very low	180 Å²	180	148.3 Å²	148.3	84%	0.841	81%	0.812	S	S	*	*			cis	79.1	115.6	41.7	-164.5	174.5	-105.5	0	0	113.9
851	V	44.9	Very low	38.9	Very low	140 Å²	140	147.3 Å²	147.3	85%	0.848	81%	0.807	S	S	*	*			trans	164	152.7	148.3	154.3	0	0	0	0	110.2
852	S	35.6	Very low	38.6	Very low	105 Å²	105	150.2 Å²	150.2	73%	0.734	81%	0.809	S	S	*	*			trans	-80.6	-177.6	-174.3	-58.7	0	0	0	0	112.8
853	E	39.8	Very low	38.6	Very low	177 Å²	177	154.2 Å²	154.2	83%	0.827	82%	0.816	S	S	*	*			cis	-155.9	138.3	36.1	-69.1	-176.8	142.3	0	0	115
854	T	36.9	Very low	38.7	Very low	127 Å²	127	151.2 Å²	151.2	78%	0.779	81%	0.811	S	S	*	*				34.9	162.2	123.8	7.5	0	0	0	0	123.6
855	P	38.6	Very low	38.4	Very low	123 Å²	123	149.4 Å²	149.4	80%	0.799	81%	0.812	S	S	*	*				-128.4	172	-102.7	43.2	-27.7	0	0	0	116.3
856	G	37.6	Very low	38.5	Very low	80 Å²	80	147 Å²	147	83%	0.825	81%	0.809	S	S	*	*			trans	-104.1	136.1	168.5	0	0	0	0	0	113.3
857	K	36.5	Very low	38.1	Very low	179 Å²	179	147.4 Å²	147.4	78%	0.778	81%	0.805	S	S	*	*			trans	-85.4	153.6	171.4	-66.5	-175.4	175.2	-169	0	111.5
858	N	41.3	Very low	37.6	Very low	174 Å²	174	146.5 Å²	146.5	93%	0.93	80%	0.797	S	S	*	*			trans	-151.5	148.4	137.8	-99.8	-24.3	0	0	0	109.7
859	E	38.1	Very low	37.8	Very low	172 Å²	172	144.8 Å²	144.8	80%	0.804	80%	0.795	S	S	*	*			trans	-112.6	136.3	-176.8	-60.4	170.7	152.8	0	0	109.3
860	E	39.7	Very low	37.7	Very low	177 Å²	177	144.4 Å²	144.4	83%	0.827	80%	0.803	S	S	*	*			trans	-138.2	107.2	162.8	-168	133.8	-136.5	0	0	112.7
861	K	37	Very low	37.7	Very low	185 Å²	185	145.4 Å²	145.4	80%	0.804	80%	0.799	S	S	*	*			trans	23.7	118.3	156.1	-69.1	169.2	-178	162.4	0	120.1
862	K	34.6	Very low	37.2	Very low	161 Å²	161	146.8 Å²	146.8	70%	0.7	80%	0.796	S	S	*	*			trans	-58.6	139.1	149.7	-48.8	169.4	-170.4	177	0	109.9	E377	E377-K862 IonicContact OE1-NZ 2.59Å; E377-K862 PolarHBondContact OE1-NZ 3.35Å
863	Q	38.3	Very low	37.3	Very low	191 Å²	191	148 Å²	148	89%	0.893	80%	0.799	S	S	*	*			trans	-130.3	121.4	154.4	-168	73.8	18.9	0	0	106.7
864	G	33.6	Very low	37.1	Very low	65 Å²	65	147.4 Å²	147.4	67%	0.67	80%	0.801	S	S	*	*			trans	-83.3	151.3	-172.1	0	0	0	0	0	113.4
865	C	32.3	Very low	36.8	Very low	139 Å²	139	145.9 Å²	145.9	94%	0.939	80%	0.801	S	S	*	*			trans	-96.8	103.9	166.8	-168	0	0	0	0	108.8
866	T	37	Very low	36.6	Very low	125 Å²	125	144.6 Å²	144.6	77%	0.767	80%	0.802	S	S	*	*			trans	-92.7	147.8	177.5	47.1	0	0	0	0	111.7
867	D	34.5	Very low	36.4	Very low	126 Å²	126	147.3 Å²	147.3	67%	0.674	80%	0.802	S	S	*	*	S	Bend	trans	-25.6	138.1	-178.5	-67.1	-86.2	0	0	0	119
868	T	34.2	Very low	36.3	Very low	106 Å²	106	145.3 Å²	145.3	65%	0.65	81%	0.805	S	S	*	*	S	Bend		-168.7	-41.3	124.3	-75	0	0	0	0	110.9
869	I	40.8	Very low	36	Very low	159 Å²	159	142.9 Å²	142.9	82%	0.815	80%	0.801	S	S	*	*	G	3₁₀ helix	trans	-79.2	-27.4	-161.8	-61.8	176	0	0	0	114.1	R871	I869-R871 PolarHBondContact O-N 3.06Å
870	C	41.4	Very low	35.8	Very low	141 Å²	141	140.2 Å²	140.2	95%	0.953	80%	0.802	S	S	*	*	G	3₁₀ helix	trans	-78	21.7	-177	-59.3	0	0	0	0	115.1
871	R	38.1	Very low	35.6	Very low	201 Å²	201	140.1 Å²	140.1	76%	0.758	80%	0.801	S	S	*	*	G	3₁₀ helix	trans	-141.2	18.1	-165.2	-137.6	170.6	-177.4	164.9	-1.6	116.1	I869	I869-R871 PolarHBondContact O-N 3.06Å
872	Q	34.5	Very low	35.6	Very low	170 Å²	170	141.6 Å²	141.6	79%	0.794	81%	0.808	S	S	*	*			trans	-128.2	68.5	178.6	-67.4	-169.8	-3.6	0	0	112.6
873	V	39.1	Very low	35.7	Very low	129 Å²	129	140.3 Å²	140.3	78%	0.782	81%	0.807	S	S	*	*	S	Bend	trans	-134	-34.3	164.4	-172.8	0	0	0	0	111	A875	V873-A875 VanDerWaalsContact C-N 3.28Å; V873-A875 PolarHBondContact O-N 3.22Å
874	D	34.9	Very low	36	Very low	165 Å²	165	134.4 Å²	134.4	88%	0.882	79%	0.787	S	S	*	*	S	Bend	trans	-83.2	46.2	-175.2	-53.6	-58.1	0	0	0	114.8
875	A	31	Very low	36.6	Very low	95 Å²	95	135.4 Å²	135.4	79%	0.785	78%	0.78	S	S	*	*			trans	-152.8	45.1	-177	0	0	0	0	0	115.8	V873	V873-A875 VanDerWaalsContact C-N 3.28Å; V873-A875 PolarHBondContact O-N 3.22Å
876	A	34.1	Very low	37.6	Very low	97 Å²	97	132.1 Å²	132.1	80%	0.802	76%	0.756	S	S	*	*			trans	-121	106.7	173.1	0	0	0	0	0	111.4
877	T	33.7	Very low	38.6	Very low	137 Å²	137	128 Å²	128	84%	0.84	73%	0.734	S	S	*	*			trans	-88.8	117.1	-174.2	-56.4	0	0	0	0	112.1
878	V	34.3	Very low	39.5	Very low	137 Å²	137	129.5 Å²	129.5	83%	0.83	74%	0.737	S	S	*	*			trans	20.6	104.4	154.1	-170	0	0	0	0	117.4
879	S	35.3	Very low	40.8	Very low	123 Å²	123	128.5 Å²	128.5	86%	0.86	73%	0.727	S	S	*	*			trans	-137.5	145.7	140.8	-171.7	0	0	0	0	108.5
880	S	33.2	Very low	41.1	Very low	116 Å²	116	128 Å²	128	81%	0.811	72%	0.723	S	S	*	*			trans	-105.7	87.4	-163.1	60	0	0	0	0	113.6
881	E	35.6	Very low	41.9	Very low	174 Å²	174	122.7 Å²	122.7	81%	0.813	69%	0.686	S	S	*	*			trans	-144.7	139.6	166	-155.2	155.6	-143.7	0	0	111.1	I883	E881-I883 PolarHBondContact O-N 3.24Å
882	K	38.2	Very low	42.7	Very low	216 Å²	216	117.3 Å²	117.3	94%	0.939	68%	0.677	S	S	*	*			trans	-83.6	79	-170	-82.4	-172.9	173.8	-179.8	0	112.3
883	I	36.6	Very low	43.3	Very low	135 Å²	135	114 Å²	114	69%	0.692	67%	0.673	S	S	*	*			trans	-111.4	125.3	167.2	-57	-179.8	0	0	0	109.3	E881 T885	E881-I883 PolarHBondContact O-N 3.24Å; I883-T885 PolarHBondContact O-N 3Å; I883-T885 VanDerWaalsContact O-N 3.1Å
884	S	44.3	Very low	44	Very low	67 Å²	67	109.6 Å²	109.6	47%	0.469	65%	0.653	S	S	.	*			trans	-85.6	71.6	-175.9	174.7	0	0	0	0	111.1	V886 K966	S884-V886 PolarHBondContact O-N 2.87Å; S884-V886 VanDerWaalsContact O-N 3.16Å; S884-K966 VanDerWaalsContact OG-CE 3.23Å; S884-K966 WeakPolarHBondContact OG-CE 3.49Å; S884-K966 PolarHBondContact OG-NZ 2.95Å
885	T	45.7	Very low	45	Very low	86 Å²	86	111.3 Å²	111.3	53%	0.528	65%	0.653	S	S	.	*			trans	-56.8	118.9	-178.8	-48.7	0	0	0	0	111.7	I883 T967	I883-T885 PolarHBondContact O-N 3Å; I883-T885 VanDerWaalsContact O-N 3.1Å; T885-T967 PolarHBondContact O-N 3.14Å; T885-T967 PolarHBondContact O-OG1 3.41Å
886	V	53.8	Low	46.9	Very low	70 Å²	70	111 Å²	111	42%	0.424	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.6	128.6	169.4	179.9	0	0	0	0	107.7	S884 F964 C965	S884-V886 PolarHBondContact O-N 2.87Å; S884-V886 VanDerWaalsContact O-N 3.16Å; V886-F964 HydrophobicContact CG1-CB 3.92Å; V886-F964 HydrophobicContact CG1-CD2 4.46Å; V886-C965 WeakPolarHBondContact CA-O 3.22Å
887	A	57.3	Low	49.1	Very low	37 Å²	37	112.9 Å²	112.9	31%	0.306	63%	0.628	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.9	131.8	174.3	0	0	0	0	0	109.6	I889 C965	A887-I889 HydrophobicContact CB-CG1 4.26Å; A887-C965 PolarHBondContact N-O 3.22Å; A887-C965 PolarHBondContact O-N 2.74Å
888	Q	53.9	Low	51.5	Low	158 Å²	158	106.6 Å²	106.6	74%	0.738	59%	0.59	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-71.5	131.2	161.7	-71.8	176.7	-17.7	0	0	108.2	G963	Q888-G963 WeakPolarHBondContact CA-O 3.43Å
889	I	60	Low	53.5	Low	86 Å²	86	106.3 Å²	106.3	44%	0.441	59%	0.588	S	S	.	*			trans	-130	114.4	-179.5	-58	-172.8	0	0	0	108.7	A887 V891 G963 C965	A887-I889 HydrophobicContact CB-CG1 4.26Å; I889-V891 PolarHBondContact O-N 2.79Å; I889-G963 PolarHBondContact N-O 3.4Å; I889-C965 HydrophobicContact CD1-CB 3.67Å; I889-C965 HydrophobicContact CG1-CB 4.14Å
890	M	49	Very low	55.4	Low	148 Å²	148	103.1 Å²	103.1	73%	0.729	56%	0.559	S	S	*	*			trans	-71.5	119.7	170.8	-75.5	-176.4	171	0	0	110.5	Q940	M890-Q940 VanDerWaalsContact CA-OE1 3.22Å
891	V	57.6	Low	57.6	Low	30 Å²	30	100 Å²	100	18%	0.182	53%	0.529	C	S	.	.			trans	-72	124.4	171.1	-178.2	0	0	0	0	107.3	I889 S893 Q940	I889-V891 PolarHBondContact O-N 2.79Å; V891-S893 PolarHBondContact O-N 2.74Å; V891-Q940 HydrophobicContact CB-CB 4.45Å; V891-Q940 HydrophobicContact CB-CG 4.42Å; V891-Q940 HydrophobicContact CG2-CB 4.14Å; V891-Q940 VanDerWaalsContact N-OE1 3.08Å
892	P	53.8	Low	60.1	Low	87 Å²	87	92 Å²	92	57%	0.565	49%	0.492	S	S	*	.			trans	-68.6	110.2	-169.1	-15.6	26.4	0	0	0	111.5	R896	P892-R896 PolarHBondContact O-NE 3.46Å; P892-R896 PolarHBondContact O-NH2 3.15Å
893	S	47.7	Very low	62.5	Low	102 Å²	102	82.9 Å²	82.9	71%	0.713	45%	0.454	S	S	*	.			trans	-59.3	144.7	-165.5	-40.6	0	0	0	0	113.7	V891 G937	V891-S893 PolarHBondContact O-N 2.74Å; S893-G937 WeakPolarHBondContact CA-O 3.38Å
894	G	54.1	Low	65.1	Low	36 Å²	36	76.4 Å²	76.4	37%	0.371	42%	0.422	S	S	.	.	S	Bend	trans	147.5	151.1	179.8	0	0	0	0	0	112.1	R896 G937	G894-R896 WeakPolarHBondContact O-CG 3.28Å; G894-R896 PolarHBondContact O-N 3.35Å; G894-G937 PolarHBondContact N-O 3.44Å; G894-G937 VanDerWaalsContact O-CA 3.28Å; G894-G937 WeakPolarHBondContact O-CA 3.48Å
895	K	55.4	Low	67.3	Low	201 Å²	201	73.8 Å²	73.8	87%	0.874	40%	0.402	S	S	*	.			trans	-68	116.9	179.6	-66.4	-171	175.9	-170.9	0	110.6
896	R	71.5	Confident	69.4	Low	87 Å²	87	71 Å²	71	33%	0.328	39%	0.388	S	S	.	.			trans	-131.5	104.7	-176.4	-63.1	167.3	-179.1	-138.3	4.4	110.4	P892 G894 C898 Y934 N935	P892-R896 PolarHBondContact O-NE 3.46Å; P892-R896 PolarHBondContact O-NH2 3.15Å; G894-R896 WeakPolarHBondContact O-CG 3.28Å; G894-R896 PolarHBondContact O-N 3.35Å; R896-C898 PolarHBondContact O-N 2.88Å; R896-C898 VanDerWaalsContact O-N 3.14Å; R896-Y934 HydrophobicContact CB-CD1 4.17Å; R896-Y934 HydrophobicContact CB-CE1 3.56Å; R896-Y934 WeakPolarHBondContact CD-OH 3.31Å; R896-Y934 HydrophobicContact CG-CE1 4.41Å; R896-Y934 PolarHBondContact NH1-OH 2.92Å; R896-Y934 VanDerWaalsContact NH1-OH 3.1Å; R896-N935 WeakPolarHBondContact O-CA 3.39Å; R896-N935 PolarHBondContact O-OD1 2.99Å
897	N	80.9	Confident	71.1	Confident	138 Å²	138	69.1 Å²	69.1	74%	0.738	37%	0.374	S	S	*	.			trans	-72.4	109.9	170.4	-71.9	5.4	0	0	0	109.5	T899 N935	N897-T899 PolarHBondContact O-N 3Å; N897-N935 WeakPolarHBondContact CA-OD1 3.22Å
898	C	82.2	Confident	72.4	Confident	5 Å²	5	72.5 Å²	72.5	3%	0.034	38%	0.383	C	S	.	.			trans	-74	97	169.6	-171.8	0	0	0	0	110	R896 K900 K931 Y934 N935 C988	R896-C898 PolarHBondContact O-N 2.88Å; R896-C898 VanDerWaalsContact O-N 3.14Å; C898-K900 PolarHBondContact O-N 2.85Å; C898-K900 PolarHBondContact SG-O 2.04Å; C898-K931 VanDerWaalsContact O-CE 3.23Å; C898-K931 WeakPolarHBondContact O-CE 3.26Å; C898-Y934 HydrophobicContact CB-CD1 3.68Å; C898-Y934 HydrophobicContact CB-CE1 3.87Å; C898-N935 PolarHBondContact N-OD1 2.8Å; C898-C988 WeakPolarHBondContact CA-SG 3.31Å; C898-C988 HydrophobicContact CB-CB 3.77Å; C898-C988 WeakPolarHBondContact CB-SG 3.39Å; C898-C988 VanDerWaalsContact SG-CA 3.6Å; C898-C988 WeakPolarHBondContact SG-CB 3.48Å; C898-C988 CovalentContact SG-SG 2.04Å; C898-C988 PolarHBondContact SG-SG 2.68Å
899	T	78.4	Confident	73.5	Confident	130 Å²	130	67.1 Å²	67.1	80%	0.798	36%	0.362	S	S	*	.			trans	-77.7	-5	174	53.4	0	0	0	0	113.5	N897	N897-T899 PolarHBondContact O-N 3Å
900	K	75.1	Confident	73.9	Confident	57 Å²	57	65.7 Å²	65.7	25%	0.248	36%	0.363	C	S	.	.	S	Bend	trans	-114.9	-178.8	-175.4	-67.5	-178.2	159.3	-163.6	0	111.7	C898 S989 E996	C898-K900 PolarHBondContact O-N 2.85Å; C898-K900 PolarHBondContact SG-O 2.04Å; K900-S989 WeakPolarHBondContact CB-OG 3.02Å; K900-S989 WeakPolarHBondContact CD-O 3.31Å; K900-E996 WeakPolarHBondContact CE-OE2 3.14Å; K900-E996 IonicContact NZ-OE1 3.12Å; K900-E996 PolarHBondContact NZ-OE1 2.8Å; K900-E996 IonicContact NZ-OE2 2.69Å; K900-E996 PolarHBondContact NZ-OE2 2.63Å
901	R	79.1	Confident	74.2	Confident	49 Å²	49	64.1 Å²	64.1	19%	0.185	35%	0.354	C	S	.	.			trans	-62.6	136.9	169.7	176.5	152.4	-86.1	157.1	-4.4	110.8	V973 S989 F999 D1075	R901-V973 VanDerWaalsContact CD-CG1 3.43Å; R901-V973 HydrophobicContact CG-CG1 3.99Å; R901-V973 HydrophobicContact CG-CG2 4.47Å; R901-V973 VanDerWaalsContact NE-CG1 3.3Å; R901-S989 WeakPolarHBondContact O-CB 3.11Å; R901-S989 PolarHBondContact O-N 3.48Å; R901-S989 PolarHBondContact O-OG 3.33Å; R901-F999 VanDerWaalsContact CZ-O 3.24Å; R901-F999 PolarHBondContact NH1-O 2.75Å; R901-F999 PolarHBondContact NH2-O 3.23Å; R901-D1075 IonicContact CZ-OD1 2.72Å; R901-D1075 IonicContact NE-OD2 2.78Å; R901-D1075 IonicContact NH2-OD1 3.16Å; R901-D1075 PolarHBondContact NH2-OD1 3.08Å; R901-D1075 IonicContact NH2-OD2 3.95Å; R901-D1075 PolarHBondContact NH2-OD2 3.43Å; R901-D1075 VanDerWaalsContact NH2-OD2 3.16Å
902	I	87	Confident	73.9	Confident	8 Å²	8	68.5 Å²	68.5	4%	0.041	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	158.3	177	-156.3	160.6	0	0	0	110.7	A927 A930 K931 Y934 I986	I902-A927 HydrophobicContact CG2-CB 4.19Å; I902-A930 HydrophobicContact CD1-CB 4.16Å; I902-A930 WeakPolarHBondContact CD1-O 3.43Å; I902-A930 HydrophobicContact CG2-CB 4.28Å; I902-K931 HydrophobicContact CD1-CB 4.06Å; I902-Y934 HydrophobicContact CD1-CG 4.2Å; I902-I986 HydrophobicContact CD1-CG2 3.54Å; I902-I986 HydrophobicContact CG1-CG2 3.93Å
903	T	88.8	Confident	74.6	Confident	23 Å²	23	68.2 Å²	68.2	14%	0.141	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	141.4	176.6	62.7	0	0	0	0	109.7	L972 I986 A987	T903-L972 VanDerWaalsContact CA-O 3.29Å; T903-L972 WeakPolarHBondContact CA-O 3.36Å; T903-I986 WeakPolarHBondContact O-CA 3.39Å; T903-A987 PolarHBondContact N-O 3.38Å; T903-A987 PolarHBondContact O-N 2.93Å; T903-A987 PolarHBondContact OG1-O 3.11Å
904	F	91.9	Very high	75.6	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	168.1	-175.7	58.8	-87.1	0	0	0	111.5	A906 A926 A927 A930 K971 L972 H975 I983 I986	F904-A906 HydrophobicContact CE2-CB 4.34Å; F904-A926 HydrophobicContact CE2-CB 4.26Å; F904-A926 HydrophobicContact CZ-CB 3.81Å; F904-A927 HydrophobicContact CE1-CB 4.29Å; F904-A930 HydrophobicContact CB-CB 4.33Å; F904-A930 HydrophobicContact CD1-CB 3.73Å; F904-A930 HydrophobicContact CE1-CB 4.27Å; F904-A930 HydrophobicContact CG-CB 4.12Å; F904-K971 CarbonylContact O-C 3.58Å; F904-K971 VanDerWaalsContact O-CA 3.32Å; F904-K971 WeakPolarHBondContact O-CA 3.29Å; F904-L972 HydrophobicContact CE2-CB 4.28Å; F904-L972 HydrophobicContact CZ-CB 4.38Å; F904-L972 PolarHBondContact N-O 2.85Å; F904-L972 PolarHBondContact O-N 2.58Å; F904-H975 HydrophobicContact CE2-CB 3.91Å; F904-H975 HydrophobicContact CZ-CB 3.94Å; F904-I983 HydrophobicContact CB-CG2 3.82Å; F904-I983 HydrophobicContact CD2-CB 4.46Å; F904-I983 HydrophobicContact CD2-CG1 4.21Å; F904-I983 HydrophobicContact CD2-CG2 3.79Å; F904-I983 HydrophobicContact CE2-CG1 4.29Å; F904-I983 HydrophobicContact CG-CG2 3.89Å; F904-I986 HydrophobicContact CB-CG1 4.28Å
905	Q	90.8	Very high	76.9	Confident	11 Å²	11	67.9 Å²	67.9	5%	0.051	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	129.4	167.8	-66.9	-173	0	0	0	108.4	F907 K966 S969 K971 S984 C985	Q905-F907 HydrophobicContact CB-CD2 4.42Å; Q905-F907 HydrophobicContact CB-CE2 3.58Å; Q905-F907 HydrophobicContact CB-CZ 3.74Å; Q905-K966 PolarHBondContact NE2-O 3.31Å; Q905-K966 PolarHBondContact OE1-O 3.28Å; Q905-S969 PolarHBondContact NE2-O 3.43Å; Q905-S969 PolarHBondContact NE2-OG 3.45Å; Q905-S969 PolarHBondContact OE1-OG 2.81Å; Q905-K971 HydrophobicContact CG-CG 4.32Å; Q905-S984 PolarHBondContact N-O 2.91Å; Q905-S984 PolarHBondContact O-N 3.44Å; Q905-C985 HydrophobicContact CB-CB 4.16Å; Q905-C985 VanDerWaalsContact CD-SG 3.55Å; Q905-C985 HydrophobicContact CG-CB 3.87Å; Q905-C985 PolarHBondContact OE1-SG 2.85Å; Q905-C985 VanDerWaalsContact OE1-SG 3.38Å
906	A	89.5	Confident	78.2	Confident	29 Å²	29	59.3 Å²	59.3	24%	0.24	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	138.2	173.4	0	0	0	0	0	110.4	F904 L972 H975 F981 V982	F904-A906 HydrophobicContact CE2-CB 4.34Å; A906-L972 HydrophobicContact CB-CD1 3.73Å; A906-H975 VanDerWaalsContact CB-CD2 3.5Å; A906-H975 WeakPolarHBondContact CB-CD2 3.36Å; A906-F981 HydrophobicContact CB-CD2 3.87Å; A906-F981 HydrophobicContact CB-CE2 4.18Å; A906-V982 CarbonylContact C-O 3.51Å; A906-V982 WeakPolarHBondContact CA-O 3.03Å
