A0A077Z3R9_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z3R9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 97 aa.

						>A0A077Z3R9_TRITR|A0A077Z3R9
MVTKGIWRRRWSKEPSYCVVRKVEPEMDRWLMHGKMWADWVLRGKPLGVYLFTKELNRCDWHLIHKHEEADFKRPVEPPKLRMPAKTPLPLLERYNR
					

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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	92.8	Very high	90.9	Very high	23 Å²	23	71.4 Å²	71.4	11%	0.113	30%	0.295	C	S	.	.				0	151.8	0	176.2	170	61.2	0	0	109.5	Y17 V19 I64 E69 F72 K73	M1-Y17 HydrophobicContact CG-CD2 3.91Å; M1-Y17 HydrophobicContact CG-CG 4.07Å; M1-Y17 HydrophobicContact SD-CD1 4.03Å; M1-Y17 HydrophobicContact SD-CD2 3.24Å; M1-Y17 WeakPolarHBondContact SD-CD2 3.41Å; M1-Y17 HydrophobicContact SD-CE1 4.48Å; M1-Y17 HydrophobicContact SD-CE2 3.78Å; M1-Y17 HydrophobicContact SD-CG 3.39Å; M1-V19 HydrophobicContact CG-CG2 4.49Å; M1-I64 HydrophobicContact CB-CB 4.35Å; M1-I64 HydrophobicContact CE-CB 4.03Å; M1-I64 HydrophobicContact CE-CD1 3.69Å; M1-I64 HydrophobicContact CE-CG1 4.46Å; M1-I64 HydrophobicContact CE-CG2 3.74Å; M1-I64 HydrophobicContact CG-CD1 4.3Å; M1-I64 PolarHBondContact O-N 2.74Å; M1-E69 HydrophobicContact CB-CG 4.27Å; M1-E69 VanDerWaalsContact CB-OE1 3.22Å; M1-E69 WeakPolarHBondContact CB-OE1 3.43Å; M1-E69 HydrophobicContact CE-CB 3.89Å; M1-E69 HydrophobicContact CE-CG 3.84Å; M1-E69 PolarHBondContact N-OE1 3.4Å; M1-F72 HydrophobicContact CE-CB 4.01Å; M1-F72 HydrophobicContact CE-CD1 3.93Å; M1-F72 HydrophobicContact CE-CG 4.27Å; M1-K73 HydrophobicContact CE-CG 4.41Å; M1-K73 HydrophobicContact SD-CG 4.35Å
2	V	93.7	Very high	90.4	Very high	25 Å²	25	74 Å²	74	15%	0.152	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	151.2	177	-62.4	0	0	0	0	111.9	Y17 C18 V20 W61 H62 L63	V2-Y17 CarbonylContact O-C 3.59Å; V2-Y17 WeakPolarHBondContact O-CA 3.05Å; V2-C18 HydrophobicContact CG2-CB 3.83Å; V2-C18 PolarHBondContact N-O 3.44Å; V2-C18 PolarHBondContact O-N 3.11Å; V2-V20 HydrophobicContact CG2-CG2 4.1Å; V2-W61 HydrophobicContact CB-CE3 4.3Å; V2-W61 HydrophobicContact CG2-CE3 3.99Å; V2-W61 HydrophobicContact CG2-CZ3 3.99Å; V2-H62 WeakPolarHBondContact CA-O 3.47Å; V2-L63 HydrophobicContact CG1-CD1 4.11Å
3	T	93.6	Very high	90	Very high	1 Å²	1	80.5 Å²	80.5	1%	0.006	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	161.1	175.7	-171	0	0	0	0	110.4	S16 W61 H62 I64 F72	T3-S16 PolarHBondContact OG1-O 2.75Å; T3-W61 CarbonylContact O-C 3.48Å; T3-W61 WeakPolarHBondContact O-CA 3.36Å; T3-H62 HydrophobicContact CG2-CB 4.07Å; T3-H62 PolarHBondContact N-O 3.45Å; T3-H62 PolarHBondContact O-N 2.86Å; T3-I64 HydrophobicContact CG2-CD1 3.8Å; T3-I64 HydrophobicContact CG2-CG1 3.96Å; T3-F72 HydrophobicContact CG2-CZ 4.37Å
