A0A077YZC0_TRITR Loading...

Splicing factor, arginine:serine rich 6

AlphaFold DB , UniProt , Accession A0A077YZC0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 106 aa.

						>A0A077YZC0_TRITR|A0A077YZC0
MAYRDSCPPDCKVFVGGLPEGANRNELEDIFRQYGQLRNVWVARRPPGFAFVEFEDPRDALDSVRNLDGTKMFGVRVRVELSHGRRRNRGPPGRYDGKYTNDSKRR
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.1	Very low	48.4	Very low	217 Å²	217	94 Å²	94	100%	1.069	51%	0.51	S	S	*	.				0	127.8	0	-73.8	165.5	170.8	0	0	108.1	Y3	M1-Y3 HydrophobicContact CB-CE2 3.94Å; M1-Y3 PolarHBondContact O-N 2.99Å
2	A	41.2	Very low	51.3	Low	89 Å²	89	92 Å²	92	74%	0.736	49%	0.492	S	S	*	.			trans	-80.1	112.2	-176.6	0	0	0	0	0	110.2
3	Y	41	Very low	54	Low	187 Å²	187	84.9 Å²	84.9	73%	0.733	46%	0.455	S	S	*	.			trans	-133.5	73.1	153.6	-45.9	-77	0	0	0	107.6	M1 D5	M1-Y3 HydrophobicContact CB-CE2 3.94Å; M1-Y3 PolarHBondContact O-N 2.99Å; Y3-D5 PolarHBondContact O-N 3.09Å
4	R	42.7	Very low	56.4	Low	133 Å²	133	82.6 Å²	82.6	50%	0.502	44%	0.439	S	S	.	.			trans	-68.1	36.5	147.8	-68.7	163	55.7	163.2	7.1	109.9	S6 P91 P92	R4-S6 WeakPolarHBondContact O-CB 2.89Å; R4-S6 PolarHBondContact O-N 2.92Å; R4-P91 VanDerWaalsContact NH2-C 3.28Å; R4-P91 VanDerWaalsContact NH2-CB 3.27Å; R4-P92 HydrophobicContact CG-CG 3.69Å; R4-P92 VanDerWaalsContact CZ-C 3.48Å; R4-P92 VanDerWaalsContact NE-CD 3.25Å; R4-P92 PolarHBondContact NH1-O 3Å; R4-P92 VanDerWaalsContact NH2-N 3.14Å; R4-P92 PolarHBondContact NH2-O 3.25Å
5	D	48.3	Very low	58.5	Low	79 Å²	79	77.2 Å²	77.2	42%	0.422	41%	0.41	S	S	.	.			trans	-81.5	73.6	173.7	-147.5	-104.2	0	0	0	104.6	Y3 C7 R65	Y3-D5 PolarHBondContact O-N 3.09Å; D5-C7 PolarHBondContact O-N 2.74Å; D5-C7 VanDerWaalsContact O-N 3.13Å; D5-R65 IonicContact OD1-NH2 3.81Å
6	S	47.7	Very low	60.3	Low	72 Å²	72	72.8 Å²	72.8	50%	0.503	39%	0.388	S	S	.	.				53.3	40.4	93.9	65.8	0	0	0	0	112.8	R4 P8	R4-S6 WeakPolarHBondContact O-CB 2.89Å; R4-S6 PolarHBondContact O-N 2.92Å; S6-P8 VanDerWaalsContact C-CD 3.43Å; S6-P8 WeakPolarHBondContact O-CD 3.15Å
7	C	41.9	Very low	61.6	Low	64 Å²	64	71.2 Å²	71.2	43%	0.432	39%	0.394	S	S	.	.			trans	-82.8	92.6	155.5	-69.1	0	0	0	0	109.3	D5	D5-C7 PolarHBondContact O-N 2.74Å; D5-C7 VanDerWaalsContact O-N 3.13Å
8	P	51.9	Low	62.7	Low	26 Å²	26	68.1 Å²	68.1	17%	0.169	38%	0.376	C	S	.	.			trans	-59.7	139.3	163.7	29	-36	0	0	0	109	S6 D10	S6-P8 VanDerWaalsContact C-CD 3.43Å; S6-P8 WeakPolarHBondContact O-CD 3.15Å; P8-D10 PolarHBondContact O-N 3.23Å
9	P	55.5	Low	63.5	Low	101 Å²	101	67.3 Å²	67.3	66%	0.656	37%	0.374	S	S	*	.	S	Bend	trans	-71.6	12.1	178.3	30.8	-36.2	0	0	0	114.1
10	D	59.2	Low	63.9	Low	45 Å²	45	73.3 Å²	73.3	24%	0.241	40%	0.399	C	S	.	.			trans	-107	105.4	175.1	-69.4	-83.9	0	0	0	107.4	P8 K12	P8-D10 PolarHBondContact O-N 3.23Å; D10-K12 PolarHBondContact O-N 3.38Å
11	C	73.1	Confident	64.2	Low	21 Å²	21	72.5 Å²	72.5	14%	0.142	41%	0.408	C	S	.	.			trans	-67	28.7	174.8	-51.7	0	0	0	0	112.4	E53 F54 E55 P57	C11-E53 CarbonylContact O-C 3.51Å; C11-E53 WeakPolarHBondContact O-CA 3.08Å; C11-F54 HydrophobicContact CB-CB 3.9Å; C11-F54 WeakPolarHBondContact CB-O 3.37Å; C11-F54 PolarHBondContact O-N 2.99Å; C11-E55 PolarHBondContact SG-O 3.39Å; C11-P57 VanDerWaalsContact SG-CD 3.56Å
12	K	82.7	Confident	66.2	Low	70 Å²	70	63.3 Å²	63.3	30%	0.304	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	131.7	-172.4	-167.3	170.5	-70.1	178.7	0	110	D10 F51 V52 E53 S82	D10-K12 PolarHBondContact O-N 3.38Å; K12-F51 HydrophobicContact CD-CD1 4.05Å; K12-F51 HydrophobicContact CG-CD1 4.13Å; K12-V52 CarbonylContact C-O 3.38Å; K12-V52 WeakPolarHBondContact CA-O 3.2Å; K12-E53 WeakPolarHBondContact CE-OE2 3.35Å; K12-E53 IonicContact NZ-OE2 3.59Å; K12-S82 WeakPolarHBondContact O-CA 3.21Å; K12-S82 WeakPolarHBondContact O-CB 3.11Å; K12-S82 PolarHBondContact O-N 3.35Å
13	V	87	Confident	68	Low	0 Å²	0	63 Å²	63	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	128.6	-178.8	174.5	0	0	0	0	107.4	V15 F31 F51 V52 F54 A60 V64 V79 E80 L81	V13-V15 HydrophobicContact CG1-CG2 4.19Å; V13-F31 HydrophobicContact CG1-CE1 3.86Å; V13-F31 HydrophobicContact CG1-CZ 4.15Å; V13-F51 CarbonylContact O-C 3.49Å; V13-F51 VanDerWaalsContact O-CA 3.22Å; V13-F51 WeakPolarHBondContact O-CA 3.42Å; V13-V52 HydrophobicContact CB-CB 4.23Å; V13-V52 WeakPolarHBondContact CB-O 3.49Å; V13-V52 PolarHBondContact N-O 2.78Å; V13-V52 PolarHBondContact O-N 2.69Å; V13-F54 HydrophobicContact CG2-CD2 3.72Å; V13-F54 HydrophobicContact CG2-CE2 3.87Å; V13-A60 HydrophobicContact CG2-CB 3.96Å; V13-V64 HydrophobicContact CB-CG2 4.17Å; V13-V64 HydrophobicContact CG1-CG2 3.59Å; V13-V64 HydrophobicContact CG2-CG2 3.61Å; V13-V79 HydrophobicContact CG1-CG1 3.35Å; V13-E80 CarbonylContact C-O 3.57Å; V13-E80 WeakPolarHBondContact CA-O 3.48Å; V13-L81 HydrophobicContact CG2-CD2 4.25Å
14	F	87.8	Confident	70.1	Confident	53 Å²	53	60.5 Å²	60.5	23%	0.232	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	136.5	169.9	172.1	-97.3	0	0	0	109.4	F49 F51 V79 E80	F14-F49 HydrophobicContact CE2-CB 3.75Å; F14-F49 HydrophobicContact CE2-CD2 4.08Å; F14-F49 HydrophobicContact CE2-CG 4.25Å; F14-F49 HydrophobicContact CZ-CB 3.96Å; F14-F51 HydrophobicContact CB-CD1 4.35Å; F14-F51 HydrophobicContact CB-CE1 4.17Å; F14-F51 HydrophobicContact CD2-CD1 4.3Å; F14-F51 AromaticContact CD2-CE1 3.74Å; F14-F51 HydrophobicContact CD2-CE1 3.74Å; F14-F51 HydrophobicContact CD2-CE2 4.04Å; F14-F51 AromaticContact CD2-CZ 3.63Å; F14-F51 HydrophobicContact CD2-CZ 3.63Å; F14-F51 HydrophobicContact CE2-CE2 4.4Å; F14-F51 HydrophobicContact CE2-CZ 4.22Å; F14-F51 HydrophobicContact CG-CE1 4.45Å; F14-V79 CarbonylContact O-C 3.44Å; F14-V79 WeakPolarHBondContact O-CA 3.16Å; F14-E80 HydrophobicContact CB-CB 4.42Å; F14-E80 HydrophobicContact CD1-CB 4.25Å; F14-E80 PolarHBondContact N-O 3.07Å; F14-E80 PolarHBondContact O-N 3.5Å
15	V	87.6	Confident	72.1	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.006	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	116.6	177.2	-170.8	0	0	0	0	108.6	V13 L18 L27 F31 F49 A50 V52 R78 V79	V13-V15 HydrophobicContact CG1-CG2 4.19Å; V15-L18 HydrophobicContact CB-CD1 4.44Å; V15-L18 HydrophobicContact CG1-CD1 4.04Å; V15-L18 HydrophobicContact CG1-CD2 4.21Å; V15-L18 HydrophobicContact CG1-CG 4.16Å; V15-L27 HydrophobicContact CB-CD2 4.24Å; V15-L27 HydrophobicContact CG1-CD2 3.72Å; V15-L27 HydrophobicContact CG2-CD2 4.25Å; V15-F31 HydrophobicContact CG2-CE2 3.65Å; V15-F31 HydrophobicContact CG2-CZ 3.46Å; V15-F31 VanDerWaalsContact CG2-CZ 3.46Å; V15-F49 CarbonylContact O-C 3.55Å; V15-F49 WeakPolarHBondContact O-CA 3.46Å; V15-A50 HydrophobicContact CB-CB 4.34Å; V15-A50 PolarHBondContact N-O 3.34Å; V15-A50 PolarHBondContact O-N 2.82Å; V15-V52 HydrophobicContact CG2-CG2 4.17Å; V15-R78 CarbonylContact C-O 3.43Å; V15-R78 VanDerWaalsContact CA-O 3.31Å; V15-R78 WeakPolarHBondContact CA-O 3.4Å; V15-V79 HydrophobicContact CG1-CG2 4.29Å; V15-V79 HydrophobicContact CG2-CG1 4.48Å