907	F	88.2	Confident	78.9	Confident	30 Å²	30	55.5 Å²	55.5	13%	0.132	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	128.3	-179.4	-58.4	-87.5	0	0	0	109.8	Q905 F964 K966 F981 V982	Q905-F907 HydrophobicContact CB-CD2 4.42Å; Q905-F907 HydrophobicContact CB-CE2 3.58Å; Q905-F907 HydrophobicContact CB-CZ 3.74Å; F907-F964 HydrophobicContact CB-CE2 4.03Å; F907-F964 HydrophobicContact CB-CZ 4.07Å; F907-F964 HydrophobicContact CD1-CD2 4.43Å; F907-F964 AromaticContact CD1-CE2 3.66Å; F907-F964 HydrophobicContact CD1-CE2 3.66Å; F907-F964 HydrophobicContact CD2-CD2 4.32Å; F907-F964 AromaticContact CD2-CE2 3.51Å; F907-F964 HydrophobicContact CD2-CE2 3.51Å; F907-F964 AromaticContact CD2-CZ 3.82Å; F907-F964 HydrophobicContact CD2-CZ 3.82Å; F907-F964 HydrophobicContact CE1-CD2 4.19Å; F907-F964 AromaticContact CE1-CE2 3.86Å; F907-F964 HydrophobicContact CE1-CE2 3.86Å; F907-F964 HydrophobicContact CE2-CD2 4.07Å; F907-F964 AromaticContact CE2-CE2 3.72Å; F907-F964 HydrophobicContact CE2-CE2 3.72Å; F907-F964 HydrophobicContact CE2-CZ 4.33Å; F907-F964 HydrophobicContact CG-CD2 4.48Å; F907-F964 AromaticContact CG-CE2 3.46Å; F907-F964 HydrophobicContact CG-CE2 3.46Å; F907-F964 VanDerWaalsContact CG-CE2 3.46Å; F907-F964 AromaticContact CG-CZ 3.91Å; F907-F964 HydrophobicContact CG-CZ 3.91Å; F907-F964 AromaticContact CZ-CD2 3.99Å; F907-F964 HydrophobicContact CZ-CD2 3.99Å; F907-F964 AromaticContact CZ-CE2 3.87Å; F907-F964 HydrophobicContact CZ-CE2 3.87Å; F907-K966 HydrophobicContact CE1-CB 4.12Å; F907-K966 HydrophobicContact CZ-CB 4.47Å; F907-F981 WeakPolarHBondContact O-CB 3.25Å; F907-V982 HydrophobicContact CB-CB 4.44Å; F907-V982 PolarHBondContact N-O 3.26Å; F907-V982 PolarHBondContact O-N 2.98Å
908	Q	85	Confident	79	Confident	108 Å²	108	52.9 Å²	52.9	51%	0.505	29%	0.288	S	S	.	.			trans	-63.6	140.7	167.3	-70.3	-68.3	-28.5	0	0	109.2	A910 S979	Q908-A910 PolarHBondContact O-N 2.03Å; Q908-S979 PolarHBondContact NE2-OG 3.39Å; Q908-S979 VanDerWaalsContact NE2-OG 3.11Å; Q908-S979 PolarHBondContact OE1-OG 2.85Å
909	P	78.4	Confident	79.2	Confident	45 Å²	45	54.5 Å²	54.5	29%	0.292	30%	0.299	S	S	.	.			trans	-70.7	105.6	-177.5	-14.3	29.8	0	0	0	110.6	F507 P980	F507-P909 HydrophobicContact CD1-CB 3.88Å; F507-P909 HydrophobicContact CD1-CG 4.37Å; F507-P909 HydrophobicContact CE1-CB 3.21Å; F507-P909 HydrophobicContact CE1-CG 3.28Å; F507-P909 HydrophobicContact CZ-CB 3.78Å; F507-P909 HydrophobicContact CZ-CG 3.35Å; P909-P980 VanDerWaalsContact CD-O 3.24Å; P909-P980 WeakPolarHBondContact CD-O 3.14Å; P909-P980 WeakPolarHBondContact CG-O 3.18Å
910	A	67.5	Low	79.7	Confident	55 Å²	55	53.7 Å²	53.7	46%	0.455	29%	0.29	S	S	.	.			trans	-82	150.4	169.6	0	0	0	0	0	110.7	Q908 N912 Y913	Q908-A910 PolarHBondContact O-N 2.03Å; A910-N912 PolarHBondContact O-N 3.19Å; A910-Y913 HydrophobicContact CB-CD2 3.77Å; A910-Y913 HydrophobicContact CB-CE2 3.88Å; A910-Y913 PolarHBondContact O-N 2.81Å
911	E	54.4	Low	80.4	Confident	116 Å²	116	54.4 Å²	54.4	54%	0.542	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-12.6	-170.7	-62.2	-167.5	-152.7	0	0	116.1	K628	K628-E911 IonicContact NZ-OE2 2.67Å
912	N	52.7	Low	80.9	Confident	122 Å²	122	60.9 Å²	60.9	65%	0.652	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	-1.5	-178.6	-61.2	-36.4	0	0	0	114.4	A910 N914	A910-N912 PolarHBondContact O-N 3.19Å; N912-N914 VanDerWaalsContact C-N 3.35Å; N912-N914 PolarHBondContact O-N 2.8Å; N912-N914 VanDerWaalsContact O-N 3.08Å
913	Y	68.7	Low	80.9	Confident	80 Å²	80	60.6 Å²	60.6	31%	0.314	32%	0.317	S	S	.	.			trans	-83.8	77.1	176.6	-73.1	-72.9	0	0	0	111.7	A910 V915 F964	A910-Y913 HydrophobicContact CB-CD2 3.77Å; A910-Y913 HydrophobicContact CB-CE2 3.88Å; A910-Y913 PolarHBondContact O-N 2.81Å; Y913-V915 PolarHBondContact O-N 3.19Å; Y913-F964 HydrophobicContact CD1-CD1 4.04Å; Y913-F964 AromaticContact CD1-CE1 3.57Å; Y913-F964 HydrophobicContact CD1-CE1 3.57Å; Y913-F964 HydrophobicContact CD1-CE2 4.17Å; Y913-F964 AromaticContact CD1-CZ 3.65Å; Y913-F964 HydrophobicContact CD1-CZ 3.65Å; Y913-F964 AromaticContact CE1-CD1 3.78Å; Y913-F964 HydrophobicContact CE1-CD1 3.78Å; Y913-F964 AromaticContact CE1-CD2 3.64Å; Y913-F964 HydrophobicContact CE1-CD2 3.64Å; Y913-F964 AromaticContact CE1-CE1 3.58Å; Y913-F964 HydrophobicContact CE1-CE1 3.58Å; Y913-F964 AromaticContact CE1-CE2 3.42Å; Y913-F964 HydrophobicContact CE1-CE2 3.42Å; Y913-F964 VanDerWaalsContact CE1-CE2 3.42Å; Y913-F964 AromaticContact CE1-CG 3.82Å; Y913-F964 HydrophobicContact CE1-CG 3.82Å; Y913-F964 AromaticContact CE1-CZ 3.39Å; Y913-F964 HydrophobicContact CE1-CZ 3.39Å; Y913-F964 HydrophobicContact CE2-CE2 4.31Å; Y913-F964 HydrophobicContact CE2-CZ 4.34Å; Y913-F964 HydrophobicContact CG-CE1 4.41Å; Y913-F964 HydrophobicContact CG-CZ 4.25Å; Y913-F964 AromaticContact CZ-CD2 3.94Å; Y913-F964 AromaticContact CZ-CE2 3.5Å; Y913-F964 VanDerWaalsContact CZ-CE2 3.5Å; Y913-F964 AromaticContact CZ-CZ 3.77Å
914	N	68.6	Low	80.7	Confident	122 Å²	122	62.6 Å²	62.6	65%	0.652	33%	0.332	S	S	*	.			trans	-74.4	90.2	167.3	-67.9	-38.4	0	0	0	109.5	N912	N912-N914 VanDerWaalsContact C-N 3.35Å; N912-N914 PolarHBondContact O-N 2.8Å; N912-N914 VanDerWaalsContact O-N 3.08Å
915	V	79.8	Confident	80.5	Confident	10 Å²	10	62.8 Å²	62.8	6%	0.061	33%	0.333	C	S	.	.			trans	-104.4	123.7	169.3	177.2	0	0	0	0	108.9	Y913 F917 V941 E961	Y913-V915 PolarHBondContact O-N 3.19Å; V915-F917 HydrophobicContact CB-CD2 4.47Å; V915-F917 HydrophobicContact CB-CE2 3.65Å; V915-F917 HydrophobicContact CB-CZ 3.79Å; V915-F917 HydrophobicContact CG1-CD1 4.41Å; V915-F917 HydrophobicContact CG1-CD2 4.21Å; V915-F917 HydrophobicContact CG1-CE1 3.89Å; V915-F917 HydrophobicContact CG1-CE2 3.62Å; V915-F917 HydrophobicContact CG1-CZ 3.46Å; V915-F917 VanDerWaalsContact CG1-CZ 3.46Å; V915-F917 VanDerWaalsContact O-CD2 3.26Å; V915-F917 WeakPolarHBondContact O-CD2 3.36Å; V915-F917 VanDerWaalsContact O-CE2 3.27Å; V915-F917 WeakPolarHBondContact O-CE2 3.33Å; V915-V941 HydrophobicContact CG1-CG1 3.77Å; V915-E961 WeakPolarHBondContact CA-OE2 2.95Å
916	A	82.6	Confident	80.5	Confident	20 Å²	20	62.2 Å²	62.2	17%	0.165	33%	0.331	C	S	.	.			trans	-84.8	113.5	172.9	0	0	0	0	0	110.9	M505 S959 E961	M505-A916 WeakPolarHBondContact O-CA 3.36Å; A916-S959 VanDerWaalsContact O-CB 3.27Å; A916-S959 WeakPolarHBondContact O-CB 3.49Å; A916-S959 PolarHBondContact O-OG 3.44Å; A916-E961 WeakPolarHBondContact CB-OE1 3.2Å; A916-E961 PolarHBondContact N-OE1 3.29Å
917	F	86.4	Confident	80.5	Confident	8 Å²	8	61.2 Å²	61.2	4%	0.035	32%	0.323	C	S	.	.			trans	-85.4	129.1	178.7	-64.5	-87.2	0	0	0	110.7	F507 V915 A943 L957 L958	F507-F917 HydrophobicContact CB-CE2 4.07Å; F507-F917 HydrophobicContact CD2-CD2 4.29Å; F507-F917 AromaticContact CD2-CE2 3.49Å; F507-F917 HydrophobicContact CD2-CE2 3.49Å; F507-F917 VanDerWaalsContact CD2-CE2 3.49Å; F507-F917 AromaticContact CD2-CZ 3.98Å; F507-F917 HydrophobicContact CD2-CZ 3.98Å; F507-F917 HydrophobicContact CE2-CE2 4.41Å; F507-F917 HydrophobicContact CG-CE2 4.23Å; V915-F917 HydrophobicContact CB-CD2 4.47Å; V915-F917 HydrophobicContact CB-CE2 3.65Å; V915-F917 HydrophobicContact CB-CZ 3.79Å; V915-F917 HydrophobicContact CG1-CD1 4.41Å; V915-F917 HydrophobicContact CG1-CD2 4.21Å; V915-F917 HydrophobicContact CG1-CE1 3.89Å; V915-F917 HydrophobicContact CG1-CE2 3.62Å; V915-F917 HydrophobicContact CG1-CZ 3.46Å; V915-F917 VanDerWaalsContact CG1-CZ 3.46Å; V915-F917 VanDerWaalsContact O-CD2 3.26Å; V915-F917 WeakPolarHBondContact O-CD2 3.36Å; V915-F917 VanDerWaalsContact O-CE2 3.27Å; V915-F917 WeakPolarHBondContact O-CE2 3.33Å; F917-A943 HydrophobicContact CE1-CB 3.74Å; F917-A943 HydrophobicContact CZ-CB 3.76Å; F917-L957 HydrophobicContact CB-CB 4.14Å; F917-L957 HydrophobicContact CD1-CB 3.43Å; F917-L957 VanDerWaalsContact CD1-CB 3.43Å; F917-L957 HydrophobicContact CE1-CB 4.01Å; F917-L957 HydrophobicContact CG-CB 3.81Å; F917-L958 CarbonylContact C-O 3.5Å; F917-L958 WeakPolarHBondContact CA-O 3.33Å
918	T	83.1	Confident	80.7	Confident	83 Å²	83	61.9 Å²	61.9	51%	0.509	33%	0.328	S	S	.	.			trans	-98.1	-22	-170.9	58.7	0	0	0	0	113.3	L958	T918-L958 PolarHBondContact N-O 3.42Å; T918-L958 PolarHBondContact OG1-O 2.8Å
919	S	86.2	Confident	81.1	Confident	38 Å²	38	56.8 Å²	56.8	27%	0.266	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	153.3	174.4	55	0	0	0	0	112.9	H921 L958	S919-H921 WeakPolarHBondContact CB-NE2 2.98Å; S919-H921 PolarHBondContact OG-NE2 2.93Å; S919-L958 PolarHBondContact O-N 2.92Å
920	D	88.8	Confident	81.8	Confident	113 Å²	113	54.6 Å²	54.6	60%	0.604	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.2	135.5	172.4	65.7	-65.7	0	0	0	111.2	V955 L957	D920-V955 HydrophobicContact CB-CG1 4.22Å; D920-L957 HydrophobicContact CB-CD2 3.88Å
921	H	90.3	Very high	83	Confident	73 Å²	73	55.7 Å²	55.7	34%	0.338	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	157.9	-178.4	-63.3	-111.3	0	0	0	110.3	S919 Q932 E936 C956 L958	S919-H921 WeakPolarHBondContact CB-NE2 2.98Å; S919-H921 PolarHBondContact OG-NE2 2.93Å; H921-Q932 VanDerWaalsContact CB-OE1 3.23Å; H921-E936 IonicContact CE1-OE1 2.89Å; H921-E936 IonicContact CE1-OE2 3.97Å; H921-E936 PolarHBondContact CE1-OE2 2.88Å; H921-E936 IonicContact NE2-OE2 2.72Å; H921-E936 PolarHBondContact NE2-OE2 2.87Å; H921-E936 VanDerWaalsContact NE2-OE2 3.16Å; H921-C956 HydrophobicContact CB-CB 4.45Å; H921-C956 PolarHBondContact N-O 2.7Å; H921-C956 PolarHBondContact O-N 3.07Å; H921-L958 WeakPolarHBondContact NE2-CD1 3.41Å
922	R	89.4	Confident	84.9	Confident	185 Å²	185	52 Å²	52	70%	0.698	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	132.1	172.9	-72.1	-174	176.3	-132.2	-2.7	110.1	Q932 A953	R922-Q932 PolarHBondContact O-NE2 2.88Å; R922-A953 HydrophobicContact CB-CB 4.21Å
923	S	88.5	Confident	86.9	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.007	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	141.5	-178.1	-176.8	0	0	0	0	113.1	S925 D928 C929 A953 G954	S923-S925 PolarHBondContact OG-O 3.16Å; S923-D928 WeakPolarHBondContact CA-OD2 3.34Å; S923-D928 WeakPolarHBondContact CB-OD2 3.39Å; S923-D928 VanDerWaalsContact OG-C 3.31Å; S923-D928 WeakPolarHBondContact OG-CB 3.44Å; S923-D928 VanDerWaalsContact OG-CG 3.24Å; S923-D928 PolarHBondContact OG-OD2 2.65Å; S923-C929 WeakPolarHBondContact OG-CA 3.32Å; S923-C929 PolarHBondContact OG-N 2.59Å; S923-A953 CarbonylContact O-C 3.56Å; S923-A953 VanDerWaalsContact O-CA 3.26Å; S923-A953 WeakPolarHBondContact O-CA 3.19Å; S923-A953 WeakPolarHBondContact O-CB 3.02Å; S923-G954 PolarHBondContact N-O 3Å; S923-G954 PolarHBondContact O-N 2.69Å
924	S	84.7	Confident	88	Confident	66 Å²	66	44 Å²	44	46%	0.462	23%	0.227	S	C	.	.	S	Bend	trans	-78.7	-26.6	-175.6	52.6	0	0	0	0	114.2	D928	S924-D928 PolarHBondContact N-OD2 3.11Å
925	S	87.5	Confident	89.1	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.021	21%	0.21	C	C	.	.	S	Bend	trans	-156.4	175	-178.5	76.6	0	0	0	0	110.7	S923 A927 D928 C929 E974	S923-S925 PolarHBondContact OG-O 3.16Å; S925-A927 PolarHBondContact OG-N 3.02Å; S925-D928 PolarHBondContact O-N 2.82Å; S925-D928 PolarHBondContact OG-N 3.38Å; S925-C929 PolarHBondContact O-N 3.19Å; S925-E974 WeakPolarHBondContact CB-OE2 3.1Å; S925-E974 PolarHBondContact OG-OE2 3.4Å
926	A	90.8	Very high	89.5	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-72.1	-31.5	177	0	0	0	0	0	112.6	F904 C929 A930 F944 E974 H975 F981 I983	F904-A926 HydrophobicContact CE2-CB 4.26Å; F904-A926 HydrophobicContact CZ-CB 3.81Å; A926-C929 PolarHBondContact O-N 3.15Å; A926-A930 WeakPolarHBondContact O-CB 3.3Å; A926-A930 PolarHBondContact O-N 3.49Å; A926-F944 HydrophobicContact CB-CB 4.44Å; A926-F944 HydrophobicContact CB-CD1 3.95Å; A926-F944 HydrophobicContact CB-CE1 4.43Å; A926-F944 HydrophobicContact CB-CG 4.26Å; A926-E974 WeakPolarHBondContact CB-OE1 3.07Å; A926-E974 PolarHBondContact N-OE1 2.84Å; A926-H975 HydrophobicContact CB-CB 4.21Å; A926-H975 WeakPolarHBondContact CB-O 3.26Å; A926-F981 HydrophobicContact CB-CE2 3.87Å; A926-F981 HydrophobicContact CB-CZ 3.61Å; A926-I983 HydrophobicContact CB-CD1 3.98Å
927	A	89.2	Confident	89.4	Confident	8 Å²	8	43.6 Å²	43.6	7%	0.066	22%	0.224	C	C	.	.	H	α-helix	trans	-63.7	-40.6	171.1	0	0	0	0	0	111.8	I902 F904 S925 K931 V973 E974	I902-A927 HydrophobicContact CG2-CB 4.19Å; F904-A927 HydrophobicContact CE1-CB 4.29Å; S925-A927 PolarHBondContact OG-N 3.02Å; A927-K931 WeakPolarHBondContact O-CB 3.38Å; A927-K931 PolarHBondContact O-N 2.91Å; A927-V973 VanDerWaalsContact CB-O 3.32Å; A927-V973 WeakPolarHBondContact CB-O 3.47Å; A927-E974 WeakPolarHBondContact CB-OE2 3.32Å; A927-E974 PolarHBondContact N-OE1 2.04Å
928	D	91	Very high	89.4	Confident	44 Å²	44	46.1 Å²	46.1	24%	0.235	24%	0.238	C	C	.	.	H	α-helix	trans	-64.3	-41.4	172.4	177.7	53.7	0	0	0	111.2	S923 S924 S925 A930 K931 Q932	S923-D928 WeakPolarHBondContact CA-OD2 3.34Å; S923-D928 WeakPolarHBondContact CB-OD2 3.39Å; S923-D928 VanDerWaalsContact OG-C 3.31Å; S923-D928 WeakPolarHBondContact OG-CB 3.44Å; S923-D928 VanDerWaalsContact OG-CG 3.24Å; S923-D928 PolarHBondContact OG-OD2 2.65Å; S924-D928 PolarHBondContact N-OD2 3.11Å; S925-D928 PolarHBondContact O-N 2.82Å; S925-D928 PolarHBondContact OG-N 3.38Å; D928-A930 PolarHBondContact O-N 2.68Å; D928-K931 CarbonylContact O-C 3.43Å; D928-K931 WeakPolarHBondContact O-CA 3.32Å; D928-K931 WeakPolarHBondContact O-CB 3.37Å; D928-K931 PolarHBondContact O-N 3.09Å; D928-Q932 WeakPolarHBondContact O-CG 3.37Å; D928-Q932 PolarHBondContact O-N 2.61Å; D928-Q932 PolarHBondContact OD2-NE2 3.34Å
929	C	94.3	Very high	89.9	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.1	-42.8	176.8	177.6	0	0	0	0	112.6	S923 S925 A926 K931 Q932 C933 F944 C956 I983	S923-C929 WeakPolarHBondContact OG-CA 3.32Å; S923-C929 PolarHBondContact OG-N 2.59Å; S925-C929 PolarHBondContact O-N 3.19Å; A926-C929 PolarHBondContact O-N 3.15Å; C929-K931 PolarHBondContact O-N 2.97Å; C929-Q932 PolarHBondContact O-N 3.07Å; C929-C933 PolarHBondContact O-N 3.25Å; C929-C933 VanDerWaalsContact O-N 3.08Å; C929-F944 HydrophobicContact CB-CB 4.39Å; C929-F944 HydrophobicContact CB-CD2 3.83Å; C929-F944 HydrophobicContact CB-CG 4.41Å; C929-C956 WeakPolarHBondContact CA-SG 3.16Å; C929-C956 HydrophobicContact CB-CB 3.65Å; C929-C956 WeakPolarHBondContact CB-SG 3.43Å; C929-C956 PolarHBondContact O-SG 3.05Å; C929-C956 VanDerWaalsContact O-SG 3.42Å; C929-C956 VanDerWaalsContact SG-CA 3.54Å; C929-C956 WeakPolarHBondContact SG-CB 3.43Å; C929-C956 CovalentContact SG-SG 2.03Å; C929-C956 PolarHBondContact SG-SG 3.41Å; C929-I983 HydrophobicContact CB-CD1 4.17Å
930	A	94	Very high	90	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.4	-36.9	171.5	0	0	0	0	0	111.4	I902 F904 A926 D928 Y934 I983 I986	I902-A930 HydrophobicContact CD1-CB 4.16Å; I902-A930 WeakPolarHBondContact CD1-O 3.43Å; I902-A930 HydrophobicContact CG2-CB 4.28Å; F904-A930 HydrophobicContact CB-CB 4.33Å; F904-A930 HydrophobicContact CD1-CB 3.73Å; F904-A930 HydrophobicContact CE1-CB 4.27Å; F904-A930 HydrophobicContact CG-CB 4.12Å; A926-A930 WeakPolarHBondContact O-CB 3.3Å; A926-A930 PolarHBondContact O-N 3.49Å; D928-A930 PolarHBondContact O-N 2.68Å; A930-Y934 WeakPolarHBondContact O-CB 3.46Å; A930-Y934 PolarHBondContact O-N 3.14Å; A930-I983 HydrophobicContact CB-CG2 3.84Å; A930-I986 HydrophobicContact CB-CG2 4.17Å
931	K	92.8	Very high	90.3	Very high	78 Å²	78	36.4 Å²	36.4	34%	0.339	18%	0.18	S	C	.	.	H	α-helix	trans	-73.6	-36.6	-179.6	-171.7	174.9	-174.7	171.7	0	112.3	C898 I902 A927 D928 C929 Y934 N935	C898-K931 VanDerWaalsContact O-CE 3.23Å; C898-K931 WeakPolarHBondContact O-CE 3.26Å; I902-K931 HydrophobicContact CD1-CB 4.06Å; A927-K931 WeakPolarHBondContact O-CB 3.38Å; A927-K931 PolarHBondContact O-N 2.91Å; D928-K931 CarbonylContact O-C 3.43Å; D928-K931 WeakPolarHBondContact O-CA 3.32Å; D928-K931 WeakPolarHBondContact O-CB 3.37Å; D928-K931 PolarHBondContact O-N 3.09Å; C929-K931 PolarHBondContact O-N 2.97Å; K931-Y934 PolarHBondContact O-N 2.96Å; K931-N935 WeakPolarHBondContact O-CB 3.34Å; K931-N935 PolarHBondContact O-N 3.25Å; K931-N935 VanDerWaalsContact O-N 3.07Å; K931-N935 PolarHBondContact O-ND2 3.39Å
932	Q	93	Very high	90.5	Very high	38 Å²	38	32.9 Å²	32.9	18%	0.178	16%	0.164	C	C	.	.	H	α-helix	trans	-59	-53.8	169.5	-68.6	177.4	22.5	0	0	109.5	H921 R922 D928 C929 Y934 N935 E936	H921-Q932 VanDerWaalsContact CB-OE1 3.23Å; R922-Q932 PolarHBondContact O-NE2 2.88Å; D928-Q932 WeakPolarHBondContact O-CG 3.37Å; D928-Q932 PolarHBondContact O-N 2.61Å; D928-Q932 PolarHBondContact OD2-NE2 3.34Å; C929-Q932 PolarHBondContact O-N 3.07Å; Q932-Y934 PolarHBondContact O-N 3.08Å; Q932-N935 PolarHBondContact O-N 3.01Å; Q932-E936 WeakPolarHBondContact O-CB 3.39Å; Q932-E936 PolarHBondContact O-N 3.25Å
933	C	94.8	Very high	90.7	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.007	13%	0.131	C	C	.	.	H	α-helix	trans	-54.9	-47.2	175	-173.1	0	0	0	0	113.3	C929 N935 E936 C939 L958 I986	C929-C933 PolarHBondContact O-N 3.25Å; C929-C933 VanDerWaalsContact O-N 3.08Å; C933-N935 VanDerWaalsContact C-N 3.31Å; C933-N935 PolarHBondContact O-N 2.96Å; C933-E936 CarbonylContact O-C 3.57Å; C933-E936 PolarHBondContact O-N 3.44Å; C933-C939 VanDerWaalsContact CA-SG 3.57Å; C933-C939 HydrophobicContact CB-CB 4.03Å; C933-C939 WeakPolarHBondContact CB-SG 3.39Å; C933-C939 WeakPolarHBondContact O-CB 3.24Å; C933-C939 VanDerWaalsContact SG-C 3.54Å; C933-C939 WeakPolarHBondContact SG-CB 3.03Å; C933-C939 CovalentContact SG-SG 2.04Å; C933-C939 PolarHBondContact SG-SG 3.32Å; C933-L958 HydrophobicContact CB-CD2 3.76Å; C933-I986 HydrophobicContact CB-CD1 3.77Å; C933-I986 VanDerWaalsContact SG-CD1 3.52Å