4	K	92.6	Very high	89.8	Confident	21 Å²	21	76 Å²	76	9%	0.091	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	141.8	170.7	-71.7	-171.6	163.7	-177.4	0	111.2	I6 W7 R8 E55 D60 W61	K4-I6 VanDerWaalsContact C-N 3.28Å; K4-I6 HydrophobicContact CB-CG2 4Å; K4-I6 HydrophobicContact CD-CG2 4.32Å; K4-I6 PolarHBondContact O-N 3.19Å; K4-W7 HydrophobicContact CB-CD2 3.61Å; K4-W7 HydrophobicContact CB-CE3 3.84Å; K4-W7 HydrophobicContact CB-CG 3.93Å; K4-W7 HydrophobicContact CB-CZ2 4.34Å; K4-W7 HydrophobicContact CB-CZ3 4.28Å; K4-W7 HydrophobicContact CD-CD2 4.44Å; K4-W7 HydrophobicContact CD-CH2 4.25Å; K4-W7 HydrophobicContact CD-CZ2 3.72Å; K4-W7 HydrophobicContact CG-CD2 4.17Å; K4-W7 HydrophobicContact CG-CE3 4.25Å; K4-W7 HydrophobicContact CG-CH2 4.06Å; K4-W7 HydrophobicContact CG-CZ2 3.97Å; K4-W7 HydrophobicContact CG-CZ3 4.2Å; K4-W7 VanDerWaalsContact N-CE3 3.32Å; K4-W7 WeakPolarHBondContact O-CB 3.31Å; K4-W7 PolarHBondContact O-N 3.11Å; K4-W7 VanDerWaalsContact O-N 3.13Å; K4-R8 PolarHBondContact O-N 3.41Å; K4-E55 PolarHBondContact NZ-O 3.15Å; K4-D60 CarbonylContact C-O 3.54Å; K4-D60 WeakPolarHBondContact CA-O 3.19Å; K4-W61 HydrophobicContact CD-CH2 4.3Å; K4-W61 HydrophobicContact CD-CZ2 4.24Å; K4-W61 HydrophobicContact CG-CD2 3.88Å; K4-W61 HydrophobicContact CG-CE3 3.7Å; K4-W61 HydrophobicContact CG-CH2 4.05Å; K4-W61 HydrophobicContact CG-CZ2 4.21Å; K4-W61 HydrophobicContact CG-CZ3 3.78Å
5	G	91.2	Very high	89.9	Confident	9 Å²	9	72 Å²	72	9%	0.093	32%	0.322	C	S	.	.	H	α-helix	trans	-59.8	-38.8	174.2	0	0	0	0	0	111.9	W7 R8 R9 D60	G5-W7 VanDerWaalsContact C-N 3.25Å; G5-W7 PolarHBondContact O-N 2.74Å; G5-R8 PolarHBondContact O-N 2.96Å; G5-R9 WeakPolarHBondContact O-CG 3.33Å; G5-R9 PolarHBondContact O-N 3.49Å; G5-D60 WeakPolarHBondContact CA-OD1 3.01Å; G5-D60 PolarHBondContact N-O 2.92Å; G5-D60 PolarHBondContact N-OD1 3.16Å
6	I	90.3	Very high	90.1	Very high	88 Å²	88	67.7 Å²	67.7	45%	0.451	30%	0.303	S	S	.	.	H	α-helix	trans	-59.6	-35.1	175.4	-160.4	166.5	0	0	0	112.8	K4 R9 R10 D60	K4-I6 VanDerWaalsContact C-N 3.28Å; K4-I6 HydrophobicContact CB-CG2 4Å; K4-I6 HydrophobicContact CD-CG2 4.32Å; K4-I6 PolarHBondContact O-N 3.19Å; I6-R9 PolarHBondContact O-N 3.29Å; I6-R10 VanDerWaalsContact O-CB 3.31Å; I6-R10 WeakPolarHBondContact O-CB 3.35Å; I6-R10 PolarHBondContact O-N 3.2Å; I6-D60 WeakPolarHBondContact CG2-OD2 3.43Å; I6-D60 PolarHBondContact N-OD1 3.19Å