16	G	86.9	Confident	73.8	Confident	6 Å²	6	56.9 Å²	56.9	6%	0.062	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	171.7	177.6	0	0	0	0	0	112.5	L18 G48 V77 R78	G16-L18 VanDerWaalsContact C-N 3.33Å; G16-G48 CarbonylContact C-O 3.51Å; G16-G48 WeakPolarHBondContact CA-O 3.41Å; G16-V77 CarbonylContact O-C 3.51Å; G16-V77 WeakPolarHBondContact O-CA 3.36Å; G16-R78 PolarHBondContact N-O 2.94Å; G16-R78 PolarHBondContact O-N 3.44Å
17	G	83.3	Confident	75.6	Confident	47 Å²	47	53.9 Å²	53.9	49%	0.485	31%	0.309	S	S	.	.			trans	78.8	19.2	179.3	0	0	0	0	0	113.7	G48	G17-G48 PolarHBondContact N-O 2.83Å; G17-G48 VanDerWaalsContact N-O 3.09Å
18	L	81.7	Confident	77.8	Confident	15 Å²	15	54.2 Å²	54.2	8%	0.079	30%	0.304	C	S	.	.			trans	-79.3	141.9	178.8	-70.7	173.9	0	0	0	110.8	V15 G16 A22 L27 G48 A50 V77	V15-L18 HydrophobicContact CB-CD1 4.44Å; V15-L18 HydrophobicContact CG1-CD1 4.04Å; V15-L18 HydrophobicContact CG1-CD2 4.21Å; V15-L18 HydrophobicContact CG1-CG 4.16Å; G16-L18 VanDerWaalsContact C-N 3.33Å; L18-A22 HydrophobicContact CB-CB 3.5Å; L18-A22 VanDerWaalsContact CB-CB 3.5Å; L18-A22 HydrophobicContact CD1-CB 4.05Å; L18-A22 HydrophobicContact CD2-CB 3.92Å; L18-A22 HydrophobicContact CG-CB 4.01Å; L18-L27 HydrophobicContact CD1-CD1 3.84Å; L18-L27 HydrophobicContact CD1-CD2 4.32Å; L18-L27 HydrophobicContact CD2-CD2 4.2Å; L18-G48 PolarHBondContact N-O 3.27Å; L18-G48 WeakPolarHBondContact O-CA 3.35Å; L18-A50 HydrophobicContact CD1-CB 3.67Å; L18-V77 HydrophobicContact CD2-CG1 3.73Å
19	P	76.2	Confident	79.5	Confident	52 Å²	52	58 Å²	58	34%	0.338	32%	0.323	S	S	.	.			trans	-67.1	165	173.9	30	-36.6	0	0	0	110.8	G21 A22 V75	P19-G21 PolarHBondContact O-N 2.81Å; P19-A22 HydrophobicContact CG-CB 4.3Å; P19-A22 WeakPolarHBondContact O-CB 3Å; P19-A22 PolarHBondContact O-N 2.77Å; P19-V75 HydrophobicContact CG-CG2 4.48Å
20	E	71.7	Confident	80.9	Confident	188 Å²	188	55 Å²	55	88%	0.879	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-19.3	178	-142	174	104.5	0	0	113.3	P47	E20-P47 HydrophobicContact CG-CB 4.32Å
21	G	70.5	Confident	82.2	Confident	56 Å²	56	53.1 Å²	53.1	58%	0.577	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	16.1	174.9	0	0	0	0	0	115.6	P19 N23	P19-G21 PolarHBondContact O-N 2.81Å; G21-N23 PolarHBondContact O-N 3.05Å
22	A	72.7	Confident	82.8	Confident	24 Å²	24	60.2 Å²	60.2	20%	0.198	31%	0.314	C	S	.	.			trans	-67.2	121.3	178.8	0	0	0	0	0	112.1	L18 P19	L18-A22 HydrophobicContact CB-CB 3.5Å; L18-A22 VanDerWaalsContact CB-CB 3.5Å; L18-A22 HydrophobicContact CD1-CB 4.05Å; L18-A22 HydrophobicContact CD2-CB 3.92Å; L18-A22 HydrophobicContact CG-CB 4.01Å; P19-A22 HydrophobicContact CG-CB 4.3Å; P19-A22 WeakPolarHBondContact O-CB 3Å; P19-A22 PolarHBondContact O-N 2.77Å
23	N	79.6	Confident	83	Confident	82 Å²	82	64.8 Å²	64.8	44%	0.439	34%	0.336	S	S	.	.			trans	-90.4	143.9	-180	-62.5	-50.7	0	0	0	111.2	G21 N25 E26 L27	G21-N23 PolarHBondContact O-N 3.05Å; N23-N25 HydrophobicContact CB-CB 4.41Å; N23-N25 PolarHBondContact O-N 2.87Å; N23-E26 WeakPolarHBondContact CB-OE1 3.31Å; N23-E26 PolarHBondContact ND2-OE1 2.71Å; N23-E26 PolarHBondContact O-N 2.91Å; N23-L27 PolarHBondContact O-N 3.44Å
24	R	84.1	Confident	82.8	Confident	135 Å²	135	68.8 Å²	68.8	51%	0.509	35%	0.352	S	S	.	.	H	α-helix	trans	-58.9	-34.2	168.3	71.7	-177.5	-174.9	-88.7	-1.6	111.6	L27 E28 V40 V42	R24-L27 PolarHBondContact O-N 3.45Å; R24-E28 VanDerWaalsContact O-CB 3.27Å; R24-E28 WeakPolarHBondContact O-CB 3.18Å; R24-E28 PolarHBondContact O-N 3.18Å; R24-V40 HydrophobicContact CB-CG1 4.05Å; R24-V42 VanDerWaalsContact CA-CG2 3.46Å; R24-V42 HydrophobicContact CB-CB 4.34Å; R24-V42 HydrophobicContact CB-CG2 3.39Å
25	N	85.2	Confident	82.6	Confident	70 Å²	70	66.8 Å²	66.8	37%	0.374	35%	0.347	S	S	.	.	H	α-helix	trans	-61.8	-46.9	-179.6	-68.6	88.3	0	0	0	111.3	N23 L27 E28 D29	N23-N25 HydrophobicContact CB-CB 4.41Å; N23-N25 PolarHBondContact O-N 2.87Å; N25-L27 PolarHBondContact O-N 3.4Å; N25-E28 CarbonylContact O-C 3.59Å; N25-E28 WeakPolarHBondContact O-CB 3.22Å; N25-E28 PolarHBondContact O-N 2.81Å; N25-D29 PolarHBondContact O-N 3.03Å
26	E	83.5	Confident	82.5	Confident	67 Å²	67	72.6 Å²	72.6	31%	0.313	37%	0.374	S	S	.	.	H	α-helix	trans	-62.3	-44	177.4	-92.6	68	90.2	0	0	112.6	N23 E28 D29 I30 F73	N23-E26 WeakPolarHBondContact CB-OE1 3.31Å; N23-E26 PolarHBondContact ND2-OE1 2.71Å; N23-E26 PolarHBondContact O-N 2.91Å; E26-E28 VanDerWaalsContact C-N 3.34Å; E26-D29 PolarHBondContact O-N 2.77Å; E26-I30 WeakPolarHBondContact O-CB 3.4Å; E26-I30 VanDerWaalsContact O-CD1 3.29Å; E26-I30 WeakPolarHBondContact O-CD1 3.27Å; E26-I30 WeakPolarHBondContact O-CG1 3.48Å; E26-I30 PolarHBondContact O-N 2.76Å; E26-F73 HydrophobicContact CB-CE1 4.31Å; E26-F73 HydrophobicContact CB-CE2 3.82Å; E26-F73 HydrophobicContact CB-CZ 3.47Å; E26-F73 VanDerWaalsContact CB-CZ 3.47Å; E26-F73 HydrophobicContact CG-CE1 3.45Å; E26-F73 VanDerWaalsContact CG-CE1 3.45Å; E26-F73 HydrophobicContact CG-CE2 3.88Å; E26-F73 HydrophobicContact CG-CZ 3.06Å
27	L	85.7	Confident	82.5	Confident	9 Å²	9	74.1 Å²	74.1	5%	0.047	38%	0.38	C	S	.	.	H	α-helix	trans	-60.8	-47.5	173.8	-68.8	160.9	0	0	0	110.1	V15 L18 N23 R24 N25 D29 I30 F31 V40 V42 A50 V52	V15-L27 HydrophobicContact CB-CD2 4.24Å; V15-L27 HydrophobicContact CG1-CD2 3.72Å; V15-L27 HydrophobicContact CG2-CD2 4.25Å; L18-L27 HydrophobicContact CD1-CD1 3.84Å; L18-L27 HydrophobicContact CD1-CD2 4.32Å; L18-L27 HydrophobicContact CD2-CD2 4.2Å; N23-L27 PolarHBondContact O-N 3.44Å; R24-L27 PolarHBondContact O-N 3.45Å; N25-L27 PolarHBondContact O-N 3.4Å; L27-D29 PolarHBondContact O-N 2.99Å; L27-I30 PolarHBondContact O-N 3.45Å; L27-F31 HydrophobicContact CB-CD2 4.23Å; L27-F31 HydrophobicContact CD2-CD2 4.22Å; L27-F31 HydrophobicContact CD2-CE2 3.69Å; L27-F31 VanDerWaalsContact O-CB 3.32Å; L27-F31 WeakPolarHBondContact O-CB 3.19Å; L27-F31 WeakPolarHBondContact O-CD2 3.4Å; L27-F31 PolarHBondContact O-N 2.65Å; L27-V40 HydrophobicContact CB-CG1 4.43Å; L27-V42 HydrophobicContact CD1-CG2 3.89Å; L27-A50 HydrophobicContact CD1-CB 3.4Å; L27-V52 HydrophobicContact CB-CG2 4.49Å