934	Y	92.7	Very high	90.9	Very high	34 Å²	34	24.1 Å²	24.1	13%	0.133	13%	0.131	C	C	.	.	H	α-helix	trans	-66.7	-29.9	-178.7	-174.2	-87.6	0	0	0	114	R896 C898 I902 A930 K931 Q932 I986 C988	R896-Y934 HydrophobicContact CB-CD1 4.17Å; R896-Y934 HydrophobicContact CB-CE1 3.56Å; R896-Y934 WeakPolarHBondContact CD-OH 3.31Å; R896-Y934 HydrophobicContact CG-CE1 4.41Å; R896-Y934 PolarHBondContact NH1-OH 2.92Å; R896-Y934 VanDerWaalsContact NH1-OH 3.1Å; C898-Y934 HydrophobicContact CB-CD1 3.68Å; C898-Y934 HydrophobicContact CB-CE1 3.87Å; I902-Y934 HydrophobicContact CD1-CG 4.2Å; A930-Y934 WeakPolarHBondContact O-CB 3.46Å; A930-Y934 PolarHBondContact O-N 3.14Å; K931-Y934 PolarHBondContact O-N 2.96Å; Q932-Y934 PolarHBondContact O-N 3.08Å; Y934-I986 HydrophobicContact CD2-CG2 4.11Å; Y934-I986 HydrophobicContact CG-CG2 4.44Å; Y934-C988 HydrophobicContact CD1-CB 4.16Å; Y934-C988 HydrophobicContact CE1-CB 3.5Å; Y934-C988 HydrophobicContact CE2-CB 3.92Å; Y934-C988 WeakPolarHBondContact OH-CB 3.36Å
935	N	91.3	Very high	91.1	Very high	53 Å²	53	21.6 Å²	21.6	28%	0.283	11%	0.112	S	C	.	.	H	α-helix	trans	-79.3	-33.9	176.6	-62.7	-26.7	0	0	0	111.5	R896 N897 C898 K931 Q932 C933 G937	R896-N935 WeakPolarHBondContact O-CA 3.39Å; R896-N935 PolarHBondContact O-OD1 2.99Å; N897-N935 WeakPolarHBondContact CA-OD1 3.22Å; C898-N935 PolarHBondContact N-OD1 2.8Å; K931-N935 WeakPolarHBondContact O-CB 3.34Å; K931-N935 PolarHBondContact O-N 3.25Å; K931-N935 VanDerWaalsContact O-N 3.07Å; K931-N935 PolarHBondContact O-ND2 3.39Å; Q932-N935 PolarHBondContact O-N 3.01Å; C933-N935 VanDerWaalsContact C-N 3.31Å; C933-N935 PolarHBondContact O-N 2.96Å; N935-G937 VanDerWaalsContact C-N 3.35Å; N935-G937 PolarHBondContact O-N 2.96Å
936	E	88.9	Confident	90.9	Very high	69 Å²	69	22.4 Å²	22.4	32%	0.322	12%	0.119	S	C	.	.	S	Bend	trans	-71.6	82.4	171.6	-164.2	105	-125.8	0	0	109.1	H921 Q932 C933 N938 C939 L958	H921-E936 IonicContact CE1-OE1 2.89Å; H921-E936 IonicContact CE1-OE2 3.97Å; H921-E936 PolarHBondContact CE1-OE2 2.88Å; H921-E936 IonicContact NE2-OE2 2.72Å; H921-E936 PolarHBondContact NE2-OE2 2.87Å; H921-E936 VanDerWaalsContact NE2-OE2 3.16Å; Q932-E936 WeakPolarHBondContact O-CB 3.39Å; Q932-E936 PolarHBondContact O-N 3.25Å; C933-E936 CarbonylContact O-C 3.57Å; C933-E936 PolarHBondContact O-N 3.44Å; E936-N938 WeakPolarHBondContact CG-OD1 3.32Å; E936-N938 PolarHBondContact O-N 3.12Å; E936-N938 PolarHBondContact O-OD1 3.32Å; E936-C939 HydrophobicContact CB-CB 4.21Å; E936-C939 HydrophobicContact CG-CB 4.42Å; E936-C939 WeakPolarHBondContact O-CB 3.04Å; E936-C939 PolarHBondContact O-N 3.35Å; E936-L958 HydrophobicContact CB-CD1 4.14Å; E936-L958 HydrophobicContact CG-CD1 4.03Å; E936-L958 WeakPolarHBondContact OE2-CD1 3.42Å
937	G	79.4	Confident	90.3	Very high	20 Å²	20	23.8 Å²	23.8	21%	0.206	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	9.5	-160.9	0	0	0	0	0	119.7	S893 G894 N935	S893-G937 WeakPolarHBondContact CA-O 3.38Å; G894-G937 PolarHBondContact N-O 3.44Å; G894-G937 VanDerWaalsContact O-CA 3.28Å; G894-G937 WeakPolarHBondContact O-CA 3.48Å; N935-G937 VanDerWaalsContact C-N 3.35Å; N935-G937 PolarHBondContact O-N 2.96Å
938	N	87.1	Confident	89.3	Confident	61 Å²	61	27.4 Å²	27.4	33%	0.326	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-24.3	170.4	50.6	-31.3	0	0	0	112.5	E936 E960	E936-N938 WeakPolarHBondContact CG-OD1 3.32Å; E936-N938 PolarHBondContact O-N 3.12Å; E936-N938 PolarHBondContact O-OD1 3.32Å; N938-E960 HydrophobicContact CB-CG 3.97Å; N938-E960 PolarHBondContact ND2-OE1 3.41Å; N938-E960 WeakPolarHBondContact O-CA 3.04Å
939	C	92.2	Very high	87.6	Confident	10 Å²	10	31.9 Å²	31.9	7%	0.068	17%	0.168	C	C	.	.			trans	-72.7	136.6	-180	-177.1	0	0	0	0	112	C933 E936 V941 S959	C933-C939 VanDerWaalsContact CA-SG 3.57Å; C933-C939 HydrophobicContact CB-CB 4.03Å; C933-C939 WeakPolarHBondContact CB-SG 3.39Å; C933-C939 WeakPolarHBondContact O-CB 3.24Å; C933-C939 VanDerWaalsContact SG-C 3.54Å; C933-C939 WeakPolarHBondContact SG-CB 3.03Å; C933-C939 CovalentContact SG-SG 2.04Å; C933-C939 PolarHBondContact SG-SG 3.32Å; E936-C939 HydrophobicContact CB-CB 4.21Å; E936-C939 HydrophobicContact CG-CB 4.42Å; E936-C939 WeakPolarHBondContact O-CB 3.04Å; E936-C939 PolarHBondContact O-N 3.35Å; C939-V941 PolarHBondContact SG-O 2.57Å; C939-V941 VanDerWaalsContact SG-O 3.41Å; C939-S959 VanDerWaalsContact CA-O 3.32Å; C939-S959 WeakPolarHBondContact CA-O 3.33Å; C939-S959 PolarHBondContact SG-O 3.39Å
940	Q	90.4	Very high	85.6	Confident	19 Å²	19	33 Å²	33	9%	0.089	18%	0.18	C	C	.	.			trans	-129.4	-20.9	-179.3	-41.2	-175.4	61	0	0	112.8	M890 V891 S959 E960 E961 S984	M890-Q940 VanDerWaalsContact CA-OE1 3.22Å; V891-Q940 HydrophobicContact CB-CB 4.45Å; V891-Q940 HydrophobicContact CB-CG 4.42Å; V891-Q940 HydrophobicContact CG2-CB 4.14Å; V891-Q940 VanDerWaalsContact N-OE1 3.08Å; Q940-S959 PolarHBondContact N-O 2.95Å; Q940-E960 PolarHBondContact NE2-O 2.69Å; Q940-E961 WeakPolarHBondContact CB-O 3.43Å; Q940-S984 PolarHBondContact O-OG 2.93Å
941	V	93.4	Very high	84	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.006	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	137.9	175.6	64.8	0	0	0	0	108.2	V915 C939 S959 E961 V982 I983	V915-V941 HydrophobicContact CG1-CG1 3.77Å; C939-V941 PolarHBondContact SG-O 2.57Å; C939-V941 VanDerWaalsContact SG-O 3.41Å; V941-S959 PolarHBondContact N-O 3.33Å; V941-S959 PolarHBondContact O-N 2.93Å; V941-S959 VanDerWaalsContact O-O 3.11Å; V941-E961 HydrophobicContact CG1-CB 4.42Å; V941-V982 HydrophobicContact CG2-CG1 3.38Å; V941-I983 WeakPolarHBondContact CA-O 3.43Å; V941-I983 WeakPolarHBondContact CG2-O 3.45Å
942	S	94.7	Very high	82.6	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	175.6	172.5	57.9	0	0	0	0	110.3	L957 V982 I983	S942-L957 CarbonylContact C-O 3.55Å; S942-L957 WeakPolarHBondContact CA-O 3.44Å; S942-L957 WeakPolarHBondContact CB-O 3.25Å; S942-V982 CarbonylContact O-C 3.47Å; S942-V982 WeakPolarHBondContact O-CA 3.46Å; S942-V982 WeakPolarHBondContact O-CG1 3.03Å; S942-I983 PolarHBondContact N-O 3.4Å; S942-I983 PolarHBondContact O-N 3.15Å; S942-I983 WeakPolarHBondContact OG-CB 3.17Å
943	A	93.4	Very high	81.9	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.008	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	144	168.1	0	0	0	0	0	109.7	F507 F917 C956 L957 F981 V982	F507-A943 HydrophobicContact CE2-CB 3.88Å; F917-A943 HydrophobicContact CE1-CB 3.74Å; F917-A943 HydrophobicContact CZ-CB 3.76Å; A943-C956 WeakPolarHBondContact O-CA 3.36Å; A943-L957 HydrophobicContact CB-CB 4.33Å; A943-L957 PolarHBondContact N-O 3.32Å; A943-L957 PolarHBondContact O-N 3.31Å; A943-F981 CarbonylContact C-O 3.55Å; A943-F981 WeakPolarHBondContact CA-O 3.48Å; A943-F981 WeakPolarHBondContact CB-O 3.47Å; A943-V982 HydrophobicContact CB-CG2 4.48Å
944	F	93	Very high	81.4	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	126.9	179.4	-175	-115.8	0	0	0	110.4	A926 C929 A946 P980 F981 I983	A926-F944 HydrophobicContact CB-CB 4.44Å; A926-F944 HydrophobicContact CB-CD1 3.95Å; A926-F944 HydrophobicContact CB-CE1 4.43Å; A926-F944 HydrophobicContact CB-CG 4.26Å; C929-F944 HydrophobicContact CB-CB 4.39Å; C929-F944 HydrophobicContact CB-CD2 3.83Å; C929-F944 HydrophobicContact CB-CG 4.41Å; F944-A946 HydrophobicContact CD1-CB 4.46Å; F944-A946 HydrophobicContact CE1-CB 3.98Å; F944-P980 WeakPolarHBondContact O-CA 3.31Å; F944-F981 HydrophobicContact CB-CE1 4.43Å; F944-F981 HydrophobicContact CB-CE2 4.14Å; F944-F981 HydrophobicContact CB-CZ 4.02Å; F944-F981 AromaticContact CD1-CE1 3.99Å; F944-F981 HydrophobicContact CD1-CE1 3.99Å; F944-F981 AromaticContact CD1-CZ 3.79Å; F944-F981 HydrophobicContact CD1-CZ 3.79Å; F944-F981 HydrophobicContact CG-CZ 4.39Å; F944-F981 PolarHBondContact N-O 3.21Å; F944-F981 PolarHBondContact O-N 3.27Å; F944-I983 HydrophobicContact CB-CD1 3.81Å
945	I	89.4	Confident	81.3	Confident	14 Å²	14	37.6 Å²	37.6	7%	0.072	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	105.9	168.7	-56	175.4	0	0	0	105.9	I511 L515 G954 V955 L957 P980	I511-I945 HydrophobicContact CG1-CD1 4.13Å; L515-I945 HydrophobicContact CD2-CG2 4.47Å; I945-G954 CarbonylContact O-C 3.58Å; I945-G954 WeakPolarHBondContact O-CA 3.46Å; I945-V955 HydrophobicContact CB-CB 4.28Å; I945-V955 PolarHBondContact N-O 2.88Å; I945-V955 PolarHBondContact O-N 3.07Å; I945-L957 HydrophobicContact CD1-CD1 4.07Å; I945-P980 HydrophobicContact CG1-CB 4.09Å; I945-P980 HydrophobicContact CG1-CG 4.15Å; I945-P980 HydrophobicContact CG2-CG 4.43Å
946	A	83.6	Confident	81.4	Confident	20 Å²	20	35 Å²	35	17%	0.165	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-57.9	145.6	-179.7	0	0	0	0	0	111.4	F944 S977	F944-A946 HydrophobicContact CD1-CB 4.46Å; F944-A946 HydrophobicContact CE1-CB 3.98Å; A946-S977 WeakPolarHBondContact CB-O 3.12Å
947	P	76.7	Confident	81.7	Confident	28 Å²	28	31.9 Å²	31.9	18%	0.182	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-61.4	129.4	-178.7	21.1	-29.7	0	0	0	111.2	K949 L951	P947-K949 PolarHBondContact O-N 3.45Å; P947-L951 HydrophobicContact CB-CB 3.85Å; P947-L951 WeakPolarHBondContact CB-O 3.28Å
948	P	68.8	Low	82.4	Confident	84 Å²	84	31 Å²	31	55%	0.545	19%	0.186	S	C	.	.	P	Polyproline II helix	trans	-57.8	138.8	162.2	26	-33.8	0	0	0	109	G950 L951	P948-G950 PolarHBondContact O-N 2.74Å; P948-G950 VanDerWaalsContact O-N 3.09Å; P948-L951 HydrophobicContact CG-CD1 3.87Å; P948-L951 HydrophobicContact CG-CG 4.27Å; P948-L951 PolarHBondContact O-N 3.41Å
949	K	55.5	Low	82.7	Confident	139 Å²	139	28.1 Å²	28.1	60%	0.604	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	118.5	-172	-64.6	170.2	-166.1	165.6	0	110.6	E42 P947	E42-K949 WeakPolarHBondContact OE1-CE 3.21Å; E42-K949 IonicContact OE1-NZ 2.74Å; E42-K949 PolarHBondContact OE1-NZ 2.81Å; E42-K949 VanDerWaalsContact OE2-CE 3.31Å; E42-K949 WeakPolarHBondContact OE2-CE 3.46Å; E42-K949 IonicContact OE2-NZ 2.78Å; E42-K949 PolarHBondContact OE2-NZ 3.11Å; P947-K949 PolarHBondContact O-N 3.45Å
950	G	53	Low	82.6	Confident	23 Å²	23	32.3 Å²	32.3	24%	0.237	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	122.7	-21.3	-168.1	0	0	0	0	0	113.4	V752 P948	V752-G950 WeakPolarHBondContact CB-O 3.33Å; V752-G950 WeakPolarHBondContact CG1-O 3.48Å; V752-G950 CarbonylContact O-C 3.54Å; V752-G950 WeakPolarHBondContact O-CA 3.4Å; P948-G950 PolarHBondContact O-N 2.74Å; P948-G950 VanDerWaalsContact O-N 3.09Å
951	L	59.4	Low	82.5	Confident	87 Å²	87	34.6 Å²	34.6	46%	0.455	20%	0.2	S	C	.	.			trans	-98.7	140	173.7	-58.8	-173.5	0	0	0	111.7	P947 P948 A953	P947-L951 HydrophobicContact CB-CB 3.85Å; P947-L951 WeakPolarHBondContact CB-O 3.28Å; P948-L951 HydrophobicContact CG-CD1 3.87Å; P948-L951 HydrophobicContact CG-CG 4.27Å; P948-L951 PolarHBondContact O-N 3.41Å; L951-A953 VanDerWaalsContact C-N 3.34Å
952	S	64.8	Low	82.1	Confident	109 Å²	109	37 Å²	37	76%	0.762	22%	0.216	S	C	*	.	S	Bend	trans	-84.9	-5.6	179.4	52.7	0	0	0	0	114.2
953	A	77.6	Confident	81.5	Confident	21 Å²	21	37.1 Å²	37.1	17%	0.174	22%	0.216	C	C	.	.	S	Bend	trans	-150	138	177.2	0	0	0	0	0	109.1	R922 S923 L951	R922-A953 HydrophobicContact CB-CB 4.21Å; S923-A953 CarbonylContact O-C 3.56Å; S923-A953 VanDerWaalsContact O-CA 3.26Å; S923-A953 WeakPolarHBondContact O-CA 3.19Å; S923-A953 WeakPolarHBondContact O-CB 3.02Å; L951-A953 VanDerWaalsContact C-N 3.34Å
954	G	84.6	Confident	81.2	Confident	3 Å²	3	37.8 Å²	37.8	3%	0.031	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	-173.1	167.6	0	0	0	0	0	111.9	S923 I945	S923-G954 PolarHBondContact N-O 3Å; S923-G954 PolarHBondContact O-N 2.69Å; I945-G954 CarbonylContact O-C 3.58Å; I945-G954 WeakPolarHBondContact O-CA 3.46Å
955	V	89.8	Confident	81	Confident	27 Å²	27	38.4 Å²	38.4	16%	0.164	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129	174.5	-175.4	0	0	0	0	109	D920 I945 L957	D920-V955 HydrophobicContact CB-CG1 4.22Å; I945-V955 HydrophobicContact CB-CB 4.28Å; I945-V955 PolarHBondContact N-O 2.88Å; I945-V955 PolarHBondContact O-N 3.07Å; V955-L957 HydrophobicContact CG1-CD2 3.75Å; V955-L957 HydrophobicContact CG1-CG 4.27Å
956	C	94.7	Very high	80.8	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	115.4	170.7	-174.6	0	0	0	0	108.7	H921 C929 A943 L958	H921-C956 HydrophobicContact CB-CB 4.45Å; H921-C956 PolarHBondContact N-O 2.7Å; H921-C956 PolarHBondContact O-N 3.07Å; C929-C956 WeakPolarHBondContact CA-SG 3.16Å; C929-C956 HydrophobicContact CB-CB 3.65Å; C929-C956 WeakPolarHBondContact CB-SG 3.43Å; C929-C956 PolarHBondContact O-SG 3.05Å; C929-C956 VanDerWaalsContact O-SG 3.42Å; C929-C956 VanDerWaalsContact SG-CA 3.54Å; C929-C956 WeakPolarHBondContact SG-CB 3.43Å; C929-C956 CovalentContact SG-SG 2.03Å; C929-C956 PolarHBondContact SG-SG 3.41Å; A943-C956 WeakPolarHBondContact O-CA 3.36Å; C956-L958 WeakPolarHBondContact SG-CD2 3.16Å
957	L	94.2	Very high	80.6	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.01	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	124.8	177	-56.9	173.8	0	0	0	108	S510 F917 D920 S942 A943 I945 V955	S510-L957 WeakPolarHBondContact OG-CD1 3.41Å; F917-L957 HydrophobicContact CB-CB 4.14Å; F917-L957 HydrophobicContact CD1-CB 3.43Å; F917-L957 VanDerWaalsContact CD1-CB 3.43Å; F917-L957 HydrophobicContact CE1-CB 4.01Å; F917-L957 HydrophobicContact CG-CB 3.81Å; D920-L957 HydrophobicContact CB-CD2 3.88Å; S942-L957 CarbonylContact C-O 3.55Å; S942-L957 WeakPolarHBondContact CA-O 3.44Å; S942-L957 WeakPolarHBondContact CB-O 3.25Å; A943-L957 HydrophobicContact CB-CB 4.33Å; A943-L957 PolarHBondContact N-O 3.32Å; A943-L957 PolarHBondContact O-N 3.31Å; I945-L957 HydrophobicContact CD1-CD1 4.07Å; V955-L957 HydrophobicContact CG1-CD2 3.75Å; V955-L957 HydrophobicContact CG1-CG 4.27Å
958	L	94.7	Very high	80.2	Confident	1 Å²	1	51 Å²	51	1%	0.005	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	147.4	-178.9	-56.2	-169.5	0	0	0	111.3	F917 T918 S919 H921 C933 E936 C956	F917-L958 CarbonylContact C-O 3.5Å; F917-L958 WeakPolarHBondContact CA-O 3.33Å; T918-L958 PolarHBondContact N-O 3.42Å; T918-L958 PolarHBondContact OG1-O 2.8Å; S919-L958 PolarHBondContact O-N 2.92Å; H921-L958 WeakPolarHBondContact NE2-CD1 3.41Å; C933-L958 HydrophobicContact CB-CD2 3.76Å; E936-L958 HydrophobicContact CB-CD1 4.14Å; E936-L958 HydrophobicContact CG-CD1 4.03Å; E936-L958 WeakPolarHBondContact OE2-CD1 3.42Å; C956-L958 WeakPolarHBondContact SG-CD2 3.16Å
959	S	93.1	Very high	80.6	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.007	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	143.8	173.5	-177.4	0	0	0	0	112.4	A916 C939 Q940 V941 E961	A916-S959 VanDerWaalsContact O-CB 3.27Å; A916-S959 WeakPolarHBondContact O-CB 3.49Å; A916-S959 PolarHBondContact O-OG 3.44Å; C939-S959 VanDerWaalsContact CA-O 3.32Å; C939-S959 WeakPolarHBondContact CA-O 3.33Å; C939-S959 PolarHBondContact SG-O 3.39Å; Q940-S959 PolarHBondContact N-O 2.95Å; V941-S959 PolarHBondContact N-O 3.33Å; V941-S959 PolarHBondContact O-N 2.93Å; V941-S959 VanDerWaalsContact O-O 3.11Å; S959-E961 VanDerWaalsContact C-N 3.31Å; S959-E961 WeakPolarHBondContact OG-CB 3.11Å; S959-E961 PolarHBondContact OG-N 3.44Å
960	E	90.9	Very high	81.4	Confident	98 Å²	98	46.5 Å²	46.5	46%	0.458	26%	0.263	S	S	.	.			trans	-83.7	-7	174.8	-54.9	-172.7	-155.1	0	0	112.8	N938 Q940	N938-E960 HydrophobicContact CB-CG 3.97Å; N938-E960 PolarHBondContact ND2-OE1 3.41Å; N938-E960 WeakPolarHBondContact O-CA 3.04Å; Q940-E960 PolarHBondContact NE2-O 2.69Å
961	E	87.6	Confident	82.8	Confident	68 Å²	68	49.9 Å²	49.9	32%	0.318	27%	0.271	S	S	.	.	S	Bend	trans	-64.1	149.4	-179.3	-75.5	-172.6	-165.2	0	0	113	V915 A916 Q940 V941 S959 G963	V915-E961 WeakPolarHBondContact CA-OE2 2.95Å; A916-E961 WeakPolarHBondContact CB-OE1 3.2Å; A916-E961 PolarHBondContact N-OE1 3.29Å; Q940-E961 WeakPolarHBondContact CB-O 3.43Å; V941-E961 HydrophobicContact CG1-CB 4.42Å; S959-E961 VanDerWaalsContact C-N 3.31Å; S959-E961 WeakPolarHBondContact OG-CB 3.11Å; S959-E961 PolarHBondContact OG-N 3.44Å; E961-G963 PolarHBondContact O-N 2.87Å; E961-G963 VanDerWaalsContact O-N 3.15Å