7	W	91.4	Very high	90.3	Very high	22 Å²	22	65.5 Å²	65.5	8%	0.083	29%	0.293	C	S	.	.	H	α-helix	trans	-70.6	-44.5	178.1	-58.6	-21.8	0	0	0	111.2	K4 G5 R9 R10 W11 W40 W61	K4-W7 HydrophobicContact CB-CD2 3.61Å; K4-W7 HydrophobicContact CB-CE3 3.84Å; K4-W7 HydrophobicContact CB-CG 3.93Å; K4-W7 HydrophobicContact CB-CZ2 4.34Å; K4-W7 HydrophobicContact CB-CZ3 4.28Å; K4-W7 HydrophobicContact CD-CD2 4.44Å; K4-W7 HydrophobicContact CD-CH2 4.25Å; K4-W7 HydrophobicContact CD-CZ2 3.72Å; K4-W7 HydrophobicContact CG-CD2 4.17Å; K4-W7 HydrophobicContact CG-CE3 4.25Å; K4-W7 HydrophobicContact CG-CH2 4.06Å; K4-W7 HydrophobicContact CG-CZ2 3.97Å; K4-W7 HydrophobicContact CG-CZ3 4.2Å; K4-W7 VanDerWaalsContact N-CE3 3.32Å; K4-W7 WeakPolarHBondContact O-CB 3.31Å; K4-W7 PolarHBondContact O-N 3.11Å; K4-W7 VanDerWaalsContact O-N 3.13Å; G5-W7 VanDerWaalsContact C-N 3.25Å; G5-W7 PolarHBondContact O-N 2.74Å; W7-R9 VanDerWaalsContact C-N 3.27Å; W7-R9 PolarHBondContact O-N 3.05Å; W7-R10 PolarHBondContact O-N 3.36Å; W7-W11 HydrophobicContact CB-CE3 4.49Å; W7-W11 AromaticContact CD1-CZ3 3.89Å; W7-W11 CarbonylContact O-C 3.49Å; W7-W11 PolarHBondContact O-N 3.12Å; W7-W40 AromaticContact CH2-NE1 3.55Å; W7-W40 HydrophobicContact CZ2-CZ2 4.26Å; W7-W40 AromaticContact CZ2-NE1 3.71Å; W7-W61 HydrophobicContact CH2-CH2 4.25Å; W7-W61 HydrophobicContact CH2-CZ3 4.12Å; W7-W61 HydrophobicContact CZ3-CZ3 4.36Å
8	R	87.7	Confident	90.6	Very high	119 Å²	119	61.8 Å²	61.8	45%	0.449	28%	0.276	S	S	.	.	H	α-helix	trans	-59.2	-38.4	174.8	-77.9	-172.2	164.3	-148.5	-0.6	112.2	K4 G5 S12 F72	K4-R8 PolarHBondContact O-N 3.41Å; G5-R8 PolarHBondContact O-N 2.96Å; R8-S12 WeakPolarHBondContact O-CA 3.48Å; R8-S12 WeakPolarHBondContact O-CB 3.44Å; R8-S12 PolarHBondContact O-N 3.1Å; R8-F72 VanDerWaalsContact NH2-CE2 3.27Å
9	R	89.2	Confident	90.8	Very high	228 Å²	228	61.4 Å²	61.4	86%	0.86	28%	0.279	S	S	*	.	H	α-helix	trans	-71.3	-44.4	177.9	-72	-179	-174.2	173.3	2.9	112.7	G5 I6 W7	G5-R9 WeakPolarHBondContact O-CG 3.33Å; G5-R9 PolarHBondContact O-N 3.49Å; I6-R9 PolarHBondContact O-N 3.29Å; W7-R9 VanDerWaalsContact C-N 3.27Å; W7-R9 PolarHBondContact O-N 3.05Å
10	R	89.7	Confident	91	Very high	182 Å²	182	61.3 Å²	61.3	69%	0.687	28%	0.283	S	S	*	.	H	α-helix	trans	-81.5	-34.6	-173.3	-166.1	169.6	-176.5	173.8	2.9	113.3	I6 W7	I6-R10 VanDerWaalsContact O-CB 3.31Å; I6-R10 WeakPolarHBondContact O-CB 3.35Å; I6-R10 PolarHBondContact O-N 3.2Å; W7-R10 PolarHBondContact O-N 3.36Å
11	W	87.5	Confident	91.2	Very high	67 Å²	67	66.8 Å²	66.8	25%	0.254	30%	0.301	S	S	.	.			trans	-134.9	61.4	-175.5	-56	-71.4	0	0	0	110.7	W7 K13 E14 L42 R43	W7-W11 HydrophobicContact CB-CE3 4.49Å; W7-W11 AromaticContact CD1-CZ3 3.89Å; W7-W11 CarbonylContact O-C 3.49Å; W7-W11 PolarHBondContact O-N 3.12Å; W11-K13 PolarHBondContact O-N 2.64Å; W11-K13 VanDerWaalsContact O-N 3.12Å; W11-E14 HydrophobicContact CB-CB 4.25Å; W11-E14 PolarHBondContact O-N 2.82Å; W11-E14 VanDerWaalsContact O-O 3.07Å; W11-L42 HydrophobicContact CZ3-CD1 4.48Å; W11-R43 HydrophobicContact CD2-CG 4.16Å; W11-R43 HydrophobicContact CE3-CG 4.48Å; W11-R43 HydrophobicContact CG-CG 4.17Å