28	E	87.6	Confident	82.7	Confident	70 Å²	70	80.8 Å²	80.8	33%	0.327	39%	0.391	S	S	.	.	H	α-helix	trans	-54.9	-51.8	177.3	-171.2	176.4	97.8	0	0	111.1	R24 N25 E26 I30 F31 R32 L37 V40	R24-E28 VanDerWaalsContact O-CB 3.27Å; R24-E28 WeakPolarHBondContact O-CB 3.18Å; R24-E28 PolarHBondContact O-N 3.18Å; N25-E28 CarbonylContact O-C 3.59Å; N25-E28 WeakPolarHBondContact O-CB 3.22Å; N25-E28 PolarHBondContact O-N 2.81Å; E26-E28 VanDerWaalsContact C-N 3.34Å; E28-I30 PolarHBondContact O-N 3.1Å; E28-F31 PolarHBondContact O-N 3.13Å; E28-R32 WeakPolarHBondContact O-CA 3.41Å; E28-R32 WeakPolarHBondContact O-CB 3.46Å; E28-R32 PolarHBondContact O-N 2.82Å; E28-L37 HydrophobicContact CG-CD1 4.11Å; E28-L37 HydrophobicContact CG-CD2 4.36Å; E28-V40 HydrophobicContact CB-CG2 4.09Å; E28-V40 HydrophobicContact CG-CG2 4.23Å
29	D	87.7	Confident	82.9	Confident	107 Å²	107	84.8 Å²	84.8	57%	0.572	41%	0.412	S	S	*	.	H	α-helix	trans	-59.4	-45.9	178.2	-95.7	-81.3	0	0	0	113.1	N25 E26 L27 Q33	N25-D29 PolarHBondContact O-N 3.03Å; E26-D29 PolarHBondContact O-N 2.77Å; L27-D29 PolarHBondContact O-N 2.99Å; D29-Q33 PolarHBondContact O-N 2.83Å
30	I	85.7	Confident	83.5	Confident	38 Å²	38	83.1 Å²	83.1	20%	0.195	40%	0.401	C	S	.	.	H	α-helix	trans	-65.1	-51.6	180	-66.1	159.4	0	0	0	110.4	E26 L27 E28 R32 Q33 Y34 L67 M72 F73	E26-I30 WeakPolarHBondContact O-CB 3.4Å; E26-I30 VanDerWaalsContact O-CD1 3.29Å; E26-I30 WeakPolarHBondContact O-CD1 3.27Å; E26-I30 WeakPolarHBondContact O-CG1 3.48Å; E26-I30 PolarHBondContact O-N 2.76Å; L27-I30 PolarHBondContact O-N 3.45Å; E28-I30 PolarHBondContact O-N 3.1Å; I30-R32 VanDerWaalsContact C-N 3.35Å; I30-R32 PolarHBondContact O-N 3.23Å; I30-Q33 WeakPolarHBondContact O-CB 3.29Å; I30-Q33 PolarHBondContact O-N 3.29Å; I30-Y34 HydrophobicContact CG2-CE2 4.26Å; I30-Y34 WeakPolarHBondContact O-CD2 3.27Å; I30-Y34 WeakPolarHBondContact O-CE2 3.31Å; I30-L67 HydrophobicContact CG2-CD1 4.32Å; I30-L67 HydrophobicContact CG2-CD2 3.81Å; I30-M72 HydrophobicContact CD1-SD 3.67Å; I30-M72 HydrophobicContact CG1-SD 4.41Å; I30-M72 HydrophobicContact CG2-CE 4.04Å; I30-M72 HydrophobicContact CG2-SD 4.21Å; I30-F73 HydrophobicContact CD1-CE2 3.72Å; I30-F73 HydrophobicContact CD1-CZ 3.94Å
31	F	86.2	Confident	84.2	Confident	4 Å²	4	81.1 Å²	81.1	2%	0.018	39%	0.386	C	S	.	.	H	α-helix	trans	-71.5	-29	-177.5	-77.2	-83.5	0	0	0	111.8	V13 V15 L27 E28 Q33 Y34 G35 L37 V52 F54 L67 V79	V13-F31 HydrophobicContact CG1-CE1 3.86Å; V13-F31 HydrophobicContact CG1-CZ 4.15Å; V15-F31 HydrophobicContact CG2-CE2 3.65Å; V15-F31 HydrophobicContact CG2-CZ 3.46Å; V15-F31 VanDerWaalsContact CG2-CZ 3.46Å; L27-F31 HydrophobicContact CB-CD2 4.23Å; L27-F31 HydrophobicContact CD2-CD2 4.22Å; L27-F31 HydrophobicContact CD2-CE2 3.69Å; L27-F31 VanDerWaalsContact O-CB 3.32Å; L27-F31 WeakPolarHBondContact O-CB 3.19Å; L27-F31 WeakPolarHBondContact O-CD2 3.4Å; L27-F31 PolarHBondContact O-N 2.65Å; E28-F31 PolarHBondContact O-N 3.13Å; F31-Q33 PolarHBondContact O-N 3.23Å; F31-Y34 PolarHBondContact O-N 2.77Å; F31-G35 PolarHBondContact O-N 2.99Å; F31-L37 HydrophobicContact CB-CD2 3.44Å; F31-L37 VanDerWaalsContact CB-CD2 3.44Å; F31-L37 HydrophobicContact CB-CG 4.35Å; F31-V52 HydrophobicContact CB-CG1 4.06Å; F31-V52 HydrophobicContact CD1-CG1 4.29Å; F31-V52 HydrophobicContact CD2-CG1 4.45Å; F31-V52 HydrophobicContact CD2-CG2 3.81Å; F31-V52 HydrophobicContact CE2-CG2 3.98Å; F31-V52 HydrophobicContact CG-CG1 4.03Å; F31-V52 HydrophobicContact CG-CG2 4.23Å; F31-V52 HydrophobicContact CZ-CG2 4.47Å; F31-F54 HydrophobicContact CB-CE2 4.25Å; F31-F54 HydrophobicContact CB-CZ 3.74Å; F31-F54 AromaticContact CD1-CE2 3.52Å; F31-F54 HydrophobicContact CD1-CE2 3.52Å; F31-F54 AromaticContact CD1-CZ 3.52Å; F31-F54 HydrophobicContact CD1-CZ 3.52Å; F31-F54 HydrophobicContact CE1-CE2 4.23Å; F31-F54 HydrophobicContact CG-CE2 4.23Å; F31-F54 HydrophobicContact CG-CZ 4.08Å; F31-L67 HydrophobicContact CD1-CD1 3.45Å; F31-L67 VanDerWaalsContact CD1-CD1 3.45Å; F31-L67 HydrophobicContact CD2-CD1 4.47Å; F31-L67 HydrophobicContact CE1-CD1 3.25Å; F31-L67 HydrophobicContact CE2-CD1 4.26Å; F31-L67 HydrophobicContact CG-CD1 4.11Å; F31-L67 HydrophobicContact CZ-CD1 3.68Å; F31-V79 HydrophobicContact CE1-CG1 3.9Å; F31-V79 HydrophobicContact CZ-CG1 3.78Å; F31-V79 HydrophobicContact CZ-CG2 4.15Å
32	R	86	Confident	84.9	Confident	171 Å²	171	80.2 Å²	80.2	65%	0.645	37%	0.369	S	S	*	.	H	α-helix	trans	-61	-31.3	174.1	-162	166.2	176.6	-177.9	-1.6	112.8	E28 I30 Y34 G35 L37	E28-R32 WeakPolarHBondContact O-CA 3.41Å; E28-R32 WeakPolarHBondContact O-CB 3.46Å; E28-R32 PolarHBondContact O-N 2.82Å; I30-R32 VanDerWaalsContact C-N 3.35Å; I30-R32 PolarHBondContact O-N 3.23Å; R32-Y34 VanDerWaalsContact C-N 3.26Å; R32-Y34 PolarHBondContact O-N 2.81Å; R32-G35 CarbonylContact C-O 3.59Å; R32-G35 VanDerWaalsContact CA-O 3.28Å; R32-G35 WeakPolarHBondContact CA-O 3.46Å; R32-G35 VanDerWaalsContact O-O 3.08Å; R32-L37 VanDerWaalsContact CA-CD1 3.45Å; R32-L37 HydrophobicContact CB-CD1 3.46Å; R32-L37 VanDerWaalsContact CB-CD1 3.46Å; R32-L37 HydrophobicContact CG-CD1 3.69Å
33	Q	85.2	Confident	85.1	Confident	165 Å²	165	79.3 Å²	79.3	77%	0.771	36%	0.362	S	S	*	.	H	α-helix	trans	-66.9	-30.8	-180	-173.9	174	97.5	0	0	111.9	D29 I30 F31	D29-Q33 PolarHBondContact O-N 2.83Å; I30-Q33 WeakPolarHBondContact O-CB 3.29Å; I30-Q33 PolarHBondContact O-N 3.29Å; F31-Q33 PolarHBondContact O-N 3.23Å
34	Y	84.7	Confident	84.7	Confident	84 Å²	84	85.4 Å²	85.4	33%	0.329	38%	0.378	S	S	.	.	H	α-helix	trans	-85.1	-33.2	178.5	-64.5	-88.8	0	0	0	112.5	I30 F31 R32 S63 N66 L67	I30-Y34 HydrophobicContact CG2-CE2 4.26Å; I30-Y34 WeakPolarHBondContact O-CD2 3.27Å; I30-Y34 WeakPolarHBondContact O-CE2 3.31Å; F31-Y34 PolarHBondContact O-N 2.77Å; R32-Y34 VanDerWaalsContact C-N 3.26Å; R32-Y34 PolarHBondContact O-N 2.81Å; Y34-S63 WeakPolarHBondContact CB-OG 3.09Å; Y34-N66 HydrophobicContact CE1-CB 3.91Å; Y34-L67 HydrophobicContact CD2-CD1 4Å; Y34-L67 HydrophobicContact CD2-CG 4.49Å; Y34-L67 HydrophobicContact CE2-CD1 3.82Å; Y34-L67 HydrophobicContact CE2-CD2 3.62Å; Y34-L67 HydrophobicContact CE2-CG 3.9Å; Y34-L67 WeakPolarHBondContact OH-CD2 3.44Å
35	G	83.5	Confident	83.9	Confident	12 Å²	12	89.9 Å²	89.9	12%	0.124	40%	0.395	C	S	.	.	S	Bend	trans	-173.8	-177.5	-179.7	0	0	0	0	0	113.5	F31 R32 L37	F31-G35 PolarHBondContact O-N 2.99Å; R32-G35 CarbonylContact C-O 3.59Å; R32-G35 VanDerWaalsContact CA-O 3.28Å; R32-G35 WeakPolarHBondContact CA-O 3.46Å; R32-G35 VanDerWaalsContact O-O 3.08Å; G35-L37 PolarHBondContact O-N 2.78Å
36	Q	84.8	Confident	82.7	Confident	123 Å²	123	91 Å²	91	58%	0.575	41%	0.406	S	S	*	.			trans	-78.9	121.4	-179.7	-69.4	168.5	95.7	0	0	110.1	E55	Q36-E55 HydrophobicContact CB-CB 4.02Å; Q36-E55 PolarHBondContact NE2-OE1 3.12Å; Q36-E55 WeakPolarHBondContact O-CB 3.17Å; Q36-E55 PolarHBondContact O-N 3.44Å