962	P	85	Confident	84	Confident	52 Å²	52	47 Å²	47	34%	0.338	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-60.2	118.8	-174.6	24.3	-34.7	0	0	0	112.3
963	G	82	Confident	84.8	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.01	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-60.4	140.9	177.2	0	0	0	0	0	112.5	Q888 I889 E961 S984	Q888-G963 WeakPolarHBondContact CA-O 3.43Å; I889-G963 PolarHBondContact N-O 3.4Å; E961-G963 PolarHBondContact O-N 2.87Å; E961-G963 VanDerWaalsContact O-N 3.15Å; G963-S984 WeakPolarHBondContact CA-OG 3.46Å
964	F	87.3	Confident	84.9	Confident	16 Å²	16	41.7 Å²	41.7	7%	0.07	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	132.5	177.7	62.4	-87.2	0	0	0	110.6	V886 F907 Y913 V982 S984 C985	V886-F964 HydrophobicContact CG1-CB 3.92Å; V886-F964 HydrophobicContact CG1-CD2 4.46Å; F907-F964 HydrophobicContact CB-CE2 4.03Å; F907-F964 HydrophobicContact CB-CZ 4.07Å; F907-F964 HydrophobicContact CD1-CD2 4.43Å; F907-F964 AromaticContact CD1-CE2 3.66Å; F907-F964 HydrophobicContact CD1-CE2 3.66Å; F907-F964 HydrophobicContact CD2-CD2 4.32Å; F907-F964 AromaticContact CD2-CE2 3.51Å; F907-F964 HydrophobicContact CD2-CE2 3.51Å; F907-F964 AromaticContact CD2-CZ 3.82Å; F907-F964 HydrophobicContact CD2-CZ 3.82Å; F907-F964 HydrophobicContact CE1-CD2 4.19Å; F907-F964 AromaticContact CE1-CE2 3.86Å; F907-F964 HydrophobicContact CE1-CE2 3.86Å; F907-F964 HydrophobicContact CE2-CD2 4.07Å; F907-F964 AromaticContact CE2-CE2 3.72Å; F907-F964 HydrophobicContact CE2-CE2 3.72Å; F907-F964 HydrophobicContact CE2-CZ 4.33Å; F907-F964 HydrophobicContact CG-CD2 4.48Å; F907-F964 AromaticContact CG-CE2 3.46Å; F907-F964 HydrophobicContact CG-CE2 3.46Å; F907-F964 VanDerWaalsContact CG-CE2 3.46Å; F907-F964 AromaticContact CG-CZ 3.91Å; F907-F964 HydrophobicContact CG-CZ 3.91Å; F907-F964 AromaticContact CZ-CD2 3.99Å; F907-F964 HydrophobicContact CZ-CD2 3.99Å; F907-F964 AromaticContact CZ-CE2 3.87Å; F907-F964 HydrophobicContact CZ-CE2 3.87Å; Y913-F964 HydrophobicContact CD1-CD1 4.04Å; Y913-F964 AromaticContact CD1-CE1 3.57Å; Y913-F964 HydrophobicContact CD1-CE1 3.57Å; Y913-F964 HydrophobicContact CD1-CE2 4.17Å; Y913-F964 AromaticContact CD1-CZ 3.65Å; Y913-F964 HydrophobicContact CD1-CZ 3.65Å; Y913-F964 AromaticContact CE1-CD1 3.78Å; Y913-F964 HydrophobicContact CE1-CD1 3.78Å; Y913-F964 AromaticContact CE1-CD2 3.64Å; Y913-F964 HydrophobicContact CE1-CD2 3.64Å; Y913-F964 AromaticContact CE1-CE1 3.58Å; Y913-F964 HydrophobicContact CE1-CE1 3.58Å; Y913-F964 AromaticContact CE1-CE2 3.42Å; Y913-F964 HydrophobicContact CE1-CE2 3.42Å; Y913-F964 VanDerWaalsContact CE1-CE2 3.42Å; Y913-F964 AromaticContact CE1-CG 3.82Å; Y913-F964 HydrophobicContact CE1-CG 3.82Å; Y913-F964 AromaticContact CE1-CZ 3.39Å; Y913-F964 HydrophobicContact CE1-CZ 3.39Å; Y913-F964 HydrophobicContact CE2-CE2 4.31Å; Y913-F964 HydrophobicContact CE2-CZ 4.34Å; Y913-F964 HydrophobicContact CG-CE1 4.41Å; Y913-F964 HydrophobicContact CG-CZ 4.25Å; Y913-F964 AromaticContact CZ-CD2 3.94Å; Y913-F964 AromaticContact CZ-CE2 3.5Å; Y913-F964 VanDerWaalsContact CZ-CE2 3.5Å; Y913-F964 AromaticContact CZ-CZ 3.77Å; F964-V982 HydrophobicContact CE1-CG1 3.91Å; F964-V982 HydrophobicContact CZ-CB 4.45Å; F964-V982 HydrophobicContact CZ-CG1 3.99Å; F964-S984 PolarHBondContact N-OG 3.36Å; F964-C985 PolarHBondContact O-SG 2.97Å
965	C	88.5	Confident	84.4	Confident	13 Å²	13	42.6 Å²	42.6	9%	0.088	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	126.7	-179	-70.7	0	0	0	0	111.6	V886 A887 I889 C985	V886-C965 WeakPolarHBondContact CA-O 3.22Å; A887-C965 PolarHBondContact N-O 3.22Å; A887-C965 PolarHBondContact O-N 2.74Å; I889-C965 HydrophobicContact CD1-CB 3.67Å; I889-C965 HydrophobicContact CG1-CB 4.14Å; C965-C985 WeakPolarHBondContact CA-SG 3.29Å; C965-C985 HydrophobicContact CB-CB 4.33Å; C965-C985 WeakPolarHBondContact CB-SG 3.26Å; C965-C985 WeakPolarHBondContact SG-CA 3.4Å; C965-C985 WeakPolarHBondContact SG-CB 3.47Å; C965-C985 CovalentContact SG-SG 2.03Å; C965-C985 PolarHBondContact SG-SG 2.81Å
966	K	85.5	Confident	83.5	Confident	92 Å²	92	42.3 Å²	42.3	40%	0.4	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	133.3	168.7	170	171.6	178.8	165.2	0	108.5	S884 Q905 F907 S969	S884-K966 VanDerWaalsContact OG-CE 3.23Å; S884-K966 WeakPolarHBondContact OG-CE 3.49Å; S884-K966 PolarHBondContact OG-NZ 2.95Å; Q905-K966 PolarHBondContact NE2-O 3.31Å; Q905-K966 PolarHBondContact OE1-O 3.28Å; F907-K966 HydrophobicContact CE1-CB 4.12Å; F907-K966 HydrophobicContact CZ-CB 4.47Å; K966-S969 WeakPolarHBondContact CB-OG 3.43Å; K966-S969 WeakPolarHBondContact CG-OG 3.4Å; K966-S969 PolarHBondContact O-OG 3.01Å
967	T	78.6	Confident	82.2	Confident	67 Å²	67	43.2 Å²	43.2	41%	0.411	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	134.9	174.7	48.8	0	0	0	0	109.6	T885 S969	T885-T967 PolarHBondContact O-N 3.14Å; T885-T967 PolarHBondContact O-OG1 3.41Å; T967-S969 VanDerWaalsContact C-N 3.27Å; T967-S969 PolarHBondContact O-N 2.85Å
968	N	69.9	Low	81	Confident	168 Å²	168	50.9 Å²	50.9	90%	0.898	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	13.7	178.8	-46.9	-65	0	0	0	117.1
969	S	75.5	Confident	80.1	Confident	36 Å²	36	52.9 Å²	52.9	25%	0.252	28%	0.279	S	S	.	.			trans	-74.6	145	165	20.9	0	0	0	0	111.8	Q905 K966 T967	Q905-S969 PolarHBondContact NE2-O 3.43Å; Q905-S969 PolarHBondContact NE2-OG 3.45Å; Q905-S969 PolarHBondContact OE1-OG 2.81Å; K966-S969 WeakPolarHBondContact CB-OG 3.43Å; K966-S969 WeakPolarHBondContact CG-OG 3.4Å; K966-S969 PolarHBondContact O-OG 3.01Å; T967-S969 VanDerWaalsContact C-N 3.27Å; T967-S969 PolarHBondContact O-N 2.85Å
970	E	73.7	Confident	79.7	Confident	91 Å²	91	54.3 Å²	54.3	43%	0.425	29%	0.288	S	S	.	.			trans	-54.9	138.3	173.5	-172.2	179.6	167.8	0	0	111.1	L972 N1031	E970-L972 HydrophobicContact CG-CD2 4.23Å; E970-N1031 HydrophobicContact CG-CB 4.21Å; E970-N1031 WeakPolarHBondContact OE1-CB 3.09Å
971	K	81.9	Confident	79.6	Confident	94 Å²	94	49.7 Å²	49.7	41%	0.409	27%	0.266	S	S	.	.			trans	-94.6	115.6	166.5	-67.8	-160.5	177.1	-153.7	0	109	F904 Q905 C985	F904-K971 CarbonylContact O-C 3.58Å; F904-K971 VanDerWaalsContact O-CA 3.32Å; F904-K971 WeakPolarHBondContact O-CA 3.29Å; Q905-K971 HydrophobicContact CG-CG 4.32Å; K971-C985 PolarHBondContact NZ-O 3.42Å; K971-C985 VanDerWaalsContact NZ-O 3.11Å
972	L	83.7	Confident	79.9	Confident	28 Å²	28	46.6 Å²	46.6	15%	0.147	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-75.8	146.9	177	-54.2	179.7	0	0	0	110.1	T903 F904 A906 E970 H975	T903-L972 VanDerWaalsContact CA-O 3.29Å; T903-L972 WeakPolarHBondContact CA-O 3.36Å; F904-L972 HydrophobicContact CE2-CB 4.28Å; F904-L972 HydrophobicContact CZ-CB 4.38Å; F904-L972 PolarHBondContact N-O 2.85Å; F904-L972 PolarHBondContact O-N 2.58Å; A906-L972 HydrophobicContact CB-CD1 3.73Å; E970-L972 HydrophobicContact CG-CD2 4.23Å; L972-H975 HydrophobicContact CD1-CB 3.86Å
973	V	81.9	Confident	80.3	Confident	14 Å²	14	44.1 Å²	44.1	9%	0.085	24%	0.236	C	C	.	.	S	Bend	trans	-88.1	-39.4	169.1	166.8	0	0	0	0	110.7	R901 A927 I1001	R901-V973 VanDerWaalsContact CD-CG1 3.43Å; R901-V973 HydrophobicContact CG-CG1 3.99Å; R901-V973 HydrophobicContact CG-CG2 4.47Å; R901-V973 VanDerWaalsContact NE-CG1 3.3Å; A927-V973 VanDerWaalsContact CB-O 3.32Å; A927-V973 WeakPolarHBondContact CB-O 3.47Å; V973-I1001 HydrophobicContact CB-CD1 4.25Å; V973-I1001 HydrophobicContact CG1-CD1 3.93Å
974	E	79.4	Confident	80.8	Confident	3 Å²	3	44.1 Å²	44.1	1%	0.014	24%	0.236	C	C	.	.			trans	-145.3	151.2	178.3	-175.9	55.2	-87.3	0	0	109.1	S925 A926 A927 V1078 T1080	S925-E974 WeakPolarHBondContact CB-OE2 3.1Å; S925-E974 PolarHBondContact OG-OE2 3.4Å; A926-E974 WeakPolarHBondContact CB-OE1 3.07Å; A926-E974 PolarHBondContact N-OE1 2.84Å; A927-E974 WeakPolarHBondContact CB-OE2 3.32Å; A927-E974 PolarHBondContact N-OE1 2.04Å; E974-V1078 HydrophobicContact CG-CB 4.19Å; E974-T1080 VanDerWaalsContact O-CG2 3.31Å; E974-T1080 WeakPolarHBondContact O-CG2 3.36Å; E974-T1080 PolarHBondContact O-OG1 3.31Å
975	H	74.4	Confident	81	Confident	22 Å²	22	44 Å²	44	10%	0.102	24%	0.237	C	C	.	.			trans	-146.5	133.4	175.6	-163.4	50.9	0	0	0	112.6	F904 A906 A926 L972 F981 T1080	F904-H975 HydrophobicContact CE2-CB 3.91Å; F904-H975 HydrophobicContact CZ-CB 3.94Å; A906-H975 VanDerWaalsContact CB-CD2 3.5Å; A906-H975 WeakPolarHBondContact CB-CD2 3.36Å; A926-H975 HydrophobicContact CB-CB 4.21Å; A926-H975 WeakPolarHBondContact CB-O 3.26Å; L972-H975 HydrophobicContact CD1-CB 3.86Å; H975-F981 HydrophobicContact CB-CE2 4.19Å; H975-F981 HydrophobicContact CB-CZ 4.01Å; H975-F981 AromaticContact CD2-CD2 3.9Å; H975-F981 AromaticContact CD2-CE1 3.75Å; H975-F981 AromaticContact CD2-CE2 3.57Å; H975-F981 AromaticContact CD2-CZ 3.46Å; H975-F981 VanDerWaalsContact CD2-CZ 3.46Å; H975-F981 WeakPolarHBondContact CD2-CZ 3.34Å; H975-T1080 WeakPolarHBondContact CA-OG1 3.46Å; H975-T1080 PolarHBondContact ND1-OG1 3.02Å
976	S	71.9	Confident	81.1	Confident	21 Å²	21	43.8 Å²	43.8	15%	0.147	24%	0.235	C	C	.	.			trans	-124.1	137.3	167.1	-172.3	0	0	0	0	109.1	N1077 V1078	S976-N1077 VanDerWaalsContact CB-OD1 3.24Å; S976-N1077 WeakPolarHBondContact CB-OD1 3.29Å; S976-N1077 PolarHBondContact OG-OD1 3.15Å; S976-V1078 WeakPolarHBondContact CB-O 3.11Å; S976-V1078 PolarHBondContact N-O 3.09Å
977	S	67	Low	81.3	Confident	20 Å²	20	40.8 Å²	40.8	14%	0.14	23%	0.227	C	C	.	.			trans	-144.4	150.5	173.3	176.3	0	0	0	0	107.7	A946 S979	A946-S977 WeakPolarHBondContact CB-O 3.12Å; S977-S979 WeakPolarHBondContact CB-O 3.39Å; S977-S979 PolarHBondContact OG-N 3.47Å; S977-S979 VanDerWaalsContact OG-N 3.14Å; S977-S979 PolarHBondContact OG-O 3.12Å; S977-S979 VanDerWaalsContact OG-O 3.11Å; S977-S979 PolarHBondContact OG-OG 2.99Å
978	I	69.4	Low	81.7	Confident	163 Å²	163	38.6 Å²	38.6	84%	0.836	21%	0.214	S	C	*	.	S	Bend	trans	-78.3	-28.8	172.4	-57.2	175.2	0	0	0	110.2
979	S	74.6	Confident	81.9	Confident	43 Å²	43	32.6 Å²	32.6	30%	0.301	19%	0.185	S	C	.	.	S	Bend	trans	-80.6	146.2	169.4	64.3	0	0	0	0	111.3	Q908 S977	Q908-S979 PolarHBondContact NE2-OG 3.39Å; Q908-S979 VanDerWaalsContact NE2-OG 3.11Å; Q908-S979 PolarHBondContact OE1-OG 2.85Å; S977-S979 WeakPolarHBondContact CB-O 3.39Å; S977-S979 PolarHBondContact OG-N 3.47Å; S977-S979 VanDerWaalsContact OG-N 3.14Å; S977-S979 PolarHBondContact OG-O 3.12Å; S977-S979 VanDerWaalsContact OG-O 3.11Å; S977-S979 PolarHBondContact OG-OG 2.99Å
980	P	85.3	Confident	81.3	Confident	31 Å²	31	34.3 Å²	34.3	20%	0.201	20%	0.197	C	C	.	.			trans	-54.3	144	162.9	-26.5	36.5	0	0	0	112.1	F507 I511 P909 F944 I945	F507-P980 HydrophobicContact CZ-CB 4.03Å; I511-P980 HydrophobicContact CD1-CB 3.95Å; I511-P980 HydrophobicContact CD1-CG 3.93Å; I511-P980 HydrophobicContact CG1-CB 4.46Å; I511-P980 HydrophobicContact CG1-CG 4.36Å; P909-P980 VanDerWaalsContact CD-O 3.24Å; P909-P980 WeakPolarHBondContact CD-O 3.14Å; P909-P980 WeakPolarHBondContact CG-O 3.18Å; F944-P980 WeakPolarHBondContact O-CA 3.31Å; I945-P980 HydrophobicContact CG1-CB 4.09Å; I945-P980 HydrophobicContact CG1-CG 4.15Å; I945-P980 HydrophobicContact CG2-CG 4.43Å
981	F	89.6	Confident	80.2	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	154.7	175.6	58	-89.5	0	0	0	112.4	A906 F907 A926 A943 F944 H975 I983	A906-F981 HydrophobicContact CB-CD2 3.87Å; A906-F981 HydrophobicContact CB-CE2 4.18Å; F907-F981 WeakPolarHBondContact O-CB 3.25Å; A926-F981 HydrophobicContact CB-CE2 3.87Å; A926-F981 HydrophobicContact CB-CZ 3.61Å; A943-F981 CarbonylContact C-O 3.55Å; A943-F981 WeakPolarHBondContact CA-O 3.48Å; A943-F981 WeakPolarHBondContact CB-O 3.47Å; F944-F981 HydrophobicContact CB-CE1 4.43Å; F944-F981 HydrophobicContact CB-CE2 4.14Å; F944-F981 HydrophobicContact CB-CZ 4.02Å; F944-F981 AromaticContact CD1-CE1 3.99Å; F944-F981 HydrophobicContact CD1-CE1 3.99Å; F944-F981 AromaticContact CD1-CZ 3.79Å; F944-F981 HydrophobicContact CD1-CZ 3.79Å; F944-F981 HydrophobicContact CG-CZ 4.39Å; F944-F981 PolarHBondContact N-O 3.21Å; F944-F981 PolarHBondContact O-N 3.27Å; H975-F981 HydrophobicContact CB-CE2 4.19Å; H975-F981 HydrophobicContact CB-CZ 4.01Å; H975-F981 AromaticContact CD2-CD2 3.9Å; H975-F981 AromaticContact CD2-CE1 3.75Å; H975-F981 AromaticContact CD2-CE2 3.57Å; H975-F981 AromaticContact CD2-CZ 3.46Å; H975-F981 VanDerWaalsContact CD2-CZ 3.46Å; H975-F981 WeakPolarHBondContact CD2-CZ 3.34Å; F981-I983 HydrophobicContact CD2-CG1 3.88Å; F981-I983 HydrophobicContact CE2-CD1 3.92Å; F981-I983 HydrophobicContact CE2-CG1 3.69Å
982	V	92.1	Very high	78.8	Confident	3 Å²	3	42.3 Å²	42.3	2%	0.018	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	137.2	177.7	-177.3	0	0	0	0	109.6	F507 A906 F907 V941 S942 A943 F964	F507-V982 HydrophobicContact CE2-CG2 4.5Å; A906-V982 CarbonylContact C-O 3.51Å; A906-V982 WeakPolarHBondContact CA-O 3.03Å; F907-V982 HydrophobicContact CB-CB 4.44Å; F907-V982 PolarHBondContact N-O 3.26Å; F907-V982 PolarHBondContact O-N 2.98Å; V941-V982 HydrophobicContact CG2-CG1 3.38Å; S942-V982 CarbonylContact O-C 3.47Å; S942-V982 WeakPolarHBondContact O-CA 3.46Å; S942-V982 WeakPolarHBondContact O-CG1 3.03Å; A943-V982 HydrophobicContact CB-CG2 4.48Å; F964-V982 HydrophobicContact CE1-CG1 3.91Å; F964-V982 HydrophobicContact CZ-CB 4.45Å; F964-V982 HydrophobicContact CZ-CG1 3.99Å
983	I	93.6	Very high	77.4	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	120.5	-179.8	-66.7	174.8	0	0	0	107.7	F904 A926 C929 A930 V941 S942 F944 F981 I986	F904-I983 HydrophobicContact CB-CG2 3.82Å; F904-I983 HydrophobicContact CD2-CB 4.46Å; F904-I983 HydrophobicContact CD2-CG1 4.21Å; F904-I983 HydrophobicContact CD2-CG2 3.79Å; F904-I983 HydrophobicContact CE2-CG1 4.29Å; F904-I983 HydrophobicContact CG-CG2 3.89Å; A926-I983 HydrophobicContact CB-CD1 3.98Å; C929-I983 HydrophobicContact CB-CD1 4.17Å; A930-I983 HydrophobicContact CB-CG2 3.84Å; V941-I983 WeakPolarHBondContact CA-O 3.43Å; V941-I983 WeakPolarHBondContact CG2-O 3.45Å; S942-I983 PolarHBondContact N-O 3.4Å; S942-I983 PolarHBondContact O-N 3.15Å; S942-I983 WeakPolarHBondContact OG-CB 3.17Å; F944-I983 HydrophobicContact CB-CD1 3.81Å; F981-I983 HydrophobicContact CD2-CG1 3.88Å; F981-I983 HydrophobicContact CE2-CD1 3.92Å; F981-I983 HydrophobicContact CE2-CG1 3.69Å; I983-I986 HydrophobicContact CG2-CD1 3.85Å; I983-I986 HydrophobicContact CG2-CG1 3.93Å
984	S	92.8	Very high	76.1	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.007	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	-171.4	173.8	-155.3	0	0	0	0	112.5	Q905 Q940 G963 F964 I986	Q905-S984 PolarHBondContact N-O 2.91Å; Q905-S984 PolarHBondContact O-N 3.44Å; Q940-S984 PolarHBondContact O-OG 2.93Å; G963-S984 WeakPolarHBondContact CA-OG 3.46Å; F964-S984 PolarHBondContact N-OG 3.36Å; S984-I986 PolarHBondContact O-N 3.4Å; S984-I986 VanDerWaalsContact O-N 3.16Å
985	C	91.3	Very high	75.3	Confident	13 Å²	13	54.2 Å²	54.2	9%	0.088	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	57.4	27.4	-176.7	-48.6	0	0	0	0	114.7	Q905 F964 C965 K971 A987	Q905-C985 HydrophobicContact CB-CB 4.16Å; Q905-C985 VanDerWaalsContact CD-SG 3.55Å; Q905-C985 HydrophobicContact CG-CB 3.87Å; Q905-C985 PolarHBondContact OE1-SG 2.85Å; Q905-C985 VanDerWaalsContact OE1-SG 3.38Å; F964-C985 PolarHBondContact O-SG 2.97Å; C965-C985 WeakPolarHBondContact CA-SG 3.29Å; C965-C985 HydrophobicContact CB-CB 4.33Å; C965-C985 WeakPolarHBondContact CB-SG 3.26Å; C965-C985 WeakPolarHBondContact SG-CA 3.4Å; C965-C985 WeakPolarHBondContact SG-CB 3.47Å; C965-C985 CovalentContact SG-SG 2.03Å; C965-C985 PolarHBondContact SG-SG 2.81Å; K971-C985 PolarHBondContact NZ-O 3.42Å; K971-C985 VanDerWaalsContact NZ-O 3.11Å; C985-A987 PolarHBondContact O-N 2.62Å
986	I	91.7	Very high	75	Confident	9 Å²	9	56.7 Å²	56.7	5%	0.046	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	116.1	-166.5	-52.2	175.6	0	0	0	109.6	I902 T903 F904 A930 C933 Y934 I983 S984	I902-I986 HydrophobicContact CD1-CG2 3.54Å; I902-I986 HydrophobicContact CG1-CG2 3.93Å; T903-I986 WeakPolarHBondContact O-CA 3.39Å; F904-I986 HydrophobicContact CB-CG1 4.28Å; A930-I986 HydrophobicContact CB-CG2 4.17Å; C933-I986 HydrophobicContact CB-CD1 3.77Å; C933-I986 VanDerWaalsContact SG-CD1 3.52Å; Y934-I986 HydrophobicContact CD2-CG2 4.11Å; Y934-I986 HydrophobicContact CG-CG2 4.44Å; I983-I986 HydrophobicContact CG2-CD1 3.85Å; I983-I986 HydrophobicContact CG2-CG1 3.93Å; S984-I986 PolarHBondContact O-N 3.4Å; S984-I986 VanDerWaalsContact O-N 3.16Å