12	S	84.9	Confident	91.4	Very high	103 Å²	103	71 Å²	71	72%	0.72	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-27.1	-177.4	58.9	0	0	0	0	114.3	R8	R8-S12 WeakPolarHBondContact O-CA 3.48Å; R8-S12 WeakPolarHBondContact O-CB 3.44Å; R8-S12 PolarHBondContact O-N 3.1Å
13	K	84.9	Confident	91.4	Very high	159 Å²	159	73.9 Å²	73.9	69%	0.691	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-15	178.9	-62.9	-173.6	-179.4	-176.7	0	113.6	W11 V76	W11-K13 PolarHBondContact O-N 2.64Å; W11-K13 VanDerWaalsContact O-N 3.12Å; K13-V76 HydrophobicContact CB-CG1 4.46Å; K13-V76 WeakPolarHBondContact O-CB 3.32Å; K13-V76 VanDerWaalsContact O-CG1 3.31Å; K13-V76 WeakPolarHBondContact O-CG1 3.49Å; K13-V76 WeakPolarHBondContact O-CG2 3.24Å
14	E	88.1	Confident	91.4	Very high	17 Å²	17	77.8 Å²	77.8	8%	0.079	35%	0.354	C	S	.	.	S	Bend	trans	-117.8	112.2	-174.3	-58.2	167.9	149	0	0	109.4	W11 S16 R43 P79	W11-E14 HydrophobicContact CB-CB 4.25Å; W11-E14 PolarHBondContact O-N 2.82Å; W11-E14 VanDerWaalsContact O-O 3.07Å; E14-S16 PolarHBondContact O-N 3.49Å; E14-S16 PolarHBondContact O-OG 3.5Å; E14-R43 HydrophobicContact CB-CB 3.92Å; E14-R43 HydrophobicContact CB-CG 4.31Å; E14-R43 IonicContact OE1-CZ 3.71Å; E14-R43 IonicContact OE1-NE 3.24Å; E14-R43 IonicContact OE1-NH2 2.84Å; E14-R43 PolarHBondContact OE1-NH2 2.96Å; E14-R43 WeakPolarHBondContact OE2-CG 3.45Å; E14-R43 IonicContact OE2-CZ 3.68Å; E14-R43 VanDerWaalsContact OE2-CZ 3.28Å; E14-R43 IonicContact OE2-NE 3.66Å; E14-R43 PolarHBondContact OE2-NE 2.94Å; E14-R43 IonicContact OE2-NH2 2.82Å; E14-R43 PolarHBondContact OE2-NH2 3.24Å; E14-R43 VanDerWaalsContact OE2-NH2 3.1Å; E14-P79 WeakPolarHBondContact OE1-CD 2.92Å
15	P	90.7	Very high	91.3	Very high	16 Å²	16	80 Å²	80	10%	0.104	37%	0.371	C	S	.	.			trans	-66.6	129.2	-170.5	27	-34.7	0	0	0	110.9	Y17 R43 G44 F72	P15-Y17 HydrophobicContact CB-CD1 4.28Å; P15-Y17 HydrophobicContact CB-CE1 4.24Å; P15-R43 CarbonylContact O-C 3.53Å; P15-R43 PolarHBondContact O-N 3.49Å; P15-G44 PolarHBondContact O-N 2.93Å; P15-F72 HydrophobicContact CB-CD1 4.44Å; P15-F72 HydrophobicContact CB-CE1 4.34Å; P15-F72 WeakPolarHBondContact CB-O 3.33Å
16	S	92.9	Very high	91.2	Very high	3 Å²	3	84.7 Å²	84.7	2%	0.021	39%	0.391	C	S	.	.			trans	-128.7	123.8	175.2	-56.2	0	0	0	0	109	T3 E14 V41 R43	T3-S16 PolarHBondContact OG1-O 2.75Å; E14-S16 PolarHBondContact O-N 3.49Å; E14-S16 PolarHBondContact O-OG 3.5Å; S16-V41 CarbonylContact C-O 3.58Å; S16-V41 VanDerWaalsContact CA-O 3.27Å; S16-V41 WeakPolarHBondContact CA-O 3.2Å; S16-R43 PolarHBondContact OG-N 3.28Å