37	L	86.7	Confident	82	Confident	37 Å²	37	91.9 Å²	91.9	19%	0.194	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	133	172.3	-21.1	83.6	0	0	0	109.8	E28 F31 R32 G35 V40 V52 E53	E28-L37 HydrophobicContact CG-CD1 4.11Å; E28-L37 HydrophobicContact CG-CD2 4.36Å; F31-L37 HydrophobicContact CB-CD2 3.44Å; F31-L37 VanDerWaalsContact CB-CD2 3.44Å; F31-L37 HydrophobicContact CB-CG 4.35Å; R32-L37 VanDerWaalsContact CA-CD1 3.45Å; R32-L37 HydrophobicContact CB-CD1 3.46Å; R32-L37 VanDerWaalsContact CB-CD1 3.46Å; R32-L37 HydrophobicContact CG-CD1 3.69Å; G35-L37 PolarHBondContact O-N 2.78Å; L37-V40 HydrophobicContact CB-CG2 4.48Å; L37-V40 HydrophobicContact CD2-CG2 3.81Å; L37-V52 HydrophobicContact CD2-CG1 3.7Å; L37-E53 CarbonylContact C-O 3.47Å; L37-E53 WeakPolarHBondContact CA-O 3.18Å
38	R	86.5	Confident	81.6	Confident	188 Å²	188	92.4 Å²	92.4	71%	0.709	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	-39.6	173.2	-174.7	172.6	-176	179.7	3.7	112	E53	R38-E53 WeakPolarHBondContact CA-O 3.32Å; R38-E53 HydrophobicContact CB-CB 4.42Å; R38-E53 HydrophobicContact CB-CG 4.27Å; R38-E53 WeakPolarHBondContact CD-OE1 3.17Å; R38-E53 PolarHBondContact N-O 3.48Å; R38-E53 IonicContact NE-OE1 2.98Å
39	N	86.3	Confident	81.4	Confident	98 Å²	98	91 Å²	91	52%	0.524	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	148.4	-177.6	-160.8	6.6	0	0	0	111.8	E53	N39-E53 HydrophobicContact CB-CB 3.99Å; N39-E53 PolarHBondContact N-O 3.33Å; N39-E53 VanDerWaalsContact N-O 3.12Å; N39-E53 PolarHBondContact O-N 2.85Å
40	V	88.4	Confident	81.4	Confident	17 Å²	17	86 Å²	86	10%	0.103	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	120.3	175.4	-176.7	0	0	0	0	109.5	R24 L27 E28 L37 V52	R24-V40 HydrophobicContact CB-CG1 4.05Å; L27-V40 HydrophobicContact CB-CG1 4.43Å; E28-V40 HydrophobicContact CB-CG2 4.09Å; E28-V40 HydrophobicContact CG-CG2 4.23Å; L37-V40 HydrophobicContact CB-CG2 4.48Å; L37-V40 HydrophobicContact CD2-CG2 3.81Å; V40-V52 HydrophobicContact CG1-CG2 4.26Å; V40-V52 HydrophobicContact CG2-CG1 4.48Å
41	W	86.7	Confident	81.6	Confident	146 Å²	146	86.4 Å²	86.4	55%	0.553	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120	109.7	-179.7	-174.9	75.8	0	0	0	111.1	A43 F49 A50 F51	W41-A43 HydrophobicContact CE3-CB 4.3Å; W41-A43 HydrophobicContact CH2-CB 3.54Å; W41-A43 HydrophobicContact CZ2-CB 4.27Å; W41-A43 HydrophobicContact CZ3-CB 3.58Å; W41-F49 HydrophobicContact CH2-CE2 4.3Å; W41-F49 AromaticContact CZ3-CE2 3.95Å; W41-F49 HydrophobicContact CZ3-CE2 3.95Å; W41-A50 CarbonylContact O-C 3.57Å; W41-A50 WeakPolarHBondContact O-CA 3.35Å; W41-F51 HydrophobicContact CB-CB 4.45Å; W41-F51 HydrophobicContact CE3-CB 4.19Å; W41-F51 AromaticContact CE3-CD2 3.37Å; W41-F51 HydrophobicContact CE3-CD2 3.37Å; W41-F51 HydrophobicContact CE3-CE2 4.07Å; W41-F51 HydrophobicContact CE3-CG 4.12Å; W41-F51 AromaticContact CZ3-CD2 3.46Å; W41-F51 HydrophobicContact CZ3-CD2 3.46Å; W41-F51 VanDerWaalsContact CZ3-CD2 3.46Å; W41-F51 AromaticContact CZ3-CE2 3.67Å; W41-F51 HydrophobicContact CZ3-CE2 3.67Å; W41-F51 PolarHBondContact N-O 3.48Å; W41-F51 PolarHBondContact O-N 2.79Å
42	V	85.6	Confident	81.7	Confident	37 Å²	37	86.2 Å²	86.2	22%	0.224	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	123.9	174.8	177.2	0	0	0	0	109.5	R24 L27 A50	R24-V42 VanDerWaalsContact CA-CG2 3.46Å; R24-V42 HydrophobicContact CB-CB 4.34Å; R24-V42 HydrophobicContact CB-CG2 3.39Å; L27-V42 HydrophobicContact CD1-CG2 3.89Å; V42-A50 HydrophobicContact CB-CB 4.33Å; V42-A50 HydrophobicContact CG1-CB 4.46Å; V42-A50 HydrophobicContact CG2-CB 3.85Å
43	A	77.9	Confident	81.7	Confident	6 Å²	6	80.2 Å²	80.2	5%	0.05	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	137.7	177.4	0	0	0	0	0	111	W41 F49	W41-A43 HydrophobicContact CE3-CB 4.3Å; W41-A43 HydrophobicContact CH2-CB 3.54Å; W41-A43 HydrophobicContact CZ2-CB 4.27Å; W41-A43 HydrophobicContact CZ3-CB 3.58Å; A43-F49 HydrophobicContact CB-CD1 3.89Å; A43-F49 HydrophobicContact CB-CD2 3.3Å; A43-F49 HydrophobicContact CB-CE1 3.55Å; A43-F49 HydrophobicContact CB-CE2 2.91Å; A43-F49 HydrophobicContact CB-CG 3.79Å; A43-F49 HydrophobicContact CB-CZ 3.06Å; A43-F49 WeakPolarHBondContact CB-O 3.41Å; A43-F49 PolarHBondContact N-O 2.71Å
44	R	70.9	Confident	81.7	Confident	209 Å²	209	72.4 Å²	72.4	79%	0.789	33%	0.334	S	S	*	.			trans	-102.2	-11.2	-179.4	-62	-178.9	177.1	-177.1	-3.1	113.1
45	R	66.3	Low	81.7	Confident	229 Å²	229	74 Å²	74	86%	0.864	35%	0.345	S	S	*	.	S	Bend	trans	-147.8	114.6	-175.1	-73	169.6	76.6	178.3	3.8	111.3
46	P	60.4	Low	81.6	Confident	93 Å²	93	75.2 Å²	75.2	60%	0.604	35%	0.348	S	S	*	.	S	Bend	cis	-58.6	160	-17.3	21.9	-30.8	0	0	0	114	F49	P46-F49 HydrophobicContact CB-CE1 4.46Å; P46-F49 HydrophobicContact CG-CD1 4.34Å; P46-F49 HydrophobicContact CG-CE1 3.71Å; P46-F49 WeakPolarHBondContact O-CD1 3.39Å; P46-F49 WeakPolarHBondContact O-CE1 3.43Å
47	P	68.7	Low	81.3	Confident	87 Å²	87	71.5 Å²	71.5	57%	0.565	34%	0.335	S	S	*	.	S	Bend	trans	-69.1	154.7	177.4	28.2	-34	0	0	0	111.9	E20	E20-P47 HydrophobicContact CG-CB 4.32Å
48	G	76.8	Confident	81.1	Confident	20 Å²	20	77.9 Å²	77.9	21%	0.206	36%	0.356	C	S	.	.	S	Bend	trans	94.3	18.2	168.6	0	0	0	0	0	116.5	G16 G17 L18	G16-G48 CarbonylContact C-O 3.51Å; G16-G48 WeakPolarHBondContact CA-O 3.41Å; G17-G48 PolarHBondContact N-O 2.83Å; G17-G48 VanDerWaalsContact N-O 3.09Å; L18-G48 PolarHBondContact N-O 3.27Å; L18-G48 WeakPolarHBondContact O-CA 3.35Å
49	F	84.9	Confident	81	Confident	41 Å²	41	71.1 Å²	71.1	18%	0.18	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	153.1	170.2	72.5	-82.7	0	0	0	114	F14 V15 W41 A43 P46 F51	F14-F49 HydrophobicContact CE2-CB 3.75Å; F14-F49 HydrophobicContact CE2-CD2 4.08Å; F14-F49 HydrophobicContact CE2-CG 4.25Å; F14-F49 HydrophobicContact CZ-CB 3.96Å; V15-F49 CarbonylContact O-C 3.55Å; V15-F49 WeakPolarHBondContact O-CA 3.46Å; W41-F49 HydrophobicContact CH2-CE2 4.3Å; W41-F49 AromaticContact CZ3-CE2 3.95Å; W41-F49 HydrophobicContact CZ3-CE2 3.95Å; A43-F49 HydrophobicContact CB-CD1 3.89Å; A43-F49 HydrophobicContact CB-CD2 3.3Å; A43-F49 HydrophobicContact CB-CE1 3.55Å; A43-F49 HydrophobicContact CB-CE2 2.91Å; A43-F49 HydrophobicContact CB-CG 3.79Å; A43-F49 HydrophobicContact CB-CZ 3.06Å; A43-F49 WeakPolarHBondContact CB-O 3.41Å; A43-F49 PolarHBondContact N-O 2.71Å; P46-F49 HydrophobicContact CB-CE1 4.46Å; P46-F49 HydrophobicContact CG-CD1 4.34Å; P46-F49 HydrophobicContact CG-CE1 3.71Å; P46-F49 WeakPolarHBondContact O-CD1 3.39Å; P46-F49 WeakPolarHBondContact O-CE1 3.43Å; F49-F51 HydrophobicContact CD2-CD2 4.16Å; F49-F51 AromaticContact CD2-CE2 3.64Å; F49-F51 HydrophobicContact CD2-CE2 3.64Å; F49-F51 HydrophobicContact CE2-CD2 4.44Å; F49-F51 AromaticContact CE2-CE2 3.74Å; F49-F51 HydrophobicContact CE2-CE2 3.74Å