987	A	88.9	Confident	75.1	Confident	29 Å²	29	56.4 Å²	56.4	24%	0.24	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	115.4	-177.8	0	0	0	0	0	110.1	T903 C985 S989	T903-A987 PolarHBondContact N-O 3.38Å; T903-A987 PolarHBondContact O-N 2.93Å; T903-A987 PolarHBondContact OG1-O 3.11Å; C985-A987 PolarHBondContact O-N 2.62Å; A987-S989 PolarHBondContact O-N 2.93Å
988	C	86.7	Confident	75.6	Confident	22 Å²	22	57.9 Å²	57.9	15%	0.149	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	132.6	161.4	-167.5	0	0	0	0	109.3	C898 Y934 S990	C898-C988 WeakPolarHBondContact CA-SG 3.31Å; C898-C988 HydrophobicContact CB-CB 3.77Å; C898-C988 WeakPolarHBondContact CB-SG 3.39Å; C898-C988 VanDerWaalsContact SG-CA 3.6Å; C898-C988 WeakPolarHBondContact SG-CB 3.48Å; C898-C988 CovalentContact SG-SG 2.04Å; C898-C988 PolarHBondContact SG-SG 2.68Å; Y934-C988 HydrophobicContact CD1-CB 4.16Å; Y934-C988 HydrophobicContact CE1-CB 3.5Å; Y934-C988 HydrophobicContact CE2-CB 3.92Å; Y934-C988 WeakPolarHBondContact OH-CB 3.36Å; C988-S990 PolarHBondContact O-N 2.81Å
989	S	75.5	Confident	76.2	Confident	41 Å²	41	50.2 Å²	50.2	29%	0.287	28%	0.282	S	S	.	.			trans	-58.6	113.9	176.7	49.2	0	0	0	0	110.3	K900 R901 A987	K900-S989 WeakPolarHBondContact CB-OG 3.02Å; K900-S989 WeakPolarHBondContact CD-O 3.31Å; R901-S989 WeakPolarHBondContact O-CB 3.11Å; R901-S989 PolarHBondContact O-N 3.48Å; R901-S989 PolarHBondContact O-OG 3.33Å; A987-S989 PolarHBondContact O-N 2.93Å
990	S	62.4	Low	76.5	Confident	72 Å²	72	48.7 Å²	48.7	50%	0.503	27%	0.27	S	S	.	.			trans	-83.3	162.1	-176.7	80.1	0	0	0	0	111.1	C988 F992 A993	C988-S990 PolarHBondContact O-N 2.81Å; S990-F992 PolarHBondContact O-N 3.06Å; S990-A993 PolarHBondContact O-N 2.04Å
991	K	51	Low	76.3	Confident	169 Å²	169	47.3 Å²	47.3	74%	0.735	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	20.1	179.4	-147.1	-173	-178.5	178.2	0	114.6	E996	K991-E996 WeakPolarHBondContact CG-OE1 3.16Å
992	F	51.4	Low	75.7	Confident	185 Å²	185	51.4 Å²	51.4	81%	0.811	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.5	-3.7	178.9	-75.3	-82.7	0	0	0	113.2	S990 L994	S990-F992 PolarHBondContact O-N 3.06Å; F992-L994 PolarHBondContact O-N 3.38Å
993	A	53.9	Low	74.9	Confident	58 Å²	58	53.9 Å²	53.9	48%	0.479	29%	0.29	S	S	.	.	S	Bend	trans	-69.3	124.3	156.3	0	0	0	0	0	107.8	S990 L995	S990-A993 PolarHBondContact O-N 2.04Å; A993-L995 PolarHBondContact O-N 3.09Å; A993-L995 VanDerWaalsContact O-N 3.11Å
994	L	54.6	Low	73.8	Confident	179 Å²	179	55.6 Å²	55.6	94%	0.937	30%	0.296	S	S	*	.	S	Bend	trans	-78.5	12.2	-168.6	-78.9	165.4	0	0	0	115	F992	F992-L994 PolarHBondContact O-N 3.38Å
995	L	64.3	Low	72.5	Confident	58 Å²	58	60.5 Å²	60.5	30%	0.304	32%	0.322	S	S	.	.	S	Bend	trans	-154.6	113.4	175.5	-161.5	65.1	0	0	0	108.7	A993 C997 E1037 Y1040 C1093 A1094	A993-L995 PolarHBondContact O-N 3.09Å; A993-L995 VanDerWaalsContact O-N 3.11Å; L995-C997 PolarHBondContact O-N 2.82Å; L995-E1037 HydrophobicContact CD2-CB 4.21Å; L995-E1037 HydrophobicContact CD2-CG 4.17Å; L995-Y1040 HydrophobicContact CD1-CE1 4.36Å; L995-C1093 HydrophobicContact CD1-CB 3.98Å; L995-C1093 HydrophobicContact CD2-CB 4.31Å; L995-C1093 HydrophobicContact CG-CB 3.8Å; L995-A1094 CarbonylContact C-O 3.35Å
996	E	67.6	Low	70.8	Confident	74 Å²	74	61.5 Å²	61.5	35%	0.346	33%	0.328	S	S	.	.			trans	-93.5	80.9	-175.2	-64.6	-163.3	-168.1	0	0	111	K900 K991 C1093 A1094	K900-E996 WeakPolarHBondContact CE-OE2 3.14Å; K900-E996 IonicContact NZ-OE1 3.12Å; K900-E996 PolarHBondContact NZ-OE1 2.8Å; K900-E996 IonicContact NZ-OE2 2.69Å; K900-E996 PolarHBondContact NZ-OE2 2.63Å; K991-E996 WeakPolarHBondContact CG-OE1 3.16Å; E996-C1093 WeakPolarHBondContact O-CA 3.44Å; E996-A1094 HydrophobicContact CB-CB 4.46Å; E996-A1094 PolarHBondContact N-O 2.56Å; E996-A1094 PolarHBondContact O-N 3.16Å
997	C	72.9	Confident	68.9	Low	15 Å²	15	66.5 Å²	66.5	10%	0.101	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	114.8	-176.4	-66.5	0	0	0	0	114.8	L995 F999 L1033 C1093	L995-C997 PolarHBondContact O-N 2.82Å; C997-F999 HydrophobicContact CB-CD1 3.99Å; C997-F999 HydrophobicContact CB-CE1 3.96Å; C997-L1033 HydrophobicContact CB-CD1 4.43Å; C997-C1093 WeakPolarHBondContact CA-SG 3.48Å; C997-C1093 HydrophobicContact CB-CB 4Å; C997-C1093 WeakPolarHBondContact CB-SG 3.38Å; C997-C1093 WeakPolarHBondContact SG-CB 3.32Å; C997-C1093 CovalentContact SG-SG 2.04Å; C997-C1093 PolarHBondContact SG-SG 2.88Å
998	S	77.4	Confident	67	Low	51 Å²	51	69.4 Å²	69.4	36%	0.357	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	143.2	157.5	-166.7	0	0	0	0	110.7	V1091 E1092	S998-V1091 WeakPolarHBondContact O-CA 3.32Å; S998-E1092 WeakPolarHBondContact CA-O 3.43Å; S998-E1092 WeakPolarHBondContact CB-O 3.43Å; S998-E1092 PolarHBondContact N-O 3.32Å; S998-E1092 PolarHBondContact O-N 3.13Å
999	F	82.9	Confident	65.2	Low	1 Å²	1	72.9 Å²	72.9	0%	0.004	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.5	149.8	175.9	52.3	-87	0	0	0	109.3	R901 C997 I1001 L1033 A1036 I1088 D1089 C1090 V1091	R901-F999 VanDerWaalsContact CZ-O 3.24Å; R901-F999 PolarHBondContact NH1-O 2.75Å; R901-F999 PolarHBondContact NH2-O 3.23Å; C997-F999 HydrophobicContact CB-CD1 3.99Å; C997-F999 HydrophobicContact CB-CE1 3.96Å; F999-I1001 HydrophobicContact CD2-CD1 4.49Å; F999-I1001 HydrophobicContact CD2-CG1 3.87Å; F999-I1001 HydrophobicContact CE2-CD1 3.88Å; F999-I1001 HydrophobicContact CE2-CG1 3.77Å; F999-L1033 HydrophobicContact CE1-CD1 3.66Å; F999-L1033 HydrophobicContact CZ-CB 4.38Å; F999-L1033 HydrophobicContact CZ-CD1 3.84Å; F999-A1036 HydrophobicContact CB-CB 4.5Å; F999-A1036 HydrophobicContact CD1-CB 3.44Å; F999-A1036 VanDerWaalsContact CD1-CB 3.44Å; F999-A1036 HydrophobicContact CD2-CB 4.13Å; F999-A1036 HydrophobicContact CE1-CB 3.5Å; F999-A1036 VanDerWaalsContact CE1-CB 3.5Å; F999-A1036 HydrophobicContact CE2-CB 4.15Å; F999-A1036 HydrophobicContact CG-CB 3.78Å; F999-A1036 HydrophobicContact CZ-CB 3.85Å; F999-I1088 HydrophobicContact CB-CG2 3.86Å; F999-I1088 HydrophobicContact CD2-CG2 3.73Å; F999-I1088 HydrophobicContact CG-CG2 4Å; F999-D1089 WeakPolarHBondContact CA-O 3.28Å; F999-C1090 WeakPolarHBondContact CA-O 3.5Å; F999-V1091 HydrophobicContact CB-CG2 4.06Å
1000	N	80.8	Confident	63.7	Low	11 Å²	11	74 Å²	74	6%	0.059	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	148.3	170.6	-37.6	-51.5	0	0	0	109.6	D1072 I1088 D1089	N1000-D1072 PolarHBondContact OD1-O 2.96Å; N1000-I1088 WeakPolarHBondContact O-CA 3.3Å; N1000-D1089 WeakPolarHBondContact CB-OD1 3.44Å; N1000-D1089 PolarHBondContact N-O 3.34Å; N1000-D1089 PolarHBondContact ND2-OD1 2.99Å; N1000-D1089 PolarHBondContact O-N 3.42Å; N1000-D1089 VanDerWaalsContact O-N 3.08Å
1001	I	80.6	Confident	62.9	Low	3 Å²	3	76.1 Å²	76.1	2%	0.015	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.9	171.4	-44.7	177.9	0	0	0	108.7	V973 F999 A1032 P1076 V1078 L1086 L1087	V973-I1001 HydrophobicContact CB-CD1 4.25Å; V973-I1001 HydrophobicContact CG1-CD1 3.93Å; F999-I1001 HydrophobicContact CD2-CD1 4.49Å; F999-I1001 HydrophobicContact CD2-CG1 3.87Å; F999-I1001 HydrophobicContact CE2-CD1 3.88Å; F999-I1001 HydrophobicContact CE2-CG1 3.77Å; I1001-A1032 HydrophobicContact CD1-CB 4.42Å; I1001-P1076 WeakPolarHBondContact O-CD 3.42Å; I1001-P1076 WeakPolarHBondContact O-CG 3.28Å; I1001-V1078 HydrophobicContact CB-CG2 4.13Å; I1001-V1078 HydrophobicContact CG2-CG1 3.86Å; I1001-V1078 HydrophobicContact CG2-CG2 4.12Å; I1001-V1078 VanDerWaalsContact O-CG2 3.29Å; I1001-V1078 WeakPolarHBondContact O-CG2 3.45Å; I1001-L1086 HydrophobicContact CG2-CB 3.86Å; I1001-L1086 HydrophobicContact CG2-CD1 4.06Å; I1001-L1086 HydrophobicContact CG2-CG 4.44Å; I1001-L1087 CarbonylContact C-O 3.55Å; I1001-L1087 WeakPolarHBondContact CA-O 3.39Å
1002	R	78.1	Confident	62.8	Low	85 Å²	85	75.5 Å²	75.5	32%	0.321	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	150.7	174.9	-48.3	-173.9	-162.1	-129.7	-3.1	109.2	Y1004 D1072 P1076 L1086 L1087 D1089	R1002-Y1004 PolarHBondContact O-N 2.84Å; R1002-D1072 IonicContact CZ-OD2 3.16Å; R1002-D1072 IonicContact NH1-OD2 3.48Å; R1002-D1072 PolarHBondContact NH1-OD2 2.81Å; R1002-D1072 IonicContact NH2-OD2 3.63Å; R1002-D1072 PolarHBondContact NH2-OD2 3.09Å; R1002-P1076 HydrophobicContact CG-CG 4.3Å; R1002-L1086 CarbonylContact O-C 3.59Å; R1002-L1087 PolarHBondContact N-O 3.32Å; R1002-L1087 PolarHBondContact O-N 2.94Å; R1002-D1089 IonicContact NE-OD1 3.59Å; R1002-D1089 IonicContact NE-OD2 3.92Å; R1002-D1089 IonicContact NH2-OD1 2.79Å
1003	N	74.6	Confident	62.7	Low	55 Å²	55	72.6 Å²	72.6	29%	0.294	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	128.1	171.2	-68.8	8.3	0	0	0	109.5	I1005 V1078 D1079 L1084	N1003-I1005 PolarHBondContact O-N 2.81Å; N1003-V1078 WeakPolarHBondContact OD1-CA 3.35Å; N1003-V1078 WeakPolarHBondContact OD1-CG1 3.32Å; N1003-D1079 WeakPolarHBondContact ND2-CB 3.4Å; N1003-D1079 PolarHBondContact OD1-N 3.26Å; N1003-L1084 HydrophobicContact CB-CD1 4.39Å
1004	Y	70.3	Confident	62.2	Low	36 Å²	36	71.3 Å²	71.3	14%	0.141	41%	0.414	C	S	.	.			trans	-81.4	118.7	171.8	-174.7	-95.4	0	0	0	110.4	R1002 P1006 Y1019 F1020 P1085 L1087	R1002-Y1004 PolarHBondContact O-N 2.84Å; Y1004-P1006 HydrophobicContact CE1-CB 4.12Å; Y1004-Y1019 HydrophobicContact CE1-CD1 4.19Å; Y1004-Y1019 PolarHBondContact OH-O 3.45Å; Y1004-Y1019 VanDerWaalsContact OH-O 3.11Å; Y1004-F1020 HydrophobicContact CD1-CD1 4.47Å; Y1004-F1020 AromaticContact CD1-CE1 3.4Å; Y1004-F1020 HydrophobicContact CD1-CE1 3.4Å; Y1004-F1020 AromaticContact CD1-CZ 3.43Å; Y1004-F1020 HydrophobicContact CD1-CZ 3.43Å; Y1004-F1020 VanDerWaalsContact CD1-CZ 3.43Å; Y1004-F1020 AromaticContact CD2-CE1 3.86Å; Y1004-F1020 HydrophobicContact CD2-CE1 3.86Å; Y1004-F1020 AromaticContact CE1-CD1 3.97Å; Y1004-F1020 HydrophobicContact CE1-CD1 3.97Å; Y1004-F1020 AromaticContact CE1-CE1 3.29Å; Y1004-F1020 HydrophobicContact CE1-CE1 3.29Å; Y1004-F1020 AromaticContact CE1-CZ 3.66Å; Y1004-F1020 HydrophobicContact CE1-CZ 3.66Å; Y1004-F1020 HydrophobicContact CE2-CD1 4.33Å; Y1004-F1020 AromaticContact CE2-CE1 3.75Å; Y1004-F1020 HydrophobicContact CE2-CE1 3.75Å; Y1004-F1020 AromaticContact CG-CE1 3.68Å; Y1004-F1020 HydrophobicContact CG-CE1 3.68Å; Y1004-F1020 AromaticContact CG-CZ 3.92Å; Y1004-F1020 HydrophobicContact CG-CZ 3.92Å; Y1004-F1020 AromaticContact CZ-CD1 3.89Å; Y1004-F1020 AromaticContact CZ-CE1 3.48Å; Y1004-F1020 VanDerWaalsContact CZ-CE1 3.48Å; Y1004-P1085 WeakPolarHBondContact CB-O 3.37Å; Y1004-P1085 HydrophobicContact CD1-CG 4.18Å; Y1004-P1085 PolarHBondContact N-O 2.94Å; Y1004-L1087 HydrophobicContact CD2-CB 4.21Å; Y1004-L1087 HydrophobicContact CD2-CD1 3.83Å; Y1004-L1087 HydrophobicContact CD2-CD2 4.27Å; Y1004-L1087 HydrophobicContact CD2-CG 4.33Å; Y1004-L1087 HydrophobicContact CE2-CD1 4.4Å
1005	I	65.4	Low	62.1	Low	105 Å²	105	66.7 Å²	66.7	54%	0.538	39%	0.393	S	S	.	.			trans	-116.1	122.7	171.1	-56.1	176.1	0	0	0	106.1	N40 N1003	N40-I1005 VanDerWaalsContact ND2-CG2 3.31Å; N40-I1005 WeakPolarHBondContact ND2-CG2 3.49Å; N1003-I1005 PolarHBondContact O-N 2.81Å
1006	P	55.1	Low	61.6	Low	34 Å²	34	66 Å²	66	22%	0.221	39%	0.386	C	S	.	.			trans	-63.5	141.7	177.3	28.6	-36.6	0	0	0	110.4	Y1004 V1008 Y1019	Y1004-P1006 HydrophobicContact CE1-CB 4.12Å; P1006-V1008 PolarHBondContact O-N 2.83Å; P1006-Y1019 HydrophobicContact CB-CD1 3.83Å; P1006-Y1019 HydrophobicContact CB-CE1 4.28Å; P1006-Y1019 HydrophobicContact CG-CD1 3.68Å; P1006-Y1019 HydrophobicContact CG-CE1 3.6Å
1007	S	51.6	Low	61	Low	114 Å²	114	67.3 Å²	67.3	80%	0.797	40%	0.396	S	S	*	.	S	Bend	trans	-74.6	-10.4	175.1	49.1	0	0	0	0	113.6
1008	V	49.9	Very low	60	Low	90 Å²	90	68.9 Å²	68.9	55%	0.545	41%	0.407	S	S	.	.	S	Bend	trans	-123.5	115.7	-174.6	-174.4	0	0	0	0	110.8	P1006 T1010	P1006-V1008 PolarHBondContact O-N 2.83Å; V1008-T1010 HydrophobicContact CG1-CG2 4.39Å; V1008-T1010 PolarHBondContact O-N 2.77Å
1009	P	48.6	Very low	58.9	Low	95 Å²	95	70.5 Å²	70.5	62%	0.617	41%	0.406	S	S	*	.			trans	-72.2	93.9	167.8	-15.8	30.9	0	0	0	110.2
1010	T	44.6	Very low	57.7	Low	65 Å²	65	70.8 Å²	70.8	40%	0.399	41%	0.407	S	S	.	.			trans	-69.5	132.6	176.7	54.4	0	0	0	0	110.8	V1008 K1012	V1008-T1010 HydrophobicContact CG1-CG2 4.39Å; V1008-T1010 PolarHBondContact O-N 2.77Å; T1010-K1012 PolarHBondContact O-N 3.04Å; T1010-K1012 PolarHBondContact OG1-O 3.39Å
1011	A	45.5	Very low	56.7	Low	115 Å²	115	77.9 Å²	77.9	95%	0.95	45%	0.445	S	S	*	.	S	Bend	trans	-74.5	7.7	-178.8	0	0	0	0	0	114.9
1012	K	48.5	Very low	55.9	Low	156 Å²	156	83.6 Å²	83.6	68%	0.678	48%	0.476	S	S	*	.	S	Bend	trans	-115.8	153	167.8	-69.3	-172.6	176.5	-171.4	0	107.9	T1010 A1014	T1010-K1012 PolarHBondContact O-N 3.04Å; T1010-K1012 PolarHBondContact OG1-O 3.39Å; K1012-A1014 PolarHBondContact O-N 2.89Å
1013	P	48.5	Very low	55.7	Low	125 Å²	125	80.8 Å²	80.8	81%	0.812	47%	0.466	S	S	*	.			trans	-55.9	115.3	165.8	26.1	-33.8	0	0	0	108	T1015	P1013-T1015 PolarHBondContact O-N 3.22Å
1014	A	44.3	Very low	55.8	Low	31 Å²	31	83 Å²	83	26%	0.256	48%	0.475	S	S	.	.			trans	-65.8	121.5	-174.4	0	0	0	0	0	109.4	K1012 S1018 Y1019	K1012-A1014 PolarHBondContact O-N 2.89Å; A1014-S1018 VanDerWaalsContact CA-OG 3.28Å; A1014-S1018 WeakPolarHBondContact CA-OG 3.31Å; A1014-S1018 WeakPolarHBondContact CB-OG 3.03Å; A1014-Y1019 HydrophobicContact CB-CD2 3.71Å; A1014-Y1019 HydrophobicContact CB-CE1 4.49Å; A1014-Y1019 HydrophobicContact CB-CE2 3.24Å; A1014-Y1019 HydrophobicContact CB-CG 4.48Å
1015	T	52.2	Low	56.3	Low	81 Å²	81	84 Å²	84	50%	0.497	48%	0.481	S	S	.	.			trans	-70.2	155.8	163.5	65.5	0	0	0	0	108.4	P1013 D1017 S1018 Y1019	P1013-T1015 PolarHBondContact O-N 3.22Å; T1015-D1017 WeakPolarHBondContact CB-OD2 3.24Å; T1015-D1017 PolarHBondContact O-N 3.41Å; T1015-D1017 PolarHBondContact OG1-OD2 2.83Å; T1015-S1018 PolarHBondContact N-OG 2.03Å; T1015-S1018 PolarHBondContact O-N 3.47Å; T1015-S1018 PolarHBondContact O-OG 3.19Å; T1015-Y1019 WeakPolarHBondContact O-CD2 2.99Å
1016	W	53.3	Low	57.3	Low	43 Å²	43	83.8 Å²	83.8	16%	0.163	48%	0.478	C	S	.	.	G	3₁₀ helix	trans	-42.8	-45.4	177.4	177.7	-112	0	0	0	112.5	S1018 Y1019 F1020 N1057 L1059 P1085	W1016-S1018 PolarHBondContact O-N 2.94Å; W1016-Y1019 PolarHBondContact O-N 3.48Å; W1016-F1020 HydrophobicContact CD2-CE2 4.44Å; W1016-F1020 HydrophobicContact CE3-CE2 4.05Å; W1016-F1020 HydrophobicContact CH2-CD2 4.48Å; W1016-F1020 AromaticContact CH2-CE2 3.63Å; W1016-F1020 HydrophobicContact CH2-CE2 3.63Å; W1016-F1020 HydrophobicContact CH2-CZ 4.2Å; W1016-F1020 HydrophobicContact CZ2-CE2 4.1Å; W1016-F1020 AromaticContact CZ3-CE2 3.62Å; W1016-F1020 HydrophobicContact CZ3-CE2 3.62Å; W1016-F1020 HydrophobicContact CZ3-CZ 4.34Å; W1016-F1020 WeakPolarHBondContact O-CD2 3.41Å; W1016-N1057 HydrophobicContact CZ2-CB 3.92Å; W1016-N1057 PolarHBondContact NE1-ND2 3.1Å; W1016-N1057 VanDerWaalsContact NE1-ND2 3.18Å; W1016-L1059 HydrophobicContact CD2-CD1 4.37Å; W1016-L1059 VanDerWaalsContact CE2-CD1 3.48Å; W1016-L1059 HydrophobicContact CH2-CD1 4.35Å; W1016-L1059 HydrophobicContact CZ2-CD1 3.48Å; W1016-L1059 VanDerWaalsContact CZ2-CD1 3.48Å; W1016-L1059 HydrophobicContact CZ2-CG 3.75Å; W1016-P1085 HydrophobicContact CH2-CB 3.94Å; W1016-P1085 HydrophobicContact CZ3-CB 3.79Å; W1016-P1085 HydrophobicContact CZ3-CG 4.11Å
1017	D	55.8	Low	59	Low	102 Å²	102	84 Å²	84	55%	0.545	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-62.6	-40.3	-178.5	-20.6	-74.8	0	0	0	112.3	T1015 Y1019 F1020	T1015-D1017 WeakPolarHBondContact CB-OD2 3.24Å; T1015-D1017 PolarHBondContact O-N 3.41Å; T1015-D1017 PolarHBondContact OG1-OD2 2.83Å; D1017-Y1019 VanDerWaalsContact C-N 3.28Å; D1017-Y1019 PolarHBondContact O-N 2.69Å; D1017-F1020 PolarHBondContact O-N 3.47Å
1018	S	52.3	Low	60.9	Low	48 Å²	48	82.4 Å²	82.4	34%	0.336	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-75.1	-7.5	-175.5	66.5	0	0	0	0	115.6	A1014 T1015 W1016 F1020	A1014-S1018 VanDerWaalsContact CA-OG 3.28Å; A1014-S1018 WeakPolarHBondContact CA-OG 3.31Å; A1014-S1018 WeakPolarHBondContact CB-OG 3.03Å; T1015-S1018 PolarHBondContact N-OG 2.03Å; T1015-S1018 PolarHBondContact O-N 3.47Å; T1015-S1018 PolarHBondContact O-OG 3.19Å; W1016-S1018 PolarHBondContact O-N 2.94Å; S1018-F1020 VanDerWaalsContact C-N 3.3Å