17	Y	94.3	Very high	91.2	Very high	30 Å²	30	89 Å²	89	12%	0.118	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	163.7	-174.3	56.4	-97.1	0	0	0	111.3	M1 V2 P15 V19 V41 F72 K73	M1-Y17 HydrophobicContact CG-CD2 3.91Å; M1-Y17 HydrophobicContact CG-CG 4.07Å; M1-Y17 HydrophobicContact SD-CD1 4.03Å; M1-Y17 HydrophobicContact SD-CD2 3.24Å; M1-Y17 WeakPolarHBondContact SD-CD2 3.41Å; M1-Y17 HydrophobicContact SD-CE1 4.48Å; M1-Y17 HydrophobicContact SD-CE2 3.78Å; M1-Y17 HydrophobicContact SD-CG 3.39Å; V2-Y17 CarbonylContact O-C 3.59Å; V2-Y17 WeakPolarHBondContact O-CA 3.05Å; P15-Y17 HydrophobicContact CB-CD1 4.28Å; P15-Y17 HydrophobicContact CB-CE1 4.24Å; Y17-V19 HydrophobicContact CD2-CG2 4.13Å; Y17-V19 HydrophobicContact CE2-CG2 4.12Å; Y17-V41 HydrophobicContact CD1-CB 4.37Å; Y17-V41 HydrophobicContact CD2-CB 4.04Å; Y17-V41 HydrophobicContact CD2-CG2 4.15Å; Y17-V41 HydrophobicContact CE1-CB 4.07Å; Y17-V41 HydrophobicContact CE1-CG1 3.94Å; Y17-V41 HydrophobicContact CE2-CB 3.71Å; Y17-V41 HydrophobicContact CE2-CG1 4.35Å; Y17-V41 HydrophobicContact CE2-CG2 3.47Å; Y17-V41 VanDerWaalsContact CE2-CG2 3.47Å; Y17-V41 HydrophobicContact CG-CB 4.36Å; Y17-V41 PolarHBondContact N-O 2.8Å; Y17-V41 PolarHBondContact O-N 3.16Å; Y17-V41 VanDerWaalsContact O-O 3.09Å; Y17-F72 AromaticContact CD1-CD1 3.83Å; Y17-F72 HydrophobicContact CD1-CD1 3.83Å; Y17-F72 AromaticContact CD1-CE1 3.87Å; Y17-F72 HydrophobicContact CD1-CE1 3.87Å; Y17-F72 HydrophobicContact CG-CD1 4.42Å; Y17-F72 HydrophobicContact CG-CE1 4.38Å; Y17-K73 HydrophobicContact CE1-CG 4.04Å; Y17-K73 HydrophobicContact CE2-CG 4.45Å
18	C	94.7	Very high	90.9	Very high	0 Å²	0	90 Å²	90	0%	0	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	131	174	-62.9	0	0	0	0	109.3	V2 A38 D39 W40	V2-C18 HydrophobicContact CG2-CB 3.83Å; V2-C18 PolarHBondContact N-O 3.44Å; V2-C18 PolarHBondContact O-N 3.11Å; C18-A38 HydrophobicContact CB-CB 3.74Å; C18-D39 WeakPolarHBondContact CA-O 3.45Å; C18-W40 VanDerWaalsContact SG-CD1 3.59Å
19	V	95.4	Very high	91	Very high	54 Å²	54	94.9 Å²	94.9	33%	0.327	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	108	169.3	-176.4	0	0	0	0	107.8	M1 Y17 R21 A38 D39	M1-V19 HydrophobicContact CG-CG2 4.49Å; Y17-V19 HydrophobicContact CD2-CG2 4.13Å; Y17-V19 HydrophobicContact CE2-CG2 4.12Å; V19-R21 PolarHBondContact O-N 3.38Å; V19-A38 CarbonylContact O-C 3.53Å; V19-A38 WeakPolarHBondContact O-CA 3.13Å; V19-A38 WeakPolarHBondContact O-CB 3.47Å; V19-D39 HydrophobicContact CB-CB 4.26Å; V19-D39 PolarHBondContact N-O 3.21Å; V19-D39 PolarHBondContact O-N 3.22Å
20	V	94.9	Very high	91	Very high	59 Å²	59	92.3 Å²	92.3	36%	0.358	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	127.1	-176.5	-176.6	0	0	0	0	110	V2 V23 M36	V2-V20 HydrophobicContact CG2-CG2 4.1Å; V20-V23 HydrophobicContact CG1-CG2 3.41Å; V20-V23 VanDerWaalsContact CG1-CG2 3.41Å; V20-M36 HydrophobicContact CG1-CG 4.1Å; V20-M36 HydrophobicContact CG1-SD 4.34Å; V20-M36 HydrophobicContact CG2-CG 4.42Å; V20-M36 HydrophobicContact CG2-SD 3.66Å