50	A	87.8	Confident	80.9	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	163.7	178.5	0	0	0	0	0	110.4	V15 L18 L27 W41 V42	V15-A50 HydrophobicContact CB-CB 4.34Å; V15-A50 PolarHBondContact N-O 3.34Å; V15-A50 PolarHBondContact O-N 2.82Å; L18-A50 HydrophobicContact CD1-CB 3.67Å; L27-A50 HydrophobicContact CD1-CB 3.4Å; W41-A50 CarbonylContact O-C 3.57Å; W41-A50 WeakPolarHBondContact O-CA 3.35Å; V42-A50 HydrophobicContact CB-CB 4.33Å; V42-A50 HydrophobicContact CG1-CB 4.46Å; V42-A50 HydrophobicContact CG2-CB 3.85Å
51	F	88.5	Confident	80.6	Confident	48 Å²	48	67.1 Å²	67.1	21%	0.211	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	133.8	175.8	-71	-95.6	0	0	0	109	K12 V13 F14 W41 F49	K12-F51 HydrophobicContact CD-CD1 4.05Å; K12-F51 HydrophobicContact CG-CD1 4.13Å; V13-F51 CarbonylContact O-C 3.49Å; V13-F51 VanDerWaalsContact O-CA 3.22Å; V13-F51 WeakPolarHBondContact O-CA 3.42Å; F14-F51 HydrophobicContact CB-CD1 4.35Å; F14-F51 HydrophobicContact CB-CE1 4.17Å; F14-F51 HydrophobicContact CD2-CD1 4.3Å; F14-F51 AromaticContact CD2-CE1 3.74Å; F14-F51 HydrophobicContact CD2-CE1 3.74Å; F14-F51 HydrophobicContact CD2-CE2 4.04Å; F14-F51 AromaticContact CD2-CZ 3.63Å; F14-F51 HydrophobicContact CD2-CZ 3.63Å; F14-F51 HydrophobicContact CE2-CE2 4.4Å; F14-F51 HydrophobicContact CE2-CZ 4.22Å; F14-F51 HydrophobicContact CG-CE1 4.45Å; W41-F51 HydrophobicContact CB-CB 4.45Å; W41-F51 HydrophobicContact CE3-CB 4.19Å; W41-F51 AromaticContact CE3-CD2 3.37Å; W41-F51 HydrophobicContact CE3-CD2 3.37Å; W41-F51 HydrophobicContact CE3-CE2 4.07Å; W41-F51 HydrophobicContact CE3-CG 4.12Å; W41-F51 AromaticContact CZ3-CD2 3.46Å; W41-F51 HydrophobicContact CZ3-CD2 3.46Å; W41-F51 VanDerWaalsContact CZ3-CD2 3.46Å; W41-F51 AromaticContact CZ3-CE2 3.67Å; W41-F51 HydrophobicContact CZ3-CE2 3.67Å; W41-F51 PolarHBondContact N-O 3.48Å; W41-F51 PolarHBondContact O-N 2.79Å; F49-F51 HydrophobicContact CD2-CD2 4.16Å; F49-F51 AromaticContact CD2-CE2 3.64Å; F49-F51 HydrophobicContact CD2-CE2 3.64Å; F49-F51 HydrophobicContact CE2-CD2 4.44Å; F49-F51 AromaticContact CE2-CE2 3.74Å; F49-F51 HydrophobicContact CE2-CE2 3.74Å
52	V	88.1	Confident	80.6	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	127.2	178.1	175.7	0	0	0	0	107.6	K12 V13 V15 L27 F31 L37 V40 F54	K12-V52 CarbonylContact C-O 3.38Å; K12-V52 WeakPolarHBondContact CA-O 3.2Å; V13-V52 HydrophobicContact CB-CB 4.23Å; V13-V52 WeakPolarHBondContact CB-O 3.49Å; V13-V52 PolarHBondContact N-O 2.78Å; V13-V52 PolarHBondContact O-N 2.69Å; V15-V52 HydrophobicContact CG2-CG2 4.17Å; L27-V52 HydrophobicContact CB-CG2 4.49Å; F31-V52 HydrophobicContact CB-CG1 4.06Å; F31-V52 HydrophobicContact CD1-CG1 4.29Å; F31-V52 HydrophobicContact CD2-CG1 4.45Å; F31-V52 HydrophobicContact CD2-CG2 3.81Å; F31-V52 HydrophobicContact CE2-CG2 3.98Å; F31-V52 HydrophobicContact CG-CG1 4.03Å; F31-V52 HydrophobicContact CG-CG2 4.23Å; F31-V52 HydrophobicContact CZ-CG2 4.47Å; L37-V52 HydrophobicContact CD2-CG1 3.7Å; V40-V52 HydrophobicContact CG1-CG2 4.26Å; V40-V52 HydrophobicContact CG2-CG1 4.48Å; V52-F54 HydrophobicContact CG1-CD2 3.95Å; V52-F54 HydrophobicContact CG1-CE2 3.62Å; V52-F54 HydrophobicContact CG1-CZ 4.36Å
53	E	86.1	Confident	80.6	Confident	45 Å²	45	62.4 Å²	62.4	21%	0.21	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	121.6	175.6	-164.5	169.4	96.4	0	0	108.3	C11 K12 L37 R38 N39	C11-E53 CarbonylContact O-C 3.51Å; C11-E53 WeakPolarHBondContact O-CA 3.08Å; K12-E53 WeakPolarHBondContact CE-OE2 3.35Å; K12-E53 IonicContact NZ-OE2 3.59Å; L37-E53 CarbonylContact C-O 3.47Å; L37-E53 WeakPolarHBondContact CA-O 3.18Å; R38-E53 WeakPolarHBondContact CA-O 3.32Å; R38-E53 HydrophobicContact CB-CB 4.42Å; R38-E53 HydrophobicContact CB-CG 4.27Å; R38-E53 WeakPolarHBondContact CD-OE1 3.17Å; R38-E53 PolarHBondContact N-O 3.48Å; R38-E53 IonicContact NE-OE1 2.98Å; N39-E53 HydrophobicContact CB-CB 3.99Å; N39-E53 PolarHBondContact N-O 3.33Å; N39-E53 VanDerWaalsContact N-O 3.12Å; N39-E53 PolarHBondContact O-N 2.85Å
54	F	86.8	Confident	81	Confident	1 Å²	1	62.9 Å²	62.9	0%	0.004	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	160.7	176	-84.6	-90.7	0	0	0	111.5	C11 V13 F31 V52 D59 A60 S63	C11-F54 HydrophobicContact CB-CB 3.9Å; C11-F54 WeakPolarHBondContact CB-O 3.37Å; C11-F54 PolarHBondContact O-N 2.99Å; V13-F54 HydrophobicContact CG2-CD2 3.72Å; V13-F54 HydrophobicContact CG2-CE2 3.87Å; F31-F54 HydrophobicContact CB-CE2 4.25Å; F31-F54 HydrophobicContact CB-CZ 3.74Å; F31-F54 AromaticContact CD1-CE2 3.52Å; F31-F54 HydrophobicContact CD1-CE2 3.52Å; F31-F54 AromaticContact CD1-CZ 3.52Å; F31-F54 HydrophobicContact CD1-CZ 3.52Å; F31-F54 HydrophobicContact CE1-CE2 4.23Å; F31-F54 HydrophobicContact CG-CE2 4.23Å; F31-F54 HydrophobicContact CG-CZ 4.08Å; V52-F54 HydrophobicContact CG1-CD2 3.95Å; V52-F54 HydrophobicContact CG1-CE2 3.62Å; V52-F54 HydrophobicContact CG1-CZ 4.36Å; F54-D59 HydrophobicContact CD1-CB 3.96Å; F54-D59 HydrophobicContact CE1-CB 4.35Å; F54-A60 HydrophobicContact CB-CB 3.82Å; F54-A60 HydrophobicContact CD2-CB 3.88Å; F54-A60 HydrophobicContact CG-CB 3.92Å; F54-S63 WeakPolarHBondContact CE1-OG 3.48Å; F54-S63 WeakPolarHBondContact CZ-OG 3.45Å
55	E	84.4	Confident	81.6	Confident	118 Å²	118	60.3 Å²	60.3	55%	0.551	29%	0.289	S	S	*	.	S	Bend	trans	-76.3	-46.2	169.9	-171	165.5	87.5	0	0	111	C11 Q36	C11-E55 PolarHBondContact SG-O 3.39Å; Q36-E55 HydrophobicContact CB-CB 4.02Å; Q36-E55 PolarHBondContact NE2-OE1 3.12Å; Q36-E55 WeakPolarHBondContact O-CB 3.17Å; Q36-E55 PolarHBondContact O-N 3.44Å
56	D	81.6	Confident	82.6	Confident	37 Å²	37	53.2 Å²	53.2	20%	0.198	27%	0.268	C	S	.	.			trans	-108.6	133.9	-178.8	-161.1	-60.9	0	0	0	111.5	R58 D59 A60	D56-R58 PolarHBondContact O-N 2.72Å; D56-R58 WeakPolarHBondContact OD1-CA 3.49Å; D56-R58 WeakPolarHBondContact OD1-CB 3.43Å; D56-R58 WeakPolarHBondContact OD1-CG 3.08Å; D56-R58 IonicContact OD1-CZ 3.38Å; D56-R58 PolarHBondContact OD1-N 3.46Å; D56-R58 IonicContact OD1-NE 3.19Å; D56-R58 PolarHBondContact OD1-NE 2.7Å; D56-R58 IonicContact OD1-NH2 2.72Å; D56-R58 IonicContact OD2-CZ 3.55Å; D56-R58 IonicContact OD2-NE 3.96Å; D56-R58 PolarHBondContact OD2-NE 3.4Å; D56-R58 IonicContact OD2-NH2 3.91Å; D56-R58 PolarHBondContact OD2-NH2 2.76Å; D56-D59 HydrophobicContact CB-CB 4.3Å; D56-D59 PolarHBondContact O-N 3.2Å; D56-A60 PolarHBondContact O-N 2.84Å; D56-A60 VanDerWaalsContact O-N 3.07Å
57	P	78	Confident	83.7	Confident	44 Å²	44	48.8 Å²	48.8	29%	0.286	24%	0.239	S	C	.	.	H	α-helix	trans	-68.2	-23.6	176.5	28.5	-35.8	0	0	0	113	C11 L61	C11-P57 VanDerWaalsContact SG-CD 3.56Å; P57-L61 WeakPolarHBondContact O-CB 3.45Å; P57-L61 PolarHBondContact O-N 3.43Å