1019	Y	53	Low	62.7	Low	85 Å²	85	78.2 Å²	78.2	33%	0.333	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-76.8	-17.5	170.7	-78.6	-98.8	0	0	0	112.4	Y1004 P1006 A1014 T1015 W1016 D1017	Y1004-Y1019 HydrophobicContact CE1-CD1 4.19Å; Y1004-Y1019 PolarHBondContact OH-O 3.45Å; Y1004-Y1019 VanDerWaalsContact OH-O 3.11Å; P1006-Y1019 HydrophobicContact CB-CD1 3.83Å; P1006-Y1019 HydrophobicContact CB-CE1 4.28Å; P1006-Y1019 HydrophobicContact CG-CD1 3.68Å; P1006-Y1019 HydrophobicContact CG-CE1 3.6Å; A1014-Y1019 HydrophobicContact CB-CD2 3.71Å; A1014-Y1019 HydrophobicContact CB-CE1 4.49Å; A1014-Y1019 HydrophobicContact CB-CE2 3.24Å; A1014-Y1019 HydrophobicContact CB-CG 4.48Å; T1015-Y1019 WeakPolarHBondContact O-CD2 2.99Å; W1016-Y1019 PolarHBondContact O-N 3.48Å; D1017-Y1019 VanDerWaalsContact C-N 3.28Å; D1017-Y1019 PolarHBondContact O-N 2.69Å
1020	F	59.1	Low	64.5	Low	8 Å²	8	80.8 Å²	80.8	4%	0.035	44%	0.437	C	S	.	.			trans	-141.8	42.9	-152.5	-64.5	-66.9	0	0	0	114.7	Y1004 W1016 D1017 S1018 D1022 F1023 A1048 L1059 P1085	Y1004-F1020 HydrophobicContact CD1-CD1 4.47Å; Y1004-F1020 AromaticContact CD1-CE1 3.4Å; Y1004-F1020 HydrophobicContact CD1-CE1 3.4Å; Y1004-F1020 AromaticContact CD1-CZ 3.43Å; Y1004-F1020 HydrophobicContact CD1-CZ 3.43Å; Y1004-F1020 VanDerWaalsContact CD1-CZ 3.43Å; Y1004-F1020 AromaticContact CD2-CE1 3.86Å; Y1004-F1020 HydrophobicContact CD2-CE1 3.86Å; Y1004-F1020 AromaticContact CE1-CD1 3.97Å; Y1004-F1020 HydrophobicContact CE1-CD1 3.97Å; Y1004-F1020 AromaticContact CE1-CE1 3.29Å; Y1004-F1020 HydrophobicContact CE1-CE1 3.29Å; Y1004-F1020 AromaticContact CE1-CZ 3.66Å; Y1004-F1020 HydrophobicContact CE1-CZ 3.66Å; Y1004-F1020 HydrophobicContact CE2-CD1 4.33Å; Y1004-F1020 AromaticContact CE2-CE1 3.75Å; Y1004-F1020 HydrophobicContact CE2-CE1 3.75Å; Y1004-F1020 AromaticContact CG-CE1 3.68Å; Y1004-F1020 HydrophobicContact CG-CE1 3.68Å; Y1004-F1020 AromaticContact CG-CZ 3.92Å; Y1004-F1020 HydrophobicContact CG-CZ 3.92Å; Y1004-F1020 AromaticContact CZ-CD1 3.89Å; Y1004-F1020 AromaticContact CZ-CE1 3.48Å; Y1004-F1020 VanDerWaalsContact CZ-CE1 3.48Å; W1016-F1020 HydrophobicContact CD2-CE2 4.44Å; W1016-F1020 HydrophobicContact CE3-CE2 4.05Å; W1016-F1020 HydrophobicContact CH2-CD2 4.48Å; W1016-F1020 AromaticContact CH2-CE2 3.63Å; W1016-F1020 HydrophobicContact CH2-CE2 3.63Å; W1016-F1020 HydrophobicContact CH2-CZ 4.2Å; W1016-F1020 HydrophobicContact CZ2-CE2 4.1Å; W1016-F1020 AromaticContact CZ3-CE2 3.62Å; W1016-F1020 HydrophobicContact CZ3-CE2 3.62Å; W1016-F1020 HydrophobicContact CZ3-CZ 4.34Å; W1016-F1020 WeakPolarHBondContact O-CD2 3.41Å; D1017-F1020 PolarHBondContact O-N 3.47Å; S1018-F1020 VanDerWaalsContact C-N 3.3Å; F1020-D1022 PolarHBondContact O-N 3.23Å; F1020-F1023 HydrophobicContact CB-CB 4.08Å; F1020-F1023 HydrophobicContact CB-CD2 3.67Å; F1020-F1023 HydrophobicContact CB-CE2 4.43Å; F1020-F1023 HydrophobicContact CB-CG 4.04Å; F1020-F1023 AromaticContact CD1-CD2 3.66Å; F1020-F1023 HydrophobicContact CD1-CD2 3.66Å; F1020-F1023 AromaticContact CD1-CE2 3.55Å; F1020-F1023 HydrophobicContact CD1-CE2 3.55Å; F1020-F1023 HydrophobicContact CD1-CG 4.27Å; F1020-F1023 HydrophobicContact CD1-CZ 4.06Å; F1020-F1023 HydrophobicContact CE1-CE2 4.3Å; F1020-F1023 HydrophobicContact CE1-CZ 4.43Å; F1020-F1023 HydrophobicContact CG-CD2 4.1Å; F1020-F1023 HydrophobicContact CG-CE2 4.43Å; F1020-F1023 HydrophobicContact CG-CG 4.49Å; F1020-F1023 WeakPolarHBondContact O-CB 3.1Å; F1020-F1023 PolarHBondContact O-N 2.87Å; F1020-A1048 HydrophobicContact CD1-CB 4.21Å; F1020-A1048 HydrophobicContact CE1-CB 3.51Å; F1020-A1048 HydrophobicContact CE2-CB 4.49Å; F1020-A1048 HydrophobicContact CZ-CB 3.69Å; F1020-L1059 HydrophobicContact CB-CD1 3.7Å; F1020-L1059 HydrophobicContact CD1-CD1 4.48Å; F1020-L1059 HydrophobicContact CD2-CD1 3.15Å; F1020-L1059 HydrophobicContact CE2-CD1 3.83Å; F1020-L1059 HydrophobicContact CG-CD1 3.56Å; F1020-P1085 HydrophobicContact CZ-CB 4.12Å; F1020-P1085 HydrophobicContact CZ-CG 4.16Å
1021	D	58.6	Low	66.3	Low	160 Å²	160	79.5 Å²	79.5	86%	0.856	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-24.9	176.1	-76.6	-26.3	0	0	0	114.3	F1023	D1021-F1023 VanDerWaalsContact C-N 3.31Å; D1021-F1023 PolarHBondContact O-N 2.92Å
1022	D	65.3	Low	68.2	Low	122 Å²	122	74.5 Å²	74.5	65%	0.652	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-9.6	175.9	-73.1	-43.3	0	0	0	114.4	F1020 T1061	F1020-D1022 PolarHBondContact O-N 3.23Å; D1022-T1061 WeakPolarHBondContact O-CB 3.42Å; D1022-T1061 PolarHBondContact O-OG1 2.59Å
1023	F	72.7	Confident	69.9	Low	26 Å²	26	69.7 Å²	69.7	11%	0.114	37%	0.368	C	S	.	.			trans	-103.1	109.2	-169.9	-66.4	-110.3	0	0	0	111.9	F1020 D1021 L1046 A1048 L1059 T1061 L1087	F1020-F1023 HydrophobicContact CB-CB 4.08Å; F1020-F1023 HydrophobicContact CB-CD2 3.67Å; F1020-F1023 HydrophobicContact CB-CE2 4.43Å; F1020-F1023 HydrophobicContact CB-CG 4.04Å; F1020-F1023 AromaticContact CD1-CD2 3.66Å; F1020-F1023 HydrophobicContact CD1-CD2 3.66Å; F1020-F1023 AromaticContact CD1-CE2 3.55Å; F1020-F1023 HydrophobicContact CD1-CE2 3.55Å; F1020-F1023 HydrophobicContact CD1-CG 4.27Å; F1020-F1023 HydrophobicContact CD1-CZ 4.06Å; F1020-F1023 HydrophobicContact CE1-CE2 4.3Å; F1020-F1023 HydrophobicContact CE1-CZ 4.43Å; F1020-F1023 HydrophobicContact CG-CD2 4.1Å; F1020-F1023 HydrophobicContact CG-CE2 4.43Å; F1020-F1023 HydrophobicContact CG-CG 4.49Å; F1020-F1023 WeakPolarHBondContact O-CB 3.1Å; F1020-F1023 PolarHBondContact O-N 2.87Å; D1021-F1023 VanDerWaalsContact C-N 3.31Å; D1021-F1023 PolarHBondContact O-N 2.92Å; F1023-L1046 HydrophobicContact CE1-CD2 4.42Å; F1023-L1046 HydrophobicContact CE1-CG 4.29Å; F1023-L1046 HydrophobicContact CZ-CD2 3.87Å; F1023-L1046 HydrophobicContact CZ-CG 4.14Å; F1023-A1048 HydrophobicContact CD1-CB 4.46Å; F1023-A1048 HydrophobicContact CE1-CB 3.89Å; F1023-A1048 HydrophobicContact CZ-CB 4.25Å; F1023-L1059 HydrophobicContact CB-CB 4.05Å; F1023-L1059 HydrophobicContact CD1-CB 3.91Å; F1023-L1059 HydrophobicContact CG-CB 4.23Å; F1023-T1061 HydrophobicContact CD1-CG2 4.29Å; F1023-T1061 HydrophobicContact CE1-CG2 4.24Å; F1023-T1061 HydrophobicContact CZ-CG2 4.48Å; F1023-L1087 HydrophobicContact CZ-CD1 4.19Å
1024	E	77.1	Confident	71.8	Confident	103 Å²	103	65.5 Å²	65.5	48%	0.481	34%	0.338	S	S	.	.			trans	-89	-14.7	-166.2	-53.5	-171.9	110.2	0	0	114.5	M1060 K1063	E1024-M1060 PolarHBondContact N-O 3.36Å; E1024-M1060 VanDerWaalsContact N-O 3.1Å; E1024-K1063 HydrophobicContact CG-CD 4.35Å; E1024-K1063 WeakPolarHBondContact OE1-CE 3.49Å; E1024-K1063 IonicContact OE1-NZ 3.98Å; E1024-K1063 PolarHBondContact OE1-NZ 3.37Å
1025	M	81.1	Confident	74.1	Confident	56 Å²	56	64 Å²	64	28%	0.276	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	139.8	-176.5	-61.5	179.1	-70.2	0	0	110.7	K1042 L1059 M1060 I1062	M1025-K1042 HydrophobicContact CE-CB 3.99Å; M1025-L1059 CarbonylContact O-C 3.29Å; M1025-L1059 WeakPolarHBondContact O-CA 2.99Å; M1025-M1060 HydrophobicContact CB-CG 3.77Å; M1025-M1060 HydrophobicContact CB-SD 4.41Å; M1025-M1060 HydrophobicContact CE-CG 3.98Å; M1025-M1060 HydrophobicContact CE-SD 3.99Å; M1025-M1060 PolarHBondContact N-O 3.49Å; M1025-M1060 PolarHBondContact O-N 2.03Å; M1025-I1062 HydrophobicContact CE-CD1 3.68Å; M1025-I1062 HydrophobicContact CE-CG1 3.74Å
1026	Q	86.9	Confident	75.9	Confident	100 Å²	100	60.2 Å²	60.2	47%	0.467	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	138.7	171.7	-173.6	178.1	-14	0	0	109.6	N1057 C1058 L1059	Q1026-N1057 VanDerWaalsContact NE2-CG 3.32Å; Q1026-N1057 PolarHBondContact NE2-ND2 3.39Å; Q1026-N1057 PolarHBondContact NE2-OD1 3.41Å; Q1026-C1058 WeakPolarHBondContact CA-O 3.35Å; Q1026-L1059 HydrophobicContact CB-CD2 3.72Å; Q1026-L1059 HydrophobicContact CG-CD2 3.82Å
1027	V	90.3	Very high	77.6	Confident	38 Å²	38	61.5 Å²	61.5	23%	0.23	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	146.9	168.6	-61.5	0	0	0	0	109.7	K1038 C1058 M1060	V1027-K1038 HydrophobicContact CG2-CB 4.15Å; V1027-K1038 HydrophobicContact CG2-CD 3.87Å; V1027-C1058 HydrophobicContact CG2-CB 3.84Å; V1027-C1058 PolarHBondContact N-O 2.71Å; V1027-C1058 WeakPolarHBondContact O-CA 3.37Å; V1027-C1058 VanDerWaalsContact O-CB 3.3Å; V1027-C1058 WeakPolarHBondContact O-CB 3.22Å; V1027-C1058 PolarHBondContact O-N 3.07Å; V1027-M1060 HydrophobicContact CG2-CE 3.69Å
1028	D	90.6	Very high	79.3	Confident	82 Å²	82	59.4 Å²	59.4	44%	0.439	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	143.3	165.2	-60.2	40.9	0	0	0	109.9	K1038 N1055 G1056	D1028-K1038 PolarHBondContact O-NZ 3Å; D1028-N1055 HydrophobicContact CB-CB 4.2Å; D1028-N1055 WeakPolarHBondContact OD2-CB 3.26Å; D1028-N1055 PolarHBondContact OD2-ND2 3.31Å; D1028-G1056 CarbonylContact C-O 3.59Å; D1028-G1056 VanDerWaalsContact CA-O 3.32Å; D1028-G1056 WeakPolarHBondContact CA-O 3.41Å
1029	A	88.9	Confident	81.2	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.008	28%	0.28	C	S	.	.			trans	-156.9	130.4	170.3	0	0	0	0	0	109.4	N1031 E1034 C1035 K1038 Y1049 N1055 G1056 C1058	A1029-N1031 VanDerWaalsContact C-N 3.26Å; A1029-N1031 PolarHBondContact O-N 3.46Å; A1029-E1034 HydrophobicContact CB-CB 4.17Å; A1029-E1034 HydrophobicContact CB-CG 4.09Å; A1029-C1035 HydrophobicContact CB-CB 3.97Å; A1029-K1038 HydrophobicContact CB-CD 4.24Å; A1029-Y1049 WeakPolarHBondContact O-CE2 2.91Å; A1029-N1055 CarbonylContact C-O 3.42Å; A1029-N1055 VanDerWaalsContact C-O 3.23Å; A1029-N1055 VanDerWaalsContact O-O 3.07Å; A1029-G1056 PolarHBondContact N-O 2.98Å; A1029-G1056 CarbonylContact O-C 3.31Å; A1029-G1056 VanDerWaalsContact O-C 3.29Å; A1029-G1056 WeakPolarHBondContact O-CA 3.28Å; A1029-C1058 HydrophobicContact CB-CB 3.74Å
1030	K	85.4	Confident	83	Confident	149 Å²	149	57.8 Å²	57.8	65%	0.648	28%	0.282	S	S	*	.	S	Bend	trans	-73.7	-16.6	-170	-59.9	162.7	-171.1	164.6	0	114.2	E1034 Y1049 N1055	K1030-E1034 VanDerWaalsContact CB-OE2 3.27Å; K1030-E1034 WeakPolarHBondContact CB-OE2 3.01Å; K1030-E1034 WeakPolarHBondContact CD-OE2 2.98Å; K1030-E1034 VanDerWaalsContact CG-OE2 3.27Å; K1030-E1034 WeakPolarHBondContact CG-OE2 3.36Å; K1030-E1034 PolarHBondContact N-OE2 2.91Å; K1030-Y1049 PolarHBondContact O-OH 3.22Å; K1030-N1055 WeakPolarHBondContact CA-O 3.35Å; K1030-N1055 PolarHBondContact N-O 2.98Å
1031	N	82.5	Confident	84.5	Confident	39 Å²	39	61.1 Å²	61.1	21%	0.209	31%	0.307	C	S	.	.	S	Bend	trans	-160.4	171.2	-177.1	59	58.6	0	0	0	110.5	E970 A1029 L1033 E1034 C1035	E970-N1031 HydrophobicContact CG-CB 4.21Å; E970-N1031 WeakPolarHBondContact OE1-CB 3.09Å; A1029-N1031 VanDerWaalsContact C-N 3.26Å; A1029-N1031 PolarHBondContact O-N 3.46Å; N1031-L1033 VanDerWaalsContact C-N 3.3Å; N1031-L1033 PolarHBondContact O-N 2.81Å; N1031-L1033 WeakPolarHBondContact OD1-CA 3.41Å; N1031-L1033 WeakPolarHBondContact OD1-CB 3.34Å; N1031-L1033 PolarHBondContact OD1-N 3.47Å; N1031-L1033 VanDerWaalsContact OD1-N 3.08Å; N1031-E1034 PolarHBondContact O-N 3.01Å; N1031-E1034 PolarHBondContact OD1-N 3.25Å; N1031-C1035 PolarHBondContact O-N 3.43Å; N1031-C1035 VanDerWaalsContact O-N 3.1Å
1032	A	85.1	Confident	86	Confident	10 Å²	10	58.4 Å²	58.4	8%	0.083	29%	0.287	C	S	.	.	H	α-helix	trans	-61.8	-33.3	-179.8	0	0	0	0	0	113.4	I1001 C1035 A1036 Y1049 L1086 I1088	I1001-A1032 HydrophobicContact CD1-CB 4.42Å; A1032-C1035 WeakPolarHBondContact O-CB 3.4Å; A1032-C1035 PolarHBondContact O-N 2.92Å; A1032-A1036 PolarHBondContact O-N 3.36Å; A1032-Y1049 HydrophobicContact CB-CD1 3.88Å; A1032-Y1049 HydrophobicContact CB-CG 4.4Å; A1032-L1086 HydrophobicContact CB-CD1 4.34Å; A1032-I1088 HydrophobicContact CB-CD1 4.05Å; A1032-I1088 VanDerWaalsContact O-CD1 3.25Å; A1032-I1088 WeakPolarHBondContact O-CD1 3.45Å
1033	L	85	Confident	87	Confident	55 Å²	55	61.2 Å²	61.2	29%	0.288	29%	0.294	S	S	.	.	H	α-helix	trans	-67.3	-48.1	178.2	175	61.5	0	0	0	111.2	C997 F999 N1031 C1035 A1036 E1037	C997-L1033 HydrophobicContact CB-CD1 4.43Å; F999-L1033 HydrophobicContact CE1-CD1 3.66Å; F999-L1033 HydrophobicContact CZ-CB 4.38Å; F999-L1033 HydrophobicContact CZ-CD1 3.84Å; N1031-L1033 VanDerWaalsContact C-N 3.3Å; N1031-L1033 PolarHBondContact O-N 2.81Å; N1031-L1033 WeakPolarHBondContact OD1-CA 3.41Å; N1031-L1033 WeakPolarHBondContact OD1-CB 3.34Å; N1031-L1033 PolarHBondContact OD1-N 3.47Å; N1031-L1033 VanDerWaalsContact OD1-N 3.08Å; L1033-C1035 PolarHBondContact O-N 2.88Å; L1033-A1036 WeakPolarHBondContact O-CB 3.48Å; L1033-A1036 PolarHBondContact O-N 2.63Å; L1033-E1037 HydrophobicContact CD1-CG 4.34Å; L1033-E1037 WeakPolarHBondContact O-CG 3.41Å; L1033-E1037 PolarHBondContact O-N 2.92Å
1034	E	88.5	Confident	87.7	Confident	37 Å²	37	60.3 Å²	60.3	17%	0.173	29%	0.291	C	S	.	.	H	α-helix	trans	-61.4	-31.8	175	-172.9	179.6	175.6	0	0	111.3	A1029 K1030 N1031 K1038	A1029-E1034 HydrophobicContact CB-CB 4.17Å; A1029-E1034 HydrophobicContact CB-CG 4.09Å; K1030-E1034 VanDerWaalsContact CB-OE2 3.27Å; K1030-E1034 WeakPolarHBondContact CB-OE2 3.01Å; K1030-E1034 WeakPolarHBondContact CD-OE2 2.98Å; K1030-E1034 VanDerWaalsContact CG-OE2 3.27Å; K1030-E1034 WeakPolarHBondContact CG-OE2 3.36Å; K1030-E1034 PolarHBondContact N-OE2 2.91Å; N1031-E1034 PolarHBondContact O-N 3.01Å; N1031-E1034 PolarHBondContact OD1-N 3.25Å; E1034-K1038 HydrophobicContact CG-CD 4.04Å; E1034-K1038 VanDerWaalsContact O-CB 3.22Å; E1034-K1038 WeakPolarHBondContact O-CB 3.41Å; E1034-K1038 WeakPolarHBondContact O-CG 3.47Å; E1034-K1038 PolarHBondContact O-N 3.3Å; E1034-K1038 WeakPolarHBondContact OE1-CE 2.92Å; E1034-K1038 IonicContact OE1-NZ 2.65Å; E1034-K1038 PolarHBondContact OE1-NZ 2.91Å
1035	C	91.7	Very high	87.9	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-67.9	-40.4	172.5	-177	0	0	0	0	112.3	A1029 N1031 A1032 L1033 C1039 Y1049 C1058 I1088	A1029-C1035 HydrophobicContact CB-CB 3.97Å; N1031-C1035 PolarHBondContact O-N 3.43Å; N1031-C1035 VanDerWaalsContact O-N 3.1Å; A1032-C1035 WeakPolarHBondContact O-CB 3.4Å; A1032-C1035 PolarHBondContact O-N 2.92Å; L1033-C1035 PolarHBondContact O-N 2.88Å; C1035-C1039 VanDerWaalsContact O-CB 3.3Å; C1035-C1039 WeakPolarHBondContact O-CB 3.01Å; C1035-C1039 PolarHBondContact O-N 3.18Å; C1035-Y1049 HydrophobicContact CB-CD2 4.26Å; C1035-Y1049 HydrophobicContact CB-CG 4.4Å; C1035-C1058 WeakPolarHBondContact CA-SG 2.99Å; C1035-C1058 HydrophobicContact CB-CB 3.64Å; C1035-C1058 WeakPolarHBondContact CB-SG 2.98Å; C1035-C1058 PolarHBondContact O-SG 2.81Å; C1035-C1058 WeakPolarHBondContact SG-CB 3.23Å; C1035-C1058 CovalentContact SG-SG 2.03Å; C1035-C1058 PolarHBondContact SG-SG 3.3Å; C1035-I1088 HydrophobicContact CB-CD1 3.87Å
1036	A	90	Very high	88.2	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-66.1	-48.1	173.7	0	0	0	0	0	112.2	F999 A1032 L1033 K1038 C1039 Y1040 I1088 V1091	F999-A1036 HydrophobicContact CB-CB 4.5Å; F999-A1036 HydrophobicContact CD1-CB 3.44Å; F999-A1036 VanDerWaalsContact CD1-CB 3.44Å; F999-A1036 HydrophobicContact CD2-CB 4.13Å; F999-A1036 HydrophobicContact CE1-CB 3.5Å; F999-A1036 VanDerWaalsContact CE1-CB 3.5Å; F999-A1036 HydrophobicContact CE2-CB 4.15Å; F999-A1036 HydrophobicContact CG-CB 3.78Å; F999-A1036 HydrophobicContact CZ-CB 3.85Å; A1032-A1036 PolarHBondContact O-N 3.36Å; L1033-A1036 WeakPolarHBondContact O-CB 3.48Å; L1033-A1036 PolarHBondContact O-N 2.63Å; A1036-K1038 VanDerWaalsContact C-N 3.31Å; A1036-K1038 PolarHBondContact O-N 3.17Å; A1036-C1039 WeakPolarHBondContact O-CB 3.47Å; A1036-C1039 PolarHBondContact O-N 3.28Å; A1036-Y1040 PolarHBondContact O-N 3.24Å; A1036-I1088 HydrophobicContact CB-CG2 4.09Å; A1036-V1091 HydrophobicContact CB-CG1 4.29Å; A1036-V1091 VanDerWaalsContact O-CG1 3.31Å; A1036-V1091 WeakPolarHBondContact O-CG1 3.36Å
1037	E	90.2	Very high	88.3	Confident	70 Å²	70	50.1 Å²	50.1	33%	0.327	25%	0.246	S	C	.	.	H	α-helix	trans	-55.4	-46.5	174.7	-68	175.8	171.3	0	0	111.3	L995 L1033 Y1040 S1041	L995-E1037 HydrophobicContact CD2-CB 4.21Å; L995-E1037 HydrophobicContact CD2-CG 4.17Å; L1033-E1037 HydrophobicContact CD1-CG 4.34Å; L1033-E1037 WeakPolarHBondContact O-CG 3.41Å; L1033-E1037 PolarHBondContact O-N 2.92Å; E1037-Y1040 PolarHBondContact O-N 3.2Å; E1037-S1041 WeakPolarHBondContact O-CB 3.03Å; E1037-S1041 PolarHBondContact O-N 3.03Å