21	R	95.7	Very high	90.8	Very high	177 Å²	177	88.9 Å²	88.9	67%	0.668	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	-45	175.3	-74.7	-155	179.5	-141.2	0.8	113	V19 W37 D39	V19-R21 PolarHBondContact O-N 3.38Å; R21-W37 PolarHBondContact N-O 3.08Å; R21-D39 IonicContact CZ-OD1 3.41Å; R21-D39 IonicContact CZ-OD2 3.65Å; R21-D39 VanDerWaalsContact CZ-OD2 3.24Å; R21-D39 IonicContact NE-OD1 3.7Å; R21-D39 PolarHBondContact NE-OD1 3.17Å; R21-D39 IonicContact NE-OD2 3.91Å; R21-D39 PolarHBondContact NE-OD2 3.41Å; R21-D39 IonicContact NH2-OD1 3.1Å; R21-D39 IonicContact NH2-OD2 2.74Å; R21-D39 PolarHBondContact NH2-OD2 3.43Å
22	K	95.6	Very high	90.7	Very high	111 Å²	111	88.6 Å²	88.6	48%	0.483	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	143.7	-179.5	-175.6	-175.4	174.9	-162.9	0	108.9	E24 W37	K22-E24 IonicContact NZ-OE2 3.62Å; K22-W37 HydrophobicContact CB-CB 4.13Å; K22-W37 HydrophobicContact CB-CD2 4.23Å; K22-W37 HydrophobicContact CB-CE3 3.78Å; K22-W37 HydrophobicContact CB-CG 4.41Å; K22-W37 HydrophobicContact CD-CD2 4.23Å; K22-W37 HydrophobicContact CD-CE3 3.81Å; K22-W37 HydrophobicContact CD-CH2 4.45Å; K22-W37 HydrophobicContact CD-CZ3 3.95Å; K22-W37 HydrophobicContact CG-CD2 4.45Å; K22-W37 HydrophobicContact CG-CE3 3.74Å; K22-W37 HydrophobicContact CG-CZ3 4.06Å; K22-W37 PolarHBondContact N-O 3.16Å; K22-W37 PolarHBondContact O-N 3.29Å
23	V	93.6	Very high	90.7	Very high	86 Å²	86	88.9 Å²	88.9	52%	0.521	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	138	171.3	-170.6	0	0	0	0	107.7	V20 K35 M36	V20-V23 HydrophobicContact CG1-CG2 3.41Å; V20-V23 VanDerWaalsContact CG1-CG2 3.41Å; V23-K35 WeakPolarHBondContact CA-O 3.27Å; V23-M36 HydrophobicContact CG2-CG 4.47Å
24	E	93.7	Very high	91	Very high	82 Å²	82	82 Å²	82	38%	0.383	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	92.7	174.1	-175	179.6	125.5	0	0	107	K22 G34 K35 W37	K22-E24 IonicContact NZ-OE2 3.62Å; E24-G34 CarbonylContact O-C 3.5Å; E24-G34 WeakPolarHBondContact O-CA 3.42Å; E24-K35 HydrophobicContact CB-CB 4.46Å; E24-K35 PolarHBondContact N-O 3.35Å; E24-K35 PolarHBondContact O-N 2.87Å; E24-K35 IonicContact OE1-NZ 2.64Å; E24-W37 HydrophobicContact CB-CH2 3.93Å; E24-W37 HydrophobicContact CB-CZ3 3.6Å; E24-W37 WeakPolarHBondContact OE2-CH2 3.31Å
25	P	91.7	Very high	91.2	Very high	67 Å²	67	84.8 Å²	84.8	44%	0.435	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	144.8	179.3	29	-33.2	0	0	0	110.5	L31 H33	P25-L31 HydrophobicContact CB-CD2 4.26Å; P25-H33 WeakPolarHBondContact CA-O 3.44Å
26	E	89.1	Confident	91.4	Very high	109 Å²	109	84.8 Å²	84.8	51%	0.509	40%	0.398	S	S	.	.			trans	-74.3	139.3	161.4	-77.1	175.3	-178.1	0	0	108.1	D28 H33	E26-D28 PolarHBondContact O-N 3.27Å; E26-D28 VanDerWaalsContact O-OD1 3.14Å; E26-H33 HydrophobicContact CB-CB 4.1Å; E26-H33 PolarHBondContact N-O 3.27Å; E26-H33 WeakPolarHBondContact OE2-CB 3.27Å