58	R	82	Confident	84.5	Confident	171 Å²	171	48.7 Å²	48.7	65%	0.645	23%	0.234	S	C	*	.	H	α-helix	trans	-66.4	-45.3	175	-60.2	174.5	-69	167.8	2	110	D56 L61 D62	D56-R58 PolarHBondContact O-N 2.72Å; D56-R58 WeakPolarHBondContact OD1-CA 3.49Å; D56-R58 WeakPolarHBondContact OD1-CB 3.43Å; D56-R58 WeakPolarHBondContact OD1-CG 3.08Å; D56-R58 IonicContact OD1-CZ 3.38Å; D56-R58 PolarHBondContact OD1-N 3.46Å; D56-R58 IonicContact OD1-NE 3.19Å; D56-R58 PolarHBondContact OD1-NE 2.7Å; D56-R58 IonicContact OD1-NH2 2.72Å; D56-R58 IonicContact OD2-CZ 3.55Å; D56-R58 IonicContact OD2-NE 3.96Å; D56-R58 PolarHBondContact OD2-NE 3.4Å; D56-R58 IonicContact OD2-NH2 3.91Å; D56-R58 PolarHBondContact OD2-NH2 2.76Å; R58-L61 PolarHBondContact O-N 2.95Å; R58-D62 WeakPolarHBondContact O-CB 3.12Å; R58-D62 PolarHBondContact O-N 2.92Å
59	D	85.4	Confident	84.7	Confident	46 Å²	46	49.7 Å²	49.7	25%	0.246	24%	0.244	C	C	.	.	H	α-helix	trans	-67	-39	177.2	-60.7	-4.7	0	0	0	110.7	F54 D56 L61 D62 S63	F54-D59 HydrophobicContact CD1-CB 3.96Å; F54-D59 HydrophobicContact CE1-CB 4.35Å; D56-D59 HydrophobicContact CB-CB 4.3Å; D56-D59 PolarHBondContact O-N 3.2Å; D59-L61 PolarHBondContact O-N 3.41Å; D59-D62 PolarHBondContact O-N 3.25Å; D59-S63 WeakPolarHBondContact O-CB 3.11Å; D59-S63 PolarHBondContact O-N 2.82Å; D59-S63 PolarHBondContact O-OG 3Å
60	A	84.5	Confident	84.5	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.7	-46.5	174.6	0	0	0	0	0	112.1	V13 F54 D56 V64 L81	V13-A60 HydrophobicContact CG2-CB 3.96Å; F54-A60 HydrophobicContact CB-CB 3.82Å; F54-A60 HydrophobicContact CD2-CB 3.88Å; F54-A60 HydrophobicContact CG-CB 3.92Å; D56-A60 PolarHBondContact O-N 2.84Å; D56-A60 VanDerWaalsContact O-N 3.07Å; A60-V64 WeakPolarHBondContact O-CB 3.13Å; A60-V64 WeakPolarHBondContact O-CG2 3.49Å; A60-V64 PolarHBondContact O-N 3.4Å; A60-L81 HydrophobicContact CB-CD2 4.08Å
61	L	82	Confident	84	Confident	32 Å²	32	57.1 Å²	57.1	17%	0.168	28%	0.28	C	S	.	.	H	α-helix	trans	-65.9	-44.3	178.9	178.5	70.8	0	0	0	111.5	P57 R58 D59 V64 R65 L81	P57-L61 WeakPolarHBondContact O-CB 3.45Å; P57-L61 PolarHBondContact O-N 3.43Å; R58-L61 PolarHBondContact O-N 2.95Å; D59-L61 PolarHBondContact O-N 3.41Å; L61-V64 PolarHBondContact O-N 2.79Å; L61-R65 WeakPolarHBondContact O-CB 3.17Å; L61-R65 WeakPolarHBondContact O-CG 3.2Å; L61-R65 PolarHBondContact O-N 3.19Å; L61-L81 HydrophobicContact CB-CD1 4.36Å; L61-L81 HydrophobicContact CD1-CD1 3.43Å; L61-L81 VanDerWaalsContact CD1-CD1 3.43Å
62	D	85.8	Confident	83	Confident	84 Å²	84	56.5 Å²	56.5	45%	0.449	28%	0.278	S	S	.	.	H	α-helix	trans	-63.7	-45.7	178	-166.4	-98.8	0	0	0	111	R58 D59 V64 R65 N66	R58-D62 WeakPolarHBondContact O-CB 3.12Å; R58-D62 PolarHBondContact O-N 2.92Å; D59-D62 PolarHBondContact O-N 3.25Å; D62-V64 VanDerWaalsContact C-N 3.35Å; D62-V64 PolarHBondContact O-N 2.75Å; D62-R65 PolarHBondContact O-N 3.33Å; D62-N66 VanDerWaalsContact CG-ND2 3.33Å; D62-N66 WeakPolarHBondContact O-CB 3.09Å; D62-N66 PolarHBondContact O-N 3.49Å; D62-N66 PolarHBondContact O-ND2 2.94Å; D62-N66 PolarHBondContact OD1-ND2 3.4Å; D62-N66 PolarHBondContact OD2-ND2 3.38Å
63	S	86.1	Confident	82	Confident	0 Å²	0	63 Å²	63	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-57.2	-47.2	174.7	-59.5	0	0	0	0	111.3	Y34 F54 D59 N66 L67	Y34-S63 WeakPolarHBondContact CB-OG 3.09Å; F54-S63 WeakPolarHBondContact CE1-OG 3.48Å; F54-S63 WeakPolarHBondContact CZ-OG 3.45Å; D59-S63 WeakPolarHBondContact O-CB 3.11Å; D59-S63 PolarHBondContact O-N 2.82Å; D59-S63 PolarHBondContact O-OG 3Å; S63-N66 PolarHBondContact O-N 3.44Å; S63-L67 WeakPolarHBondContact O-CB 3.43Å; S63-L67 WeakPolarHBondContact O-CD1 3.15Å; S63-L67 WeakPolarHBondContact O-CG 3.42Å; S63-L67 PolarHBondContact O-N 2.88Å
64	V	86.1	Confident	81.6	Confident	15 Å²	15	63.4 Å²	63.4	9%	0.091	32%	0.324	C	S	.	.	H	α-helix	trans	-61.8	-47.2	178.2	169.1	0	0	0	0	111.2	V13 A60 L61 D62 N66 L67 D68 V79 L81	V13-V64 HydrophobicContact CB-CG2 4.17Å; V13-V64 HydrophobicContact CG1-CG2 3.59Å; V13-V64 HydrophobicContact CG2-CG2 3.61Å; A60-V64 WeakPolarHBondContact O-CB 3.13Å; A60-V64 WeakPolarHBondContact O-CG2 3.49Å; A60-V64 PolarHBondContact O-N 3.4Å; L61-V64 PolarHBondContact O-N 2.79Å; D62-V64 VanDerWaalsContact C-N 3.35Å; D62-V64 PolarHBondContact O-N 2.75Å; V64-N66 VanDerWaalsContact C-N 3.31Å; V64-N66 PolarHBondContact O-N 2.68Å; V64-L67 PolarHBondContact O-N 3.46Å; V64-D68 WeakPolarHBondContact O-CB 3.17Å; V64-D68 PolarHBondContact O-N 2.84Å; V64-V79 HydrophobicContact CB-CG1 4.25Å; V64-V79 HydrophobicContact CG1-CG1 4.49Å; V64-V79 HydrophobicContact CG2-CG1 3.82Å; V64-L81 HydrophobicContact CB-CG 4.24Å; V64-L81 HydrophobicContact CG1-CG 4.26Å; V64-L81 HydrophobicContact CG2-CD2 3.81Å; V64-L81 HydrophobicContact CG2-CG 3.84Å
65	R	83.9	Confident	81.3	Confident	155 Å²	155	65.5 Å²	65.5	59%	0.585	34%	0.337	S	S	*	.	H	α-helix	trans	-64.3	-35.6	-179.3	-74.3	176.8	175.1	173	3	112.8	D5 L61 D62	D5-R65 IonicContact OD1-NH2 3.81Å; L61-R65 WeakPolarHBondContact O-CB 3.17Å; L61-R65 WeakPolarHBondContact O-CG 3.2Å; L61-R65 PolarHBondContact O-N 3.19Å; D62-R65 PolarHBondContact O-N 3.33Å
66	N	85.9	Confident	81.3	Confident	80 Å²	80	69.1 Å²	69.1	43%	0.428	35%	0.345	S	S	.	.	H	α-helix	trans	-82.3	-31.9	179.5	-76.5	-79.2	0	0	0	112.9	Y34 D62 S63 V64 T70	Y34-N66 HydrophobicContact CE1-CB 3.91Å; D62-N66 VanDerWaalsContact CG-ND2 3.33Å; D62-N66 WeakPolarHBondContact O-CB 3.09Å; D62-N66 PolarHBondContact O-N 3.49Å; D62-N66 PolarHBondContact O-ND2 2.94Å; D62-N66 PolarHBondContact OD1-ND2 3.4Å; D62-N66 PolarHBondContact OD2-ND2 3.38Å; S63-N66 PolarHBondContact O-N 3.44Å; V64-N66 VanDerWaalsContact C-N 3.31Å; V64-N66 PolarHBondContact O-N 2.68Å; N66-T70 WeakPolarHBondContact O-CG2 3.5Å
67	L	84.1	Confident	81.5	Confident	1 Å²	1	67.7 Å²	67.7	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-97.2	-20.6	-174.5	-62.5	167.2	0	0	0	113.6	I30 F31 Y34 S63 V64 G69 T70 M72 V79	I30-L67 HydrophobicContact CG2-CD1 4.32Å; I30-L67 HydrophobicContact CG2-CD2 3.81Å; F31-L67 HydrophobicContact CD1-CD1 3.45Å; F31-L67 VanDerWaalsContact CD1-CD1 3.45Å; F31-L67 HydrophobicContact CD2-CD1 4.47Å; F31-L67 HydrophobicContact CE1-CD1 3.25Å; F31-L67 HydrophobicContact CE2-CD1 4.26Å; F31-L67 HydrophobicContact CG-CD1 4.11Å; F31-L67 HydrophobicContact CZ-CD1 3.68Å; Y34-L67 HydrophobicContact CD2-CD1 4Å; Y34-L67 HydrophobicContact CD2-CG 4.49Å; Y34-L67 HydrophobicContact CE2-CD1 3.82Å; Y34-L67 HydrophobicContact CE2-CD2 3.62Å; Y34-L67 HydrophobicContact CE2-CG 3.9Å; Y34-L67 WeakPolarHBondContact OH-CD2 3.44Å; S63-L67 WeakPolarHBondContact O-CB 3.43Å; S63-L67 WeakPolarHBondContact O-CD1 3.15Å; S63-L67 WeakPolarHBondContact O-CG 3.42Å; S63-L67 PolarHBondContact O-N 2.88Å; V64-L67 PolarHBondContact O-N 3.46Å; L67-G69 PolarHBondContact O-N 3.43Å; L67-T70 WeakPolarHBondContact O-CB 3.41Å; L67-T70 PolarHBondContact O-N 3.3Å; L67-T70 VanDerWaalsContact O-N 3.13Å; L67-T70 PolarHBondContact O-OG1 3.22Å; L67-M72 HydrophobicContact CD2-CE 3.21Å; L67-V79 HydrophobicContact CB-CB 4.21Å; L67-V79 HydrophobicContact CB-CG1 4.34Å; L67-V79 HydrophobicContact CB-CG2 3.77Å