1038	K	91.8	Very high	88.3	Confident	59 Å²	59	48.3 Å²	48.3	26%	0.257	24%	0.235	S	C	.	.	H	α-helix	trans	-64.8	-39.3	175.7	-76.6	172	173.7	172.7	0	111.5	V1027 D1028 A1029 E1034 A1036 S1041 K1042 M1060	V1027-K1038 HydrophobicContact CG2-CB 4.15Å; V1027-K1038 HydrophobicContact CG2-CD 3.87Å; D1028-K1038 PolarHBondContact O-NZ 3Å; A1029-K1038 HydrophobicContact CB-CD 4.24Å; E1034-K1038 HydrophobicContact CG-CD 4.04Å; E1034-K1038 VanDerWaalsContact O-CB 3.22Å; E1034-K1038 WeakPolarHBondContact O-CB 3.41Å; E1034-K1038 WeakPolarHBondContact O-CG 3.47Å; E1034-K1038 PolarHBondContact O-N 3.3Å; E1034-K1038 WeakPolarHBondContact OE1-CE 2.92Å; E1034-K1038 IonicContact OE1-NZ 2.65Å; E1034-K1038 PolarHBondContact OE1-NZ 2.91Å; A1036-K1038 VanDerWaalsContact C-N 3.31Å; A1036-K1038 PolarHBondContact O-N 3.17Å; K1038-S1041 PolarHBondContact O-N 2.04Å; K1038-S1041 PolarHBondContact O-OG 3.34Å; K1038-K1042 WeakPolarHBondContact O-CG 3.03Å; K1038-K1042 PolarHBondContact O-N 2.78Å; K1038-K1042 VanDerWaalsContact O-N 3.14Å; K1038-M1060 HydrophobicContact CB-CE 4.11Å
1039	C	92	Very high	88.2	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-62.8	-47.6	177.1	-176.7	0	0	0	0	112.2	C1035 A1036 S1041 K1042 K1043 C1044 A1047 M1060 V1091	C1035-C1039 VanDerWaalsContact O-CB 3.3Å; C1035-C1039 WeakPolarHBondContact O-CB 3.01Å; C1035-C1039 PolarHBondContact O-N 3.18Å; A1036-C1039 WeakPolarHBondContact O-CB 3.47Å; A1036-C1039 PolarHBondContact O-N 3.28Å; C1039-S1041 VanDerWaalsContact C-N 3.31Å; C1039-S1041 PolarHBondContact O-N 2.8Å; C1039-K1042 CarbonylContact O-C 3.55Å; C1039-K1042 WeakPolarHBondContact O-CA 3.28Å; C1039-K1042 PolarHBondContact O-N 3.33Å; C1039-K1043 PolarHBondContact O-N 2.82Å; C1039-C1044 WeakPolarHBondContact CA-SG 3.16Å; C1039-C1044 WeakPolarHBondContact CB-SG 3.31Å; C1039-C1044 PolarHBondContact O-N 2.88Å; C1039-C1044 VanDerWaalsContact O-N 3.11Å; C1039-C1044 PolarHBondContact O-SG 3.5Å; C1039-C1044 WeakPolarHBondContact SG-CB 3.17Å; C1039-C1044 PolarHBondContact SG-O 3.24Å; C1039-C1044 CovalentContact SG-SG 2.04Å; C1039-C1044 PolarHBondContact SG-SG 3.03Å; C1039-A1047 HydrophobicContact CB-CB 3.94Å; C1039-M1060 HydrophobicContact CB-CE 4.17Å; C1039-V1091 HydrophobicContact CB-CG1 4.46Å; C1039-V1091 HydrophobicContact CB-CG2 4.41Å
1040	Y	90.1	Very high	88	Confident	98 Å²	98	44.9 Å²	44.9	38%	0.384	22%	0.216	S	C	.	.	H	α-helix	trans	-56.3	-45.4	173.3	-177.7	-95.8	0	0	0	111.8	L995 A1036 E1037 K1042 K1043 C1093	L995-Y1040 HydrophobicContact CD1-CE1 4.36Å; A1036-Y1040 PolarHBondContact O-N 3.24Å; E1037-Y1040 PolarHBondContact O-N 3.2Å; Y1040-K1042 PolarHBondContact O-N 3.21Å; Y1040-K1042 VanDerWaalsContact O-N 3.1Å; Y1040-K1043 PolarHBondContact O-N 2.97Å; Y1040-C1093 WeakPolarHBondContact CB-SG 3.31Å; Y1040-C1093 HydrophobicContact CD1-CB 3.78Å; Y1040-C1093 HydrophobicContact CD2-CB 3.7Å; Y1040-C1093 VanDerWaalsContact CD2-N 3.29Å; Y1040-C1093 HydrophobicContact CE1-CB 3.95Å; Y1040-C1093 HydrophobicContact CE2-CB 3.84Å; Y1040-C1093 WeakPolarHBondContact CE2-O 3.45Å; Y1040-C1093 HydrophobicContact CG-CB 3.65Å; Y1040-C1093 PolarHBondContact OH-O 3.41Å
1041	S	90.7	Very high	87.8	Confident	79 Å²	79	40.3 Å²	40.3	55%	0.552	20%	0.202	S	C	*	.	H	α-helix	trans	-59.9	-23	177	85.5	0	0	0	0	113.9	E1037 K1038 C1039	E1037-S1041 WeakPolarHBondContact O-CB 3.03Å; E1037-S1041 PolarHBondContact O-N 3.03Å; K1038-S1041 PolarHBondContact O-N 2.04Å; K1038-S1041 PolarHBondContact O-OG 3.34Å; C1039-S1041 VanDerWaalsContact C-N 3.31Å; C1039-S1041 PolarHBondContact O-N 2.8Å
1042	K	89.8	Confident	87.5	Confident	102 Å²	102	44 Å²	44	44%	0.443	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	2.3	177	-62.1	-61.3	-176.4	177.5	0	113.7	M1025 K1038 C1039 Y1040 C1044 M1060	M1025-K1042 HydrophobicContact CE-CB 3.99Å; K1038-K1042 WeakPolarHBondContact O-CG 3.03Å; K1038-K1042 PolarHBondContact O-N 2.78Å; K1038-K1042 VanDerWaalsContact O-N 3.14Å; C1039-K1042 CarbonylContact O-C 3.55Å; C1039-K1042 WeakPolarHBondContact O-CA 3.28Å; C1039-K1042 PolarHBondContact O-N 3.33Å; Y1040-K1042 PolarHBondContact O-N 3.21Å; Y1040-K1042 VanDerWaalsContact O-N 3.1Å; K1042-C1044 VanDerWaalsContact C-N 3.32Å; K1042-C1044 PolarHBondContact O-N 3.35Å; K1042-M1060 HydrophobicContact CB-SD 3.65Å; K1042-M1060 HydrophobicContact CG-SD 3.61Å
1043	K	87.2	Confident	87.1	Confident	182 Å²	182	45.6 Å²	45.6	79%	0.791	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.3	36.3	-177.3	-52.7	-174.9	178.5	-172.9	0	114.1	C1039 Y1040	C1039-K1043 PolarHBondContact O-N 2.82Å; Y1040-K1043 PolarHBondContact O-N 2.97Å
1044	C	87.4	Confident	86.6	Confident	7 Å²	7	49.7 Å²	49.7	5%	0.047	26%	0.259	C	S	.	.			trans	-92.1	154	164.8	49.1	0	0	0	0	111.7	C1039 K1042 M1060 T1061 I1062	C1039-C1044 WeakPolarHBondContact CA-SG 3.16Å; C1039-C1044 WeakPolarHBondContact CB-SG 3.31Å; C1039-C1044 PolarHBondContact O-N 2.88Å; C1039-C1044 VanDerWaalsContact O-N 3.11Å; C1039-C1044 PolarHBondContact O-SG 3.5Å; C1039-C1044 WeakPolarHBondContact SG-CB 3.17Å; C1039-C1044 PolarHBondContact SG-O 3.24Å; C1039-C1044 CovalentContact SG-SG 2.04Å; C1039-C1044 PolarHBondContact SG-SG 3.03Å; K1042-C1044 VanDerWaalsContact C-N 3.32Å; K1042-C1044 PolarHBondContact O-N 3.35Å; C1044-M1060 HydrophobicContact CB-CB 4.41Å; C1044-M1060 VanDerWaalsContact SG-CB 3.51Å; C1044-T1061 WeakPolarHBondContact CB-O 3.48Å; C1044-I1062 HydrophobicContact CB-CG1 4.46Å
1045	S	80.4	Confident	86.2	Confident	31 Å²	31	52.5 Å²	52.5	22%	0.217	28%	0.275	C	S	.	.	S	Bend	trans	-102.2	-8.9	174.4	42.8	0	0	0	0	112.6	A1064 C1090	S1045-A1064 PolarHBondContact OG-O 3.38Å; S1045-C1090 PolarHBondContact O-N 3.22Å; S1045-C1090 VanDerWaalsContact O-N 3.16Å
1046	L	86.6	Confident	85.8	Confident	14 Å²	14	52.6 Å²	52.6	7%	0.073	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	129.1	-175	-169.5	71.2	0	0	0	110.6	F1023 T1061 A1064 L1087 I1088 D1089	F1023-L1046 HydrophobicContact CE1-CD2 4.42Å; F1023-L1046 HydrophobicContact CE1-CG 4.29Å; F1023-L1046 HydrophobicContact CZ-CD2 3.87Å; F1023-L1046 HydrophobicContact CZ-CG 4.14Å; L1046-T1061 HydrophobicContact CB-CG2 3.88Å; L1046-T1061 HydrophobicContact CD2-CG2 3.91Å; L1046-T1061 HydrophobicContact CG-CG2 4.27Å; L1046-T1061 PolarHBondContact O-N 2.94Å; L1046-A1064 HydrophobicContact CB-CB 3.69Å; L1046-A1064 HydrophobicContact CD2-CB 3.53Å; L1046-A1064 HydrophobicContact CG-CB 4.24Å; L1046-L1087 HydrophobicContact CD1-CD1 3.65Å; L1046-L1087 HydrophobicContact CD1-CD2 4.3Å; L1046-L1087 HydrophobicContact CD1-CG 3.94Å; L1046-L1087 HydrophobicContact CD2-CD1 4.44Å; L1046-L1087 HydrophobicContact CG-CD1 4.07Å; L1046-I1088 WeakPolarHBondContact CA-O 3.29Å; L1046-D1089 HydrophobicContact CD1-CB 3.54Å
1047	A	90.5	Very high	85.6	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	162.4	172.8	0	0	0	0	0	111.2	C1039 L1059 M1060 I1088	C1039-A1047 HydrophobicContact CB-CB 3.94Å; A1047-L1059 CarbonylContact C-O 3.23Å; A1047-L1059 WeakPolarHBondContact CA-O 3.26Å; A1047-L1059 WeakPolarHBondContact CB-O 3.38Å; A1047-M1060 HydrophobicContact CB-CB 4Å; A1047-I1088 HydrophobicContact CB-CB 4.34Å; A1047-I1088 PolarHBondContact N-O 2.91Å; A1047-I1088 PolarHBondContact O-N 3.01Å
1048	A	89	Confident	85.7	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	114.7	174.3	0	0	0	0	0	109.3	F1020 F1023 L1059 L1086	F1020-A1048 HydrophobicContact CD1-CB 4.21Å; F1020-A1048 HydrophobicContact CE1-CB 3.51Å; F1020-A1048 HydrophobicContact CE2-CB 4.49Å; F1020-A1048 HydrophobicContact CZ-CB 3.69Å; F1023-A1048 HydrophobicContact CD1-CB 4.46Å; F1023-A1048 HydrophobicContact CE1-CB 3.89Å; F1023-A1048 HydrophobicContact CZ-CB 4.25Å; A1048-L1059 HydrophobicContact CB-CB 4.42Å; A1048-L1059 PolarHBondContact N-O 3.12Å; A1048-L1059 PolarHBondContact O-N 2.71Å; A1048-L1086 CarbonylContact C-O 3.54Å; A1048-L1086 WeakPolarHBondContact CA-O 3.47Å
1049	Y	88.9	Confident	85.6	Confident	10 Å²	10	47.8 Å²	47.8	4%	0.039	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	144.5	178.5	174.9	-119.7	0	0	0	111.3	A1029 K1030 A1032 C1035 P1051 N1057 P1085 L1086	A1029-Y1049 WeakPolarHBondContact O-CE2 2.91Å; K1030-Y1049 PolarHBondContact O-OH 3.22Å; A1032-Y1049 HydrophobicContact CB-CD1 3.88Å; A1032-Y1049 HydrophobicContact CB-CG 4.4Å; C1035-Y1049 HydrophobicContact CB-CD2 4.26Å; C1035-Y1049 HydrophobicContact CB-CG 4.4Å; Y1049-P1051 HydrophobicContact CE1-CB 4.29Å; Y1049-P1051 HydrophobicContact CE1-CG 4.45Å; Y1049-N1057 CarbonylContact C-O 3.46Å; Y1049-N1057 VanDerWaalsContact CA-O 3.32Å; Y1049-N1057 WeakPolarHBondContact CA-O 3.41Å; Y1049-N1057 WeakPolarHBondContact CD2-O 3.41Å; Y1049-P1085 CarbonylContact O-C 3.56Å; Y1049-P1085 VanDerWaalsContact O-CA 3.22Å; Y1049-P1085 WeakPolarHBondContact O-CA 3.37Å; Y1049-P1085 WeakPolarHBondContact O-CB 3.27Å; Y1049-L1086 HydrophobicContact CD1-CD1 4.16Å; Y1049-L1086 HydrophobicContact CD1-CG 4.45Å; Y1049-L1086 PolarHBondContact N-O 2.99Å; Y1049-L1086 PolarHBondContact O-N 2.95Å
1050	S	85.8	Confident	85.4	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.007	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	129	164.6	179.3	0	0	0	0	113	L1052 G1056 N1057	S1050-L1052 PolarHBondContact O-N 2.89Å; S1050-L1052 WeakPolarHBondContact OG-CB 3.44Å; S1050-L1052 WeakPolarHBondContact OG-CG 3.38Å; S1050-L1052 PolarHBondContact OG-N 3.18Å; S1050-L1052 VanDerWaalsContact OG-N 3.16Å; S1050-G1056 WeakPolarHBondContact O-CA 3.25Å; S1050-N1057 PolarHBondContact N-O 2.84Å; S1050-N1057 PolarHBondContact O-N 2.91Å
1051	P	81	Confident	85.1	Confident	53 Å²	53	43.2 Å²	43.2	34%	0.344	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	3.9	171.8	35.1	-36.3	0	0	0	113.4	Y1049 T1053	Y1049-P1051 HydrophobicContact CE1-CB 4.29Å; Y1049-P1051 HydrophobicContact CE1-CG 4.45Å; P1051-T1053 PolarHBondContact O-N 2.03Å
1052	L	76.3	Confident	84.5	Confident	116 Å²	116	43.6 Å²	43.6	61%	0.607	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-2.1	179.4	-66.9	173.1	0	0	0	113.9	S1050 G1082	S1050-L1052 PolarHBondContact O-N 2.89Å; S1050-L1052 WeakPolarHBondContact OG-CB 3.44Å; S1050-L1052 WeakPolarHBondContact OG-CG 3.38Å; S1050-L1052 PolarHBondContact OG-N 3.18Å; S1050-L1052 VanDerWaalsContact OG-N 3.16Å; L1052-G1082 VanDerWaalsContact CD2-O 3.23Å; L1052-G1082 WeakPolarHBondContact CD2-O 3.49Å; L1052-G1082 WeakPolarHBondContact CG-O 3.48Å
1053	T	75.8	Confident	83.4	Confident	44 Å²	44	45.4 Å²	45.4	27%	0.27	24%	0.241	S	C	.	.	S	Bend	trans	-118.5	149.8	175.1	56.4	0	0	0	0	110.5	P1051 N1055 G1056 N1057	P1051-T1053 PolarHBondContact O-N 2.03Å; T1053-N1055 PolarHBondContact O-N 3.02Å; T1053-G1056 PolarHBondContact O-N 3.02Å; T1053-G1056 WeakPolarHBondContact OG1-CA 3.5Å; T1053-N1057 HydrophobicContact CG2-CB 4.48Å; T1053-N1057 WeakPolarHBondContact CG2-ND2 3.48Å; T1053-N1057 PolarHBondContact OG1-N 2.87Å
1054	P	75.1	Confident	82.3	Confident	140 Å²	140	37.9 Å²	37.9	91%	0.909	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-23.6	-169.7	-27.2	35.9	0	0	0	116.3
1055	N	79.5	Confident	80.8	Confident	96 Å²	96	43.8 Å²	43.8	51%	0.513	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-5.4	177.4	-63.9	-8.3	0	0	0	113	D1028 A1029 K1030 T1053	D1028-N1055 HydrophobicContact CB-CB 4.2Å; D1028-N1055 WeakPolarHBondContact OD2-CB 3.26Å; D1028-N1055 PolarHBondContact OD2-ND2 3.31Å; A1029-N1055 CarbonylContact C-O 3.42Å; A1029-N1055 VanDerWaalsContact C-O 3.23Å; A1029-N1055 VanDerWaalsContact O-O 3.07Å; K1030-N1055 WeakPolarHBondContact CA-O 3.35Å; K1030-N1055 PolarHBondContact N-O 2.98Å; T1053-N1055 PolarHBondContact O-N 3.02Å
1056	G	83.1	Confident	80	Confident	2 Å²	2	48.6 Å²	48.6	2%	0.021	26%	0.262	C	S	.	.			trans	69.5	137.7	-163.9	0	0	0	0	0	113.1	D1028 A1029 S1050 T1053	D1028-G1056 CarbonylContact C-O 3.59Å; D1028-G1056 VanDerWaalsContact CA-O 3.32Å; D1028-G1056 WeakPolarHBondContact CA-O 3.41Å; A1029-G1056 PolarHBondContact N-O 2.98Å; A1029-G1056 CarbonylContact O-C 3.31Å; A1029-G1056 VanDerWaalsContact O-C 3.29Å; A1029-G1056 WeakPolarHBondContact O-CA 3.28Å; S1050-G1056 WeakPolarHBondContact O-CA 3.25Å; T1053-G1056 PolarHBondContact O-N 3.02Å; T1053-G1056 WeakPolarHBondContact OG1-CA 3.5Å
1057	N	87.4	Confident	78.7	Confident	17 Å²	17	56.8 Å²	56.8	9%	0.091	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	129.6	-178.7	-103.1	-10.5	0	0	0	110.1	W1016 Q1026 Y1049 S1050 T1053	W1016-N1057 HydrophobicContact CZ2-CB 3.92Å; W1016-N1057 PolarHBondContact NE1-ND2 3.1Å; W1016-N1057 VanDerWaalsContact NE1-ND2 3.18Å; Q1026-N1057 VanDerWaalsContact NE2-CG 3.32Å; Q1026-N1057 PolarHBondContact NE2-ND2 3.39Å; Q1026-N1057 PolarHBondContact NE2-OD1 3.41Å; Y1049-N1057 CarbonylContact C-O 3.46Å; Y1049-N1057 VanDerWaalsContact CA-O 3.32Å; Y1049-N1057 WeakPolarHBondContact CA-O 3.41Å; Y1049-N1057 WeakPolarHBondContact CD2-O 3.41Å; S1050-N1057 PolarHBondContact N-O 2.84Å; S1050-N1057 PolarHBondContact O-N 2.91Å; T1053-N1057 HydrophobicContact CG2-CB 4.48Å; T1053-N1057 WeakPolarHBondContact CG2-ND2 3.48Å; T1053-N1057 PolarHBondContact OG1-N 2.87Å
1058	C	91.6	Very high	77.7	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	105.6	171.9	-177.3	0	0	0	0	109.6	Q1026 V1027 A1029 C1035	Q1026-C1058 WeakPolarHBondContact CA-O 3.35Å; V1027-C1058 HydrophobicContact CG2-CB 3.84Å; V1027-C1058 PolarHBondContact N-O 2.71Å; V1027-C1058 WeakPolarHBondContact O-CA 3.37Å; V1027-C1058 VanDerWaalsContact O-CB 3.3Å; V1027-C1058 WeakPolarHBondContact O-CB 3.22Å; V1027-C1058 PolarHBondContact O-N 3.07Å; A1029-C1058 HydrophobicContact CB-CB 3.74Å; C1035-C1058 WeakPolarHBondContact CA-SG 2.99Å; C1035-C1058 HydrophobicContact CB-CB 3.64Å; C1035-C1058 WeakPolarHBondContact CB-SG 2.98Å; C1035-C1058 PolarHBondContact O-SG 2.81Å; C1035-C1058 WeakPolarHBondContact SG-CB 3.23Å; C1035-C1058 CovalentContact SG-SG 2.03Å; C1035-C1058 PolarHBondContact SG-SG 3.3Å
1059	L	89.5	Confident	76.2	Confident	11 Å²	11	64.6 Å²	64.6	6%	0.058	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	147.6	167.5	-68.6	173.3	0	0	0	109.3	W1016 F1020 F1023 M1025 Q1026 A1047 A1048	W1016-L1059 HydrophobicContact CD2-CD1 4.37Å; W1016-L1059 VanDerWaalsContact CE2-CD1 3.48Å; W1016-L1059 HydrophobicContact CH2-CD1 4.35Å; W1016-L1059 HydrophobicContact CZ2-CD1 3.48Å; W1016-L1059 VanDerWaalsContact CZ2-CD1 3.48Å; W1016-L1059 HydrophobicContact CZ2-CG 3.75Å; F1020-L1059 HydrophobicContact CB-CD1 3.7Å; F1020-L1059 HydrophobicContact CD1-CD1 4.48Å; F1020-L1059 HydrophobicContact CD2-CD1 3.15Å; F1020-L1059 HydrophobicContact CE2-CD1 3.83Å; F1020-L1059 HydrophobicContact CG-CD1 3.56Å; F1023-L1059 HydrophobicContact CB-CB 4.05Å; F1023-L1059 HydrophobicContact CD1-CB 3.91Å; F1023-L1059 HydrophobicContact CG-CB 4.23Å; M1025-L1059 CarbonylContact O-C 3.29Å; M1025-L1059 WeakPolarHBondContact O-CA 2.99Å; Q1026-L1059 HydrophobicContact CB-CD2 3.72Å; Q1026-L1059 HydrophobicContact CG-CD2 3.82Å; A1047-L1059 CarbonylContact C-O 3.23Å; A1047-L1059 WeakPolarHBondContact CA-O 3.26Å; A1047-L1059 WeakPolarHBondContact CB-O 3.38Å; A1048-L1059 HydrophobicContact CB-CB 4.42Å; A1048-L1059 PolarHBondContact N-O 3.12Å; A1048-L1059 PolarHBondContact O-N 2.71Å
1060	M	88.6	Confident	74.6	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	154.6	-180	61.3	178.5	61.5	0	0	114.5	E1024 M1025 V1027 K1038 C1039 K1042 C1044 A1047	E1024-M1060 PolarHBondContact N-O 3.36Å; E1024-M1060 VanDerWaalsContact N-O 3.1Å; M1025-M1060 HydrophobicContact CB-CG 3.77Å; M1025-M1060 HydrophobicContact CB-SD 4.41Å; M1025-M1060 HydrophobicContact CE-CG 3.98Å; M1025-M1060 HydrophobicContact CE-SD 3.99Å; M1025-M1060 PolarHBondContact N-O 3.49Å; M1025-M1060 PolarHBondContact O-N 2.03Å; V1027-M1060 HydrophobicContact CG2-CE 3.69Å; K1038-M1060 HydrophobicContact CB-CE 4.11Å; C1039-M1060 HydrophobicContact CB-CE 4.17Å; K1042-M1060 HydrophobicContact CB-SD 3.65Å; K1042-M1060 HydrophobicContact CG-SD 3.61Å; C1044-M1060 HydrophobicContact CB-CB 4.41Å; C1044-M1060 VanDerWaalsContact SG-CB 3.51Å; A1047-M1060 HydrophobicContact CB-CB 4Å
1061	T	82.3	Confident	72.9	Confident	2 Å²	2	71.7 Å²	71.7	1%	0.012	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	132.5	-177.9	-171.3	0	0	0	0	113.4	D1022 F1023 C1044 L1046 K1063 A1064	D1022-T1061 WeakPolarHBondContact O-CB 3.42Å; D1022-T1061 PolarHBondContact O-OG1 2.59Å; F1023-T1061 HydrophobicContact CD1-CG2 4.29Å; F1023-T1061 HydrophobicContact CE1-CG2 4.24Å; F1023-T1061 HydrophobicContact CZ-CG2 4.48Å; C1044-T1061 WeakPolarHBondContact CB-O 3.48Å; L1046-T1061 HydrophobicContact CB-CG2 3.88Å; L1046-T1061 HydrophobicContact CD2-CG2 3.91Å; L1046-T1061 HydrophobicContact CG-CG2 4.27Å; L1046-T1061 PolarHBondContact O-N 2.94Å; T1061-K1063 PolarHBondContact OG1-N 3.34Å; T1061-A1064 HydrophobicContact CG2-CB 3.62Å