27	M	89.4	Confident	91.5	Very high	177 Å²	177	87.5 Å²	87.5	87%	0.872	41%	0.408	S	S	*	.			trans	-77.6	56.7	-179.8	-68.7	-66.2	-68.7	0	0	111	L31	M27-L31 HydrophobicContact SD-CD2 4.3Å
28	D	86.2	Confident	91.6	Very high	44 Å²	44	86.1 Å²	86.1	24%	0.235	40%	0.402	C	S	.	.			trans	-83.1	164.4	170.4	70.7	-29.1	0	0	0	110.8	E26 W30 L31 M32 H33	E26-D28 PolarHBondContact O-N 3.27Å; E26-D28 VanDerWaalsContact O-OD1 3.14Å; D28-W30 PolarHBondContact O-N 3.36Å; D28-L31 PolarHBondContact O-N 3.47Å; D28-L31 WeakPolarHBondContact OD1-CA 3.29Å; D28-L31 PolarHBondContact OD1-N 2.98Å; D28-M32 PolarHBondContact OD1-N 3.24Å; D28-M32 PolarHBondContact OD2-N 2.81Å; D28-H33 IonicContact OD2-CE1 2.79Å; D28-H33 IonicContact OD2-CG 3.7Å; D28-H33 IonicContact OD2-ND1 3.85Å; D28-H33 PolarHBondContact OD2-ND1 3.23Å
29	R	89.2	Confident	91.7	Very high	222 Å²	222	88 Å²	88	84%	0.838	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-25.1	-175.2	-175.3	175.4	-171.8	173.8	4.4	113.9
30	W	88.1	Confident	91.6	Very high	174 Å²	174	87.7 Å²	87.7	66%	0.659	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.4	5.7	-168.9	-61.2	115.3	0	0	0	114.3	D28 M32	D28-W30 PolarHBondContact O-N 3.36Å; W30-M32 HydrophobicContact CB-CE 3.25Å; W30-M32 HydrophobicContact CB-CG 3.5Å; W30-M32 HydrophobicContact CB-SD 3.79Å; W30-M32 HydrophobicContact CD2-CE 4.17Å; W30-M32 HydrophobicContact CG-CE 3.44Å; W30-M32 VanDerWaalsContact CG-CE 3.44Å; W30-M32 HydrophobicContact CG-SD 4.34Å; W30-M32 PolarHBondContact O-N 3.36Å
31	L	86.8	Confident	91.6	Very high	109 Å²	109	85.6 Å²	85.6	57%	0.571	39%	0.393	S	S	*	.	S	Bend	trans	51.1	41.5	-177.2	-58.4	173.3	0	0	0	112.6	P25 M27 D28	P25-L31 HydrophobicContact CB-CD2 4.26Å; M27-L31 HydrophobicContact SD-CD2 4.3Å; D28-L31 PolarHBondContact O-N 3.47Å; D28-L31 WeakPolarHBondContact OD1-CA 3.29Å; D28-L31 PolarHBondContact OD1-N 2.98Å
32	M	84.2	Confident	91.4	Very high	61 Å²	61	79.2 Å²	79.2	30%	0.3	37%	0.371	S	S	.	.			trans	-91.2	-19.7	-174.4	-61.1	-177.5	177.3	0	0	113	D28 W30 R58	D28-M32 PolarHBondContact OD1-N 3.24Å; D28-M32 PolarHBondContact OD2-N 2.81Å; W30-M32 HydrophobicContact CB-CE 3.25Å; W30-M32 HydrophobicContact CB-CG 3.5Å; W30-M32 HydrophobicContact CB-SD 3.79Å; W30-M32 HydrophobicContact CD2-CE 4.17Å; W30-M32 HydrophobicContact CG-CE 3.44Å; W30-M32 VanDerWaalsContact CG-CE 3.44Å; W30-M32 HydrophobicContact CG-SD 4.34Å; W30-M32 PolarHBondContact O-N 3.36Å; M32-R58 VanDerWaalsContact CG-CZ 3.46Å; M32-R58 PolarHBondContact SD-NE 2.89Å; M32-R58 PolarHBondContact SD-NH1 2.91Å; M32-R58 PolarHBondContact SD-NH2 2.94Å