68	D	84.9	Confident	81.9	Confident	85 Å²	85	72.4 Å²	72.4	46%	0.455	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	127	178.5	-176.6	-125.5	0	0	0	111.5	V64 T70 V79	V64-D68 WeakPolarHBondContact O-CB 3.17Å; V64-D68 PolarHBondContact O-N 2.84Å; D68-T70 PolarHBondContact O-N 2.62Å; D68-V79 HydrophobicContact CB-CB 4.31Å; D68-V79 VanDerWaalsContact CB-O 3.31Å; D68-V79 WeakPolarHBondContact CB-O 3.45Å; D68-V79 PolarHBondContact OD2-N 3Å; D68-V79 VanDerWaalsContact OD2-N 3.1Å; D68-V79 VanDerWaalsContact OD2-O 3.04Å
69	G	81.5	Confident	82.1	Confident	41 Å²	41	64.4 Å²	64.4	42%	0.423	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.1	2.1	-179.7	0	0	0	0	0	115	L67 V77	L67-G69 PolarHBondContact O-N 3.43Å; G69-V77 WeakPolarHBondContact CA-O 3.38Å; G69-V77 PolarHBondContact N-O 3.25Å
70	T	81.2	Confident	82.1	Confident	44 Å²	44	66.2 Å²	66.2	27%	0.27	33%	0.327	S	S	.	.			trans	-72.9	157.7	174.6	63.9	0	0	0	0	111.8	N66 L67 D68 M72 V77	N66-T70 WeakPolarHBondContact O-CG2 3.5Å; L67-T70 WeakPolarHBondContact O-CB 3.41Å; L67-T70 PolarHBondContact O-N 3.3Å; L67-T70 VanDerWaalsContact O-N 3.13Å; L67-T70 PolarHBondContact O-OG1 3.22Å; D68-T70 PolarHBondContact O-N 2.62Å; T70-M72 WeakPolarHBondContact OG1-CE 3.28Å; T70-V77 WeakPolarHBondContact O-CG2 2.95Å; T70-V77 PolarHBondContact O-N 2.82Å
71	K	76.4	Confident	81.9	Confident	152 Å²	152	67.3 Å²	67.3	66%	0.661	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	104.4	-178.5	-147.6	176.1	172.5	-174.6	0	109	G74 V75 R76	K71-G74 WeakPolarHBondContact CE-O 3.48Å; K71-V75 CarbonylContact C-O 3.49Å; K71-V75 WeakPolarHBondContact CA-O 3.32Å; K71-V75 VanDerWaalsContact CG-O 3.27Å; K71-V75 WeakPolarHBondContact CG-O 3.46Å; K71-R76 HydrophobicContact CG-CG 4.34Å
72	M	67.8	Low	81.2	Confident	35 Å²	35	66.7 Å²	66.7	17%	0.172	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	132.9	177.4	-61.2	-72.2	166	0	0	108.9	I30 L67 T70 G74 V75 V77	I30-M72 HydrophobicContact CD1-SD 3.67Å; I30-M72 HydrophobicContact CG1-SD 4.41Å; I30-M72 HydrophobicContact CG2-CE 4.04Å; I30-M72 HydrophobicContact CG2-SD 4.21Å; L67-M72 HydrophobicContact CD2-CE 3.21Å; T70-M72 WeakPolarHBondContact OG1-CE 3.28Å; M72-G74 PolarHBondContact O-N 3.13Å; M72-V75 PolarHBondContact N-O 3.01Å; M72-V75 WeakPolarHBondContact O-CG2 2.88Å; M72-V75 PolarHBondContact O-N 2.84Å; M72-V77 HydrophobicContact CB-CG1 3.8Å; M72-V77 HydrophobicContact CB-CG2 4.09Å; M72-V77 HydrophobicContact CG-CB 4.42Å; M72-V77 HydrophobicContact CG-CG1 4.09Å; M72-V77 HydrophobicContact CG-CG2 3.45Å; M72-V77 VanDerWaalsContact CG-CG2 3.45Å
73	F	67.1	Low	80	Confident	136 Å²	136	68.5 Å²	68.5	60%	0.596	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	24	179.7	-52.6	-78.5	0	0	0	114.9	E26 I30 V75	E26-F73 HydrophobicContact CB-CE1 4.31Å; E26-F73 HydrophobicContact CB-CE2 3.82Å; E26-F73 HydrophobicContact CB-CZ 3.47Å; E26-F73 VanDerWaalsContact CB-CZ 3.47Å; E26-F73 HydrophobicContact CG-CE1 3.45Å; E26-F73 VanDerWaalsContact CG-CE1 3.45Å; E26-F73 HydrophobicContact CG-CE2 3.88Å; E26-F73 HydrophobicContact CG-CZ 3.06Å; I30-F73 HydrophobicContact CD1-CE2 3.72Å; I30-F73 HydrophobicContact CD1-CZ 3.94Å; F73-V75 VanDerWaalsContact C-N 3.28Å; F73-V75 PolarHBondContact O-N 3.38Å
74	G	78.2	Confident	78.3	Confident	55 Å²	55	70.5 Å²	70.5	57%	0.567	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	-1	-175.6	0	0	0	0	0	115	K71 M72	K71-G74 WeakPolarHBondContact CE-O 3.48Å; M72-G74 PolarHBondContact O-N 3.13Å
75	V	81.4	Confident	76.3	Confident	45 Å²	45	81.2 Å²	81.2	27%	0.273	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	156	171.5	-60	0	0	0	0	111.2	P19 K71 M72 F73 V77	P19-V75 HydrophobicContact CG-CG2 4.48Å; K71-V75 CarbonylContact C-O 3.49Å; K71-V75 WeakPolarHBondContact CA-O 3.32Å; K71-V75 VanDerWaalsContact CG-O 3.27Å; K71-V75 WeakPolarHBondContact CG-O 3.46Å; M72-V75 PolarHBondContact N-O 3.01Å; M72-V75 WeakPolarHBondContact O-CG2 2.88Å; M72-V75 PolarHBondContact O-N 2.84Å; F73-V75 VanDerWaalsContact C-N 3.28Å; F73-V75 PolarHBondContact O-N 3.38Å; V75-V77 HydrophobicContact CG2-CG1 4.25Å
76	R	84.2	Confident	74.6	Confident	194 Å²	194	83.6 Å²	83.6	73%	0.732	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	114.6	174	-62.7	178.2	76.7	-176.9	4.3	108.3	K71	K71-R76 HydrophobicContact CG-CG 4.34Å
77	V	86.1	Confident	72.8	Confident	7 Å²	7	91 Å²	91	4%	0.042	43%	0.427	C	S	.	.			trans	-90.7	148.2	173.4	-62.9	0	0	0	0	109.7	G16 L18 G69 T70 M72 V75 V79	G16-V77 CarbonylContact O-C 3.51Å; G16-V77 WeakPolarHBondContact O-CA 3.36Å; L18-V77 HydrophobicContact CD2-CG1 3.73Å; G69-V77 WeakPolarHBondContact CA-O 3.38Å; G69-V77 PolarHBondContact N-O 3.25Å; T70-V77 WeakPolarHBondContact O-CG2 2.95Å; T70-V77 PolarHBondContact O-N 2.82Å; M72-V77 HydrophobicContact CB-CG1 3.8Å; M72-V77 HydrophobicContact CB-CG2 4.09Å; M72-V77 HydrophobicContact CG-CB 4.42Å; M72-V77 HydrophobicContact CG-CG1 4.09Å; M72-V77 HydrophobicContact CG-CG2 3.45Å; M72-V77 VanDerWaalsContact CG-CG2 3.45Å; V75-V77 HydrophobicContact CG2-CG1 4.25Å; V77-V79 HydrophobicContact CG2-CG2 4.2Å
78	R	85.5	Confident	71.1	Confident	143 Å²	143	97.8 Å²	97.8	54%	0.54	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	123.5	172.7	-178.9	171	175.3	177	-5.1	107.8	V15 G16 E80	V15-R78 CarbonylContact C-O 3.43Å; V15-R78 VanDerWaalsContact CA-O 3.31Å; V15-R78 WeakPolarHBondContact CA-O 3.4Å; G16-R78 PolarHBondContact N-O 2.94Å; G16-R78 PolarHBondContact O-N 3.44Å; R78-E80 IonicContact CZ-OE2 3.66Å; R78-E80 IonicContact NE-OE2 3.68Å; R78-E80 IonicContact NH2-OE2 2.83Å; R78-E80 PolarHBondContact NH2-OE2 3.35Å
79	V	87.1	Confident	69.3	Low	3 Å²	3	104.2 Å²	104.2	2%	0.018	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	124.4	-178	-173.1	0	0	0	0	107.3	V13 F14 V15 F31 V64 L67 D68 V77	V13-V79 HydrophobicContact CG1-CG1 3.35Å; F14-V79 CarbonylContact O-C 3.44Å; F14-V79 WeakPolarHBondContact O-CA 3.16Å; V15-V79 HydrophobicContact CG1-CG2 4.29Å; V15-V79 HydrophobicContact CG2-CG1 4.48Å; F31-V79 HydrophobicContact CE1-CG1 3.9Å; F31-V79 HydrophobicContact CZ-CG1 3.78Å; F31-V79 HydrophobicContact CZ-CG2 4.15Å; V64-V79 HydrophobicContact CB-CG1 4.25Å; V64-V79 HydrophobicContact CG1-CG1 4.49Å; V64-V79 HydrophobicContact CG2-CG1 3.82Å; L67-V79 HydrophobicContact CB-CB 4.21Å; L67-V79 HydrophobicContact CB-CG1 4.34Å; L67-V79 HydrophobicContact CB-CG2 3.77Å; D68-V79 HydrophobicContact CB-CB 4.31Å; D68-V79 VanDerWaalsContact CB-O 3.31Å; D68-V79 WeakPolarHBondContact CB-O 3.45Å; D68-V79 PolarHBondContact OD2-N 3Å; D68-V79 VanDerWaalsContact OD2-N 3.1Å; D68-V79 VanDerWaalsContact OD2-O 3.04Å; V77-V79 HydrophobicContact CG2-CG2 4.2Å