1062	I	79.2	Confident	71.5	Confident	87 Å²	87	71.9 Å²	71.9	45%	0.446	40%	0.403	S	S	.	.	S	Bend	trans	-82.2	-21.3	174.8	-58.6	168.3	0	0	0	110.4	M1025 C1044 A1064	M1025-I1062 HydrophobicContact CE-CD1 3.68Å; M1025-I1062 HydrophobicContact CE-CG1 3.74Å; C1044-I1062 HydrophobicContact CB-CG1 4.46Å; I1062-A1064 PolarHBondContact O-N 3.14Å
1063	K	66.6	Low	70.2	Confident	140 Å²	140	71.8 Å²	71.8	61%	0.609	40%	0.402	S	S	*	.	S	Bend	trans	-71.7	-22.2	-173.9	-73.5	166.8	166.4	161.2	0	114.6	E1024 T1061 T1065	E1024-K1063 HydrophobicContact CG-CD 4.35Å; E1024-K1063 WeakPolarHBondContact OE1-CE 3.49Å; E1024-K1063 IonicContact OE1-NZ 3.98Å; E1024-K1063 PolarHBondContact OE1-NZ 3.37Å; T1061-K1063 PolarHBondContact OG1-N 3.34Å; K1063-T1065 PolarHBondContact O-N 3.27Å
1064	A	62.8	Low	69	Low	24 Å²	24	73.7 Å²	73.7	20%	0.198	42%	0.418	C	S	.	.			trans	-83.3	73	-169.8	0	0	0	0	0	113.5	S1045 L1046 T1061 I1062 R1066	S1045-A1064 PolarHBondContact OG-O 3.38Å; L1046-A1064 HydrophobicContact CB-CB 3.69Å; L1046-A1064 HydrophobicContact CD2-CB 3.53Å; L1046-A1064 HydrophobicContact CG-CB 4.24Å; T1061-A1064 HydrophobicContact CG2-CB 3.62Å; I1062-A1064 PolarHBondContact O-N 3.14Å; A1064-R1066 PolarHBondContact O-N 3.34Å
1065	T	57.5	Low	68.1	Low	132 Å²	132	69 Å²	69	81%	0.81	39%	0.385	S	S	*	.			trans	-70.8	72.9	173.2	58.8	0	0	0	0	112	K1063	K1063-T1065 PolarHBondContact O-N 3.27Å
1066	R	62.5	Low	67	Low	132 Å²	132	66.9 Å²	66.9	50%	0.498	38%	0.376	S	S	.	.			trans	-71	144	163.1	-72.2	-171.4	174.9	-173.8	-2	109.3	A1064 D1089	A1064-R1066 PolarHBondContact O-N 3.34Å; R1066-D1089 IonicContact CZ-OD2 2.74Å; R1066-D1089 IonicContact NH1-OD2 3.4Å; R1066-D1089 PolarHBondContact NH1-OD2 3.05Å
1067	K	60.6	Low	65.8	Low	186 Å²	186	69.7 Å²	69.7	81%	0.809	39%	0.391	S	S	*	.			trans	-79.7	131.4	162.7	-71.3	-173	176.1	-174.1	0	108.3	D1069	K1067-D1069 PolarHBondContact O-N 3.19Å
1068	C	68.1	Low	64.6	Low	51 Å²	51	68.9 Å²	68.9	35%	0.345	39%	0.387	S	S	.	.			trans	-98.8	84.1	176.9	-64.4	0	0	0	0	108.4	G1070 C1090	C1068-G1070 PolarHBondContact O-N 3.23Å; C1068-C1090 WeakPolarHBondContact CA-SG 3.32Å; C1068-C1090 HydrophobicContact CB-CB 3.77Å; C1068-C1090 WeakPolarHBondContact CB-SG 3.3Å; C1068-C1090 WeakPolarHBondContact SG-CA 3.31Å; C1068-C1090 WeakPolarHBondContact SG-CB 3.3Å; C1068-C1090 CovalentContact SG-SG 2.03Å; C1068-C1090 PolarHBondContact SG-SG 3.38Å
1069	D	58.6	Low	63.1	Low	113 Å²	113	70.7 Å²	70.7	60%	0.604	40%	0.396	S	S	*	.			trans	-68.3	114.9	171.8	-63.4	-21.1	0	0	0	107	K1067 S1071 D1072	K1067-D1069 PolarHBondContact O-N 3.19Å; D1069-S1071 PolarHBondContact O-N 3.18Å; D1069-S1071 PolarHBondContact O-OG 3.23Å; D1069-D1072 PolarHBondContact O-N 3.12Å
1070	G	54.3	Low	61.7	Low	70 Å²	70	71.5 Å²	71.5	72%	0.722	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	11.3	-166.9	0	0	0	0	0	116.8	C1068 N1073	C1068-G1070 PolarHBondContact O-N 3.23Å; G1070-N1073 PolarHBondContact O-ND2 3.07Å
1071	S	50.2	Low	60.2	Low	89 Å²	89	74.6 Å²	74.6	62%	0.622	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-29.1	171.1	47.7	0	0	0	0	113.7	D1069 N1073	D1069-S1071 PolarHBondContact O-N 3.18Å; D1069-S1071 PolarHBondContact O-OG 3.23Å; S1071-N1073 PolarHBondContact O-N 2.86Å
1072	D	51.6	Low	59.1	Low	58 Å²	58	75.1 Å²	75.1	31%	0.31	43%	0.429	S	S	.	.			trans	-78.2	19.2	-162.6	-88.6	42.2	0	0	0	115.5	N1000 R1002 D1069 S1074	N1000-D1072 PolarHBondContact OD1-O 2.96Å; R1002-D1072 IonicContact CZ-OD2 3.16Å; R1002-D1072 IonicContact NH1-OD2 3.48Å; R1002-D1072 PolarHBondContact NH1-OD2 2.81Å; R1002-D1072 IonicContact NH2-OD2 3.63Å; R1002-D1072 PolarHBondContact NH2-OD2 3.09Å; D1069-D1072 PolarHBondContact O-N 3.12Å; D1072-S1074 PolarHBondContact O-N 2.84Å
1073	N	50.2	Low	58.4	Low	113 Å²	113	75.6 Å²	75.6	60%	0.604	44%	0.437	S	S	*	.			trans	-64.3	9.8	171.4	-77.7	-70.1	0	0	0	114.6	G1070 S1071 D1075	G1070-N1073 PolarHBondContact O-ND2 3.07Å; S1071-N1073 PolarHBondContact O-N 2.86Å; N1073-D1075 PolarHBondContact O-N 3.1Å
1074	S	49.9	Very low	58.5	Low	85 Å²	85	71.8 Å²	71.8	59%	0.594	42%	0.422	S	S	*	.			trans	-79.7	93.1	163.4	57.6	0	0	0	0	109	D1072 P1076	D1072-S1074 PolarHBondContact O-N 2.84Å; S1074-P1076 WeakPolarHBondContact O-CD 3.45Å
1075	D	56.2	Low	59.2	Low	40 Å²	40	71.1 Å²	71.1	21%	0.214	42%	0.416	C	S	.	.			trans	-53	111.3	160.8	-76.4	-50.6	0	0	0	107.3	R901 N1073	R901-D1075 IonicContact CZ-OD1 2.72Å; R901-D1075 IonicContact NE-OD2 2.78Å; R901-D1075 IonicContact NH2-OD1 3.16Å; R901-D1075 PolarHBondContact NH2-OD1 3.08Å; R901-D1075 IonicContact NH2-OD2 3.95Å; R901-D1075 PolarHBondContact NH2-OD2 3.43Å; R901-D1075 VanDerWaalsContact NH2-OD2 3.16Å; N1073-D1075 PolarHBondContact O-N 3.1Å
1076	P	56.5	Low	60.5	Low	52 Å²	52	65.2 Å²	65.2	34%	0.338	38%	0.379	S	S	.	.			trans	-75.3	172.6	-178.6	32.1	-31.9	0	0	0	109.5	I1001 R1002 S1074 V1078	I1001-P1076 WeakPolarHBondContact O-CD 3.42Å; I1001-P1076 WeakPolarHBondContact O-CG 3.28Å; R1002-P1076 HydrophobicContact CG-CG 4.3Å; S1074-P1076 WeakPolarHBondContact O-CD 3.45Å; P1076-V1078 VanDerWaalsContact C-N 3.31Å; P1076-V1078 HydrophobicContact CG-CG2 3.86Å; P1076-V1078 WeakPolarHBondContact O-CG2 3.32Å; P1076-V1078 PolarHBondContact O-N 3.47Å
1077	N	57.6	Low	61.6	Low	61 Å²	61	59.7 Å²	59.7	33%	0.326	36%	0.36	S	S	.	.			trans	-73.4	85.1	177.8	-156.5	9	0	0	0	110.5	S976	S976-N1077 VanDerWaalsContact CB-OD1 3.24Å; S976-N1077 WeakPolarHBondContact CB-OD1 3.29Å; S976-N1077 PolarHBondContact OG-OD1 3.15Å
1078	V	62.2	Low	62.9	Low	1 Å²	1	50.8 Å²	50.8	1%	0.006	32%	0.321	C	S	.	.			trans	-84.8	130.3	-173.1	177.9	0	0	0	0	111.5	E974 S976 I1001 N1003 P1076 T1080 L1086	E974-V1078 HydrophobicContact CG-CB 4.19Å; S976-V1078 WeakPolarHBondContact CB-O 3.11Å; S976-V1078 PolarHBondContact N-O 3.09Å; I1001-V1078 HydrophobicContact CB-CG2 4.13Å; I1001-V1078 HydrophobicContact CG2-CG1 3.86Å; I1001-V1078 HydrophobicContact CG2-CG2 4.12Å; I1001-V1078 VanDerWaalsContact O-CG2 3.29Å; I1001-V1078 WeakPolarHBondContact O-CG2 3.45Å; N1003-V1078 WeakPolarHBondContact OD1-CA 3.35Å; N1003-V1078 WeakPolarHBondContact OD1-CG1 3.32Å; P1076-V1078 VanDerWaalsContact C-N 3.31Å; P1076-V1078 HydrophobicContact CG-CG2 3.86Å; P1076-V1078 WeakPolarHBondContact O-CG2 3.32Å; P1076-V1078 PolarHBondContact O-N 3.47Å; V1078-T1080 HydrophobicContact CB-CG2 4.22Å; V1078-T1080 HydrophobicContact CG1-CG2 3.66Å; V1078-T1080 PolarHBondContact O-N 2.9Å; V1078-L1086 HydrophobicContact CG1-CD1 4.39Å; V1078-L1086 HydrophobicContact CG1-CD2 3.55Å; V1078-L1086 HydrophobicContact CG1-CG 4.49Å
1079	D	61.2	Low	63.8	Low	37 Å²	37	48.5 Å²	48.5	20%	0.198	31%	0.306	C	S	.	.			trans	-74.9	85.6	173.5	-178.9	11.7	0	0	0	111.1	N1003 S1081	N1003-D1079 WeakPolarHBondContact ND2-CB 3.4Å; N1003-D1079 PolarHBondContact OD1-N 3.26Å; D1079-S1081 VanDerWaalsContact C-N 3.27Å; D1079-S1081 WeakPolarHBondContact OD1-CB 3.22Å; D1079-S1081 PolarHBondContact OD1-N 2.92Å; D1079-S1081 PolarHBondContact OD1-OG 3.47Å; D1079-S1081 PolarHBondContact OD2-OG 3.03Å
1080	T	58.5	Low	64.9	Low	28 Å²	28	44 Å²	44	17%	0.172	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	20.4	172.5	71.9	0	0	0	0	113	E974 H975 V1078 G1082 L1086	E974-T1080 VanDerWaalsContact O-CG2 3.31Å; E974-T1080 WeakPolarHBondContact O-CG2 3.36Å; E974-T1080 PolarHBondContact O-OG1 3.31Å; H975-T1080 WeakPolarHBondContact CA-OG1 3.46Å; H975-T1080 PolarHBondContact ND1-OG1 3.02Å; V1078-T1080 HydrophobicContact CB-CG2 4.22Å; V1078-T1080 HydrophobicContact CG1-CG2 3.66Å; V1078-T1080 PolarHBondContact O-N 2.9Å; T1080-G1082 PolarHBondContact O-N 2.97Å; T1080-G1082 VanDerWaalsContact O-N 3.09Å; T1080-L1086 HydrophobicContact CG2-CD1 3.7Å; T1080-L1086 HydrophobicContact CG2-CD2 4.35Å
1081	S	57	Low	66.3	Low	65 Å²	65	41.2 Å²	41.2	46%	0.455	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-13.9	168.2	69.4	0	0	0	0	113.6	D1079 T1083	D1079-S1081 VanDerWaalsContact C-N 3.27Å; D1079-S1081 WeakPolarHBondContact OD1-CB 3.22Å; D1079-S1081 PolarHBondContact OD1-N 2.92Å; D1079-S1081 PolarHBondContact OD1-OG 3.47Å; D1079-S1081 PolarHBondContact OD2-OG 3.03Å; S1081-T1083 PolarHBondContact OG-N 3.28Å; S1081-T1083 PolarHBondContact OG-OG1 2.95Å
1082	G	59.6	Low	67.9	Low	13 Å²	13	43 Å²	43	13%	0.134	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.6	-2.3	-177.5	0	0	0	0	0	114.3	L1052 T1080 L1084	L1052-G1082 VanDerWaalsContact CD2-O 3.23Å; L1052-G1082 WeakPolarHBondContact CD2-O 3.49Å; L1052-G1082 WeakPolarHBondContact CG-O 3.48Å; T1080-G1082 PolarHBondContact O-N 2.97Å; T1080-G1082 VanDerWaalsContact O-N 3.09Å; G1082-L1084 VanDerWaalsContact C-N 3.31Å; G1082-L1084 PolarHBondContact O-N 3.45Å
1083	T	65.4	Low	69.3	Low	98 Å²	98	40.8 Å²	40.8	60%	0.601	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-31.3	178	-49.5	0	0	0	0	112.6	S1081	S1081-T1083 PolarHBondContact OG-N 3.28Å; S1081-T1083 PolarHBondContact OG-OG1 2.95Å
1084	L	68.4	Low	70.5	Confident	59 Å²	59	40.9 Å²	40.9	31%	0.309	26%	0.256	S	S	.	.	S	Bend	trans	-122.5	147.4	-178.7	-66.7	175	0	0	0	111.8	N1003 G1082	N1003-L1084 HydrophobicContact CB-CD1 4.39Å; G1082-L1084 VanDerWaalsContact C-N 3.31Å; G1082-L1084 PolarHBondContact O-N 3.45Å
1085	P	76.9	Confident	71.5	Confident	11 Å²	11	38.7 Å²	38.7	7%	0.071	24%	0.239	C	C	.	.			trans	-62.6	148.3	165.1	17.9	-23	0	0	0	112.4	Y1004 W1016 F1020 Y1049	Y1004-P1085 WeakPolarHBondContact CB-O 3.37Å; Y1004-P1085 HydrophobicContact CD1-CG 4.18Å; Y1004-P1085 PolarHBondContact N-O 2.94Å; W1016-P1085 HydrophobicContact CH2-CB 3.94Å; W1016-P1085 HydrophobicContact CZ3-CB 3.79Å; W1016-P1085 HydrophobicContact CZ3-CG 4.11Å; F1020-P1085 HydrophobicContact CZ-CB 4.12Å; F1020-P1085 HydrophobicContact CZ-CG 4.16Å; Y1049-P1085 CarbonylContact O-C 3.56Å; Y1049-P1085 VanDerWaalsContact O-CA 3.22Å; Y1049-P1085 WeakPolarHBondContact O-CA 3.37Å; Y1049-P1085 WeakPolarHBondContact O-CB 3.27Å
1086	L	84.7	Confident	72.4	Confident	7 Å²	7	38.6 Å²	38.6	4%	0.037	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	115.6	178.3	-49.9	-171.9	0	0	0	109.2	I1001 R1002 A1032 A1048 Y1049 V1078 T1080	I1001-L1086 HydrophobicContact CG2-CB 3.86Å; I1001-L1086 HydrophobicContact CG2-CD1 4.06Å; I1001-L1086 HydrophobicContact CG2-CG 4.44Å; R1002-L1086 CarbonylContact O-C 3.59Å; A1032-L1086 HydrophobicContact CB-CD1 4.34Å; A1048-L1086 CarbonylContact C-O 3.54Å; A1048-L1086 WeakPolarHBondContact CA-O 3.47Å; Y1049-L1086 HydrophobicContact CD1-CD1 4.16Å; Y1049-L1086 HydrophobicContact CD1-CG 4.45Å; Y1049-L1086 PolarHBondContact N-O 2.99Å; Y1049-L1086 PolarHBondContact O-N 2.95Å; V1078-L1086 HydrophobicContact CG1-CD1 4.39Å; V1078-L1086 HydrophobicContact CG1-CD2 3.55Å; V1078-L1086 HydrophobicContact CG1-CG 4.49Å; T1080-L1086 HydrophobicContact CG2-CD1 3.7Å; T1080-L1086 HydrophobicContact CG2-CD2 4.35Å
1087	L	86.9	Confident	73.2	Confident	16 Å²	16	37.9 Å²	37.9	8%	0.084	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	127.6	168	-167.4	63.7	0	0	0	108.8	I1001 R1002 Y1004 F1023 L1046	I1001-L1087 CarbonylContact C-O 3.55Å; I1001-L1087 WeakPolarHBondContact CA-O 3.39Å; R1002-L1087 PolarHBondContact N-O 3.32Å; R1002-L1087 PolarHBondContact O-N 2.94Å; Y1004-L1087 HydrophobicContact CD2-CB 4.21Å; Y1004-L1087 HydrophobicContact CD2-CD1 3.83Å; Y1004-L1087 HydrophobicContact CD2-CD2 4.27Å; Y1004-L1087 HydrophobicContact CD2-CG 4.33Å; Y1004-L1087 HydrophobicContact CE2-CD1 4.4Å; F1023-L1087 HydrophobicContact CZ-CD1 4.19Å; L1046-L1087 HydrophobicContact CD1-CD1 3.65Å; L1046-L1087 HydrophobicContact CD1-CD2 4.3Å; L1046-L1087 HydrophobicContact CD1-CG 3.94Å; L1046-L1087 HydrophobicContact CD2-CD1 4.44Å; L1046-L1087 HydrophobicContact CG-CD1 4.07Å
1088	I	87.1	Confident	74.2	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	113.8	176.8	-57.8	178.5	0	0	0	106.8	F999 N1000 A1032 C1035 A1036 L1046 A1047 V1091	F999-I1088 HydrophobicContact CB-CG2 3.86Å; F999-I1088 HydrophobicContact CD2-CG2 3.73Å; F999-I1088 HydrophobicContact CG-CG2 4Å; N1000-I1088 WeakPolarHBondContact O-CA 3.3Å; A1032-I1088 HydrophobicContact CB-CD1 4.05Å; A1032-I1088 VanDerWaalsContact O-CD1 3.25Å; A1032-I1088 WeakPolarHBondContact O-CD1 3.45Å; C1035-I1088 HydrophobicContact CB-CD1 3.87Å; A1036-I1088 HydrophobicContact CB-CG2 4.09Å; L1046-I1088 WeakPolarHBondContact CA-O 3.29Å; A1047-I1088 HydrophobicContact CB-CB 4.34Å; A1047-I1088 PolarHBondContact N-O 2.91Å; A1047-I1088 PolarHBondContact O-N 3.01Å; I1088-V1091 HydrophobicContact CG2-CG2 3.66Å
1089	D	86.5	Confident	74.9	Confident	3 Å²	3	38.8 Å²	38.8	2%	0.016	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	163.3	176.5	73.8	16	0	0	0	113.2	F999 N1000 R1002 L1046 R1066 V1091	F999-D1089 WeakPolarHBondContact CA-O 3.28Å; N1000-D1089 WeakPolarHBondContact CB-OD1 3.44Å; N1000-D1089 PolarHBondContact N-O 3.34Å; N1000-D1089 PolarHBondContact ND2-OD1 2.99Å; N1000-D1089 PolarHBondContact O-N 3.42Å; N1000-D1089 VanDerWaalsContact O-N 3.08Å; R1002-D1089 IonicContact NE-OD1 3.59Å; R1002-D1089 IonicContact NE-OD2 3.92Å; R1002-D1089 IonicContact NH2-OD1 2.79Å; L1046-D1089 HydrophobicContact CD1-CB 3.54Å; R1066-D1089 IonicContact CZ-OD2 2.74Å; R1066-D1089 IonicContact NH1-OD2 3.4Å; R1066-D1089 PolarHBondContact NH1-OD2 3.05Å; D1089-V1091 PolarHBondContact O-N 2.95Å
1090	C	82.2	Confident	75.8	Confident	18 Å²	18	38.9 Å²	38.9	12%	0.122	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	58.2	45.8	-178	-65.3	0	0	0	0	114.1	F999 S1045 C1068 E1092	F999-C1090 WeakPolarHBondContact CA-O 3.5Å; S1045-C1090 PolarHBondContact O-N 3.22Å; S1045-C1090 VanDerWaalsContact O-N 3.16Å; C1068-C1090 WeakPolarHBondContact CA-SG 3.32Å; C1068-C1090 HydrophobicContact CB-CB 3.77Å; C1068-C1090 WeakPolarHBondContact CB-SG 3.3Å; C1068-C1090 WeakPolarHBondContact SG-CA 3.31Å; C1068-C1090 WeakPolarHBondContact SG-CB 3.3Å; C1068-C1090 CovalentContact SG-SG 2.03Å; C1068-C1090 PolarHBondContact SG-SG 3.38Å; C1090-E1092 PolarHBondContact O-N 3.18Å; C1090-E1092 VanDerWaalsContact O-N 3.17Å
1091	V	84.1	Confident	77	Confident	12 Å²	12	39.6 Å²	39.6	7%	0.073	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	105.4	177.3	-173.6	0	0	0	0	111	S998 F999 A1036 C1039 I1088 D1089	S998-V1091 WeakPolarHBondContact O-CA 3.32Å; F999-V1091 HydrophobicContact CB-CG2 4.06Å; A1036-V1091 HydrophobicContact CB-CG1 4.29Å; A1036-V1091 VanDerWaalsContact O-CG1 3.31Å; A1036-V1091 WeakPolarHBondContact O-CG1 3.36Å; C1039-V1091 HydrophobicContact CB-CG1 4.46Å; C1039-V1091 HydrophobicContact CB-CG2 4.41Å; I1088-V1091 HydrophobicContact CG2-CG2 3.66Å; D1089-V1091 PolarHBondContact O-N 2.95Å
1092	E	83.2	Confident	78.6	Confident	125 Å²	125	37.7 Å²	37.7	58%	0.584	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-128.2	114.9	175.3	-66.4	-175.6	175.1	0	0	109.1	S998 C1090	S998-E1092 WeakPolarHBondContact CA-O 3.43Å; S998-E1092 WeakPolarHBondContact CB-O 3.43Å; S998-E1092 PolarHBondContact N-O 3.32Å; S998-E1092 PolarHBondContact O-N 3.13Å; C1090-E1092 PolarHBondContact O-N 3.18Å; C1090-E1092 VanDerWaalsContact O-N 3.17Å
1093	C	81.7	Confident	80.2	Confident	12 Å²	12	39.8 Å²	39.8	8%	0.081	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	152.8	174.6	-44.5	0	0	0	0	112	L995 E996 C997 Y1040	L995-C1093 HydrophobicContact CD1-CB 3.98Å; L995-C1093 HydrophobicContact CD2-CB 4.31Å; L995-C1093 HydrophobicContact CG-CB 3.8Å; E996-C1093 WeakPolarHBondContact O-CA 3.44Å; C997-C1093 WeakPolarHBondContact CA-SG 3.48Å; C997-C1093 HydrophobicContact CB-CB 4Å; C997-C1093 WeakPolarHBondContact CB-SG 3.38Å; C997-C1093 WeakPolarHBondContact SG-CB 3.32Å; C997-C1093 CovalentContact SG-SG 2.04Å; C997-C1093 PolarHBondContact SG-SG 2.88Å; Y1040-C1093 WeakPolarHBondContact CB-SG 3.31Å; Y1040-C1093 HydrophobicContact CD1-CB 3.78Å; Y1040-C1093 HydrophobicContact CD2-CB 3.7Å; Y1040-C1093 VanDerWaalsContact CD2-N 3.29Å; Y1040-C1093 HydrophobicContact CE1-CB 3.95Å; Y1040-C1093 HydrophobicContact CE2-CB 3.84Å; Y1040-C1093 WeakPolarHBondContact CE2-O 3.45Å; Y1040-C1093 HydrophobicContact CG-CB 3.65Å; Y1040-C1093 PolarHBondContact OH-O 3.41Å
1094	A	75	Confident	81.5	Confident	116 Å²	116	34.5 Å²	34.5	96%	0.959	21%	0.212	S	C	*	.			trans	-122.1	0	175.6	0	0	0	0	0	112.1	L995 E996	L995-A1094 CarbonylContact C-O 3.35Å; E996-A1094 HydrophobicContact CB-CB 4.46Å; E996-A1094 PolarHBondContact N-O 2.56Å; E996-A1094 PolarHBondContact O-N 3.16Å

Retrieved 1,094 of 1,094 residues in 615.1 ms (Link to these results)

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