33	H	86.3	Confident	91.1	Very high	110 Å²	110	78.2 Å²	78.2	51%	0.509	36%	0.364	S	S	.	.			trans	-117.5	161.9	-173.1	-56.1	90.2	0	0	0	110.1	P25 E26 D28	P25-H33 WeakPolarHBondContact CA-O 3.44Å; E26-H33 HydrophobicContact CB-CB 4.1Å; E26-H33 PolarHBondContact N-O 3.27Å; E26-H33 WeakPolarHBondContact OE2-CB 3.27Å; D28-H33 IonicContact OD2-CE1 2.79Å; D28-H33 IonicContact OD2-CG 3.7Å; D28-H33 IonicContact OD2-ND1 3.85Å; D28-H33 PolarHBondContact OD2-ND1 3.23Å
34	G	90.2	Very high	90.8	Very high	13 Å²	13	76 Å²	76	13%	0.134	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	151.9	-166.9	-177.4	0	0	0	0	0	113.2	E24 L56	E24-G34 CarbonylContact O-C 3.5Å; E24-G34 WeakPolarHBondContact O-CA 3.42Å; G34-L56 VanDerWaalsContact O-CD1 3.24Å; G34-L56 WeakPolarHBondContact O-CD1 3.34Å
35	K	93.2	Very high	90.5	Very high	77 Å²	77	78.8 Å²	78.8	34%	0.335	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	143.6	179.7	-58.1	171.4	-168	155	0	109.6	V23 E24 W37 L51 F52 T53	V23-K35 WeakPolarHBondContact CA-O 3.27Å; E24-K35 HydrophobicContact CB-CB 4.46Å; E24-K35 PolarHBondContact N-O 3.35Å; E24-K35 PolarHBondContact O-N 2.87Å; E24-K35 IonicContact OE1-NZ 2.64Å; K35-W37 HydrophobicContact CB-CH2 4.03Å; K35-W37 HydrophobicContact CB-CZ3 4Å; K35-W37 HydrophobicContact CD-CH2 4.44Å; K35-L51 HydrophobicContact CB-CD1 4.11Å; K35-F52 WeakPolarHBondContact CA-O 3.49Å; K35-T53 HydrophobicContact CD-CG2 4.16Å; K35-T53 HydrophobicContact CG-CG2 4.01Å
36	M	93.7	Very high	90.5	Very high	16 Å²	16	80.7 Å²	80.7	8%	0.079	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	129.2	178.6	178.9	-176.5	74.8	0	0	110.1	V20 V23 A38 F52 L56 W61	V20-M36 HydrophobicContact CG1-CG 4.1Å; V20-M36 HydrophobicContact CG1-SD 4.34Å; V20-M36 HydrophobicContact CG2-CG 4.42Å; V20-M36 HydrophobicContact CG2-SD 3.66Å; V23-M36 HydrophobicContact CG2-CG 4.47Å; M36-A38 HydrophobicContact CE-CB 4.17Å; M36-A38 HydrophobicContact CG-CB 4.45Å; M36-F52 HydrophobicContact CB-CB 4.3Å; M36-F52 HydrophobicContact CE-CB 4.2Å; M36-F52 HydrophobicContact CE-CD2 3.41Å; M36-F52 VanDerWaalsContact CE-CD2 3.41Å; M36-F52 HydrophobicContact CE-CE2 3.91Å; M36-F52 HydrophobicContact CE-CG 3.82Å; M36-F52 PolarHBondContact N-O 2.96Å; M36-F52 PolarHBondContact O-N 2.99Å; M36-L56 HydrophobicContact CB-CD2 4.47Å; M36-W61 HydrophobicContact CE-CH2 4Å; M36-W61 HydrophobicContact CE-CZ2 4.41Å; M36-W61 HydrophobicContact CE-CZ3 4.39Å
37	W	96.1	Very high	90.7	Very high	60 Å²	60	80.1 Å²	80.1	23%	0.227	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	126.2	166.5	-63.2	-103.3	0	0	0	108.3	R21 K22 E24 K35 V49 Y50 L51	R21-W37 PolarHBondContact N-O 3.08Å; K22-W37 HydrophobicContact CB-CB 4.13Å; K22-W37 HydrophobicContact CB-CD2 4.23Å; K22-W37 HydrophobicContact CB-CE3 3.78Å; K22-W37 HydrophobicContact CB-CG 4.41Å; K22