80	E	84.3	Confident	67.4	Low	83 Å²	83	105.2 Å²	105.2	39%	0.388	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	147.2	-174.5	-166.2	172.7	96.5	0	0	109.6	V13 F14 R78 S82	V13-E80 CarbonylContact C-O 3.57Å; V13-E80 WeakPolarHBondContact CA-O 3.48Å; F14-E80 HydrophobicContact CB-CB 4.42Å; F14-E80 HydrophobicContact CD1-CB 4.25Å; F14-E80 PolarHBondContact N-O 3.07Å; F14-E80 PolarHBondContact O-N 3.5Å; R78-E80 IonicContact CZ-OE2 3.66Å; R78-E80 IonicContact NE-OE2 3.68Å; R78-E80 IonicContact NH2-OE2 2.83Å; R78-E80 PolarHBondContact NH2-OE2 3.35Å; E80-S82 PolarHBondContact O-N 2.79Å
81	L	80.7	Confident	65.7	Low	23 Å²	23	107.9 Å²	107.9	12%	0.12	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	120.4	169.5	-77.2	170.6	0	0	0	109.3	V13 A60 L61 V64 H83	V13-L81 HydrophobicContact CG2-CD2 4.25Å; A60-L81 HydrophobicContact CB-CD2 4.08Å; L61-L81 HydrophobicContact CB-CD1 4.36Å; L61-L81 HydrophobicContact CD1-CD1 3.43Å; L61-L81 VanDerWaalsContact CD1-CD1 3.43Å; V64-L81 HydrophobicContact CB-CG 4.24Å; V64-L81 HydrophobicContact CG1-CG 4.26Å; V64-L81 HydrophobicContact CG2-CD2 3.81Å; V64-L81 HydrophobicContact CG2-CG 3.84Å; L81-H83 PolarHBondContact O-CD2 2.98Å; L81-H83 PolarHBondContact O-N 3.38Å
82	S	67.9	Low	64.3	Low	20 Å²	20	104.4 Å²	104.4	14%	0.14	50%	0.502	C	S	.	.			trans	-75.1	93.7	175.1	171.8	0	0	0	0	109.2	K12 E80 G84	K12-S82 WeakPolarHBondContact O-CA 3.21Å; K12-S82 WeakPolarHBondContact O-CB 3.11Å; K12-S82 PolarHBondContact O-N 3.35Å; E80-S82 PolarHBondContact O-N 2.79Å; S82-G84 PolarHBondContact O-N 3.33Å
83	H	60.6	Low	63.2	Low	122 Å²	122	105 Å²	105	57%	0.565	52%	0.518	S	S	*	.			trans	-71	69.5	169	-60.7	-80.5	0	0	0	110.8	L81 R85	L81-H83 PolarHBondContact O-CD2 2.98Å; L81-H83 PolarHBondContact O-N 3.38Å; H83-R85 PolarHBondContact O-N 3.34Å
84	G	49.1	Very low	62.4	Low	42 Å²	42	109.1 Å²	109.1	43%	0.433	53%	0.53	S	S	.	.			trans	-71.4	56	175.3	0	0	0	0	0	112.6	S82 R86	S82-G84 PolarHBondContact O-N 3.33Å; G84-R86 VanDerWaalsContact C-N 3.32Å; G84-R86 PolarHBondContact O-N 2.77Å
85	R	44.4	Very low	60.7	Low	239 Å²	239	117.3 Å²	117.3	90%	0.902	55%	0.545	S	S	*	.			trans	13.1	64.8	166.1	-163.4	-179.3	171.3	-144.6	0.7	115.6	H83 R87	H83-R85 PolarHBondContact O-N 3.34Å; R85-R87 PolarHBondContact O-N 3.49Å
86	R	48.3	Very low	59.1	Low	206 Å²	206	121.7 Å²	121.7	78%	0.777	57%	0.567	S	S	*	*			trans	-94.4	80.9	150	-74.7	-130.2	-162.1	-127.4	4.5	108.4	G84 N88	G84-R86 VanDerWaalsContact C-N 3.32Å; G84-R86 PolarHBondContact O-N 2.77Å; R86-N88 PolarHBondContact O-N 2.97Å
87	R	48.3	Very low	57.4	Low	234 Å²	234	115.8 Å²	115.8	88%	0.883	57%	0.566	S	S	*	*	S	Bend	trans	21.5	69.4	133.6	-150.6	170.6	-165.9	168.3	0.6	115	R85	R85-R87 PolarHBondContact O-N 3.49Å
88	N	49.2	Very low	55.5	Low	145 Å²	145	123.2 Å²	123.2	78%	0.775	60%	0.598	S	S	*	*	S	Bend	trans	-177.2	48.8	142.2	-99.5	19.5	0	0	0	112.3	R86	R86-N88 PolarHBondContact O-N 2.97Å
89	R	45.5	Very low	53.9	Low	219 Å²	219	126.4 Å²	126.4	83%	0.826	61%	0.611	S	S	*	*			trans	-173.8	77.2	146.6	-112.2	169.3	-91.9	-170.1	-6.4	109.1
90	G	41.3	Very low	52.2	Low	62 Å²	62	132 Å²	132	64%	0.639	65%	0.646	S	S	*	*			trans	-51.1	141.7	141.2	0	0	0	0	0	107.2
91	P	45.8	Very low	51	Low	100 Å²	100	134.1 Å²	134.1	65%	0.649	66%	0.66	S	S	*	*			trans	-62.6	145.6	-178.2	38.8	-40.7	0	0	0	105.5	R4 G93	R4-P91 VanDerWaalsContact NH2-C 3.28Å; R4-P91 VanDerWaalsContact NH2-CB 3.27Å; P91-G93 PolarHBondContact O-N 2.94Å
92	P	47.8	Very low	50	Low	79 Å²	79	139 Å²	139	51%	0.513	69%	0.686	S	S	.	*			trans	-68.8	70	176.2	24.5	-32.1	0	0	0	110.7	R4 R94	R4-P92 HydrophobicContact CG-CG 3.69Å; R4-P92 VanDerWaalsContact CZ-C 3.48Å; R4-P92 VanDerWaalsContact NE-CD 3.25Å; R4-P92 PolarHBondContact NH1-O 3Å; R4-P92 VanDerWaalsContact NH2-N 3.14Å; R4-P92 PolarHBondContact NH2-O 3.25Å; P92-R94 PolarHBondContact O-N 2.72Å
93	G	44.3	Very low	49.3	Very low	48 Å²	48	142.1 Å²	142.1	50%	0.495	71%	0.708	S	S	.	*			trans	-68.6	112.7	149.5	0	0	0	0	0	104.5	P91	P91-G93 PolarHBondContact O-N 2.94Å
94	R	49.6	Very low	48.9	Very low	223 Å²	223	142.5 Å²	142.5	84%	0.842	71%	0.708	S	S	*	*	S	Bend		45.7	108.5	89.1	-60.7	-159.9	-175.6	-165.5	4.1	109.3	P92	P92-R94 PolarHBondContact O-N 2.72Å
95	Y	44.2	Very low	49.1	Very low	226 Å²	226	150 Å²	150	89%	0.886	72%	0.723	S	S	*	*			trans	82.1	86.8	178.2	-61.9	-91.3	0	0	0	116.3
96	D	47.1	Very low	49.7	Very low	138 Å²	138	153.6 Å²	153.6	74%	0.738	74%	0.737	S	S	*	*				-151.7	85.1	122.1	-167.9	-129.3	0	0	0	107.4	K98	D96-K98 PolarHBondContact O-N 3.19Å
97	G	49.3	Very low	49.8	Very low	69 Å²	69	151 Å²	151	71%	0.711	74%	0.735	S	S	*	*			trans	-70.5	111.8	155	0	0	0	0	0	106.6
98	K	46	Very low	49.8	Very low	163 Å²	163	146.6 Å²	146.6	71%	0.709	73%	0.727	S	S	*	*			trans	-170.3	149.3	150	-101.1	159.6	-168.9	-166.9	0	107.9	D96	D96-K98 PolarHBondContact O-N 3.19Å
99	Y	50.6	Low	49.9	Very low	211 Å²	211	146.7 Å²	146.7	83%	0.827	72%	0.724	S	S	*	*			trans	76.6	63.7	-164.3	-54	-81.6	0	0	0	113.1
100	T	52.9	Low	50.1	Low	121 Å²	121	142.5 Å²	142.5	74%	0.742	72%	0.718	S	S	*	*				13	81	64.8	-154.5	0	0	0	0	114
101	N	58.7	Low	50.7	Low	127 Å²	127	147.5 Å²	147.5	68%	0.679	72%	0.723	S	S	*	*			trans	-138.3	70.9	144.5	-131.3	-1.2	0	0	0	105.4	S103	N101-S103 PolarHBondContact O-N 3.45Å; N101-S103 PolarHBondContact OD1-OG 3.33Å
102	D	58.4	Low	51	Low	125 Å²	125	150.7 Å²	150.7	67%	0.668	73%	0.728	S	S	*	*				-24.4	89.6	105.7	-168.4	-118.5	0	0	0	112.9
103	S	54.5	Low	51.3	Low	86 Å²	86	155.8 Å²	155.8	60%	0.601	74%	0.743	S	S	*	*			trans	-156.2	75.8	156.4	-77.3	0	0	0	0	106.1	N101	N101-S103 PolarHBondContact O-N 3.45Å; N101-S103 PolarHBondContact OD1-OG 3.33Å
104	K	52.6	Low	51.8	Low	129 Å²	129	164.1 Å²	164.1	56%	0.561	76%	0.762	S	S	*	*				70.3	120.6	90.6	-85.5	-138.2	-174.7	170.1	0	114.2
105	R	52.8	Low	52	Low	199 Å²	199	159.2 Å²	159.2	75%	0.751	76%	0.756	S	S	*	*			trans	76.3	127.1	149.1	-21.5	-152	-176.3	-125.2	12.4	114.2
106	R	56.8	Low	52.7	Low	316 Å²	316	153.1 Å²	153.1	100%	1.192	74%	0.744	S	S	*	*			cis	-148.9	0	28.2	-75.7	178.6	171.1	160.9	-2.7	110.2

Retrieved 106 of 106 residues in 192.2 ms (Link to these results)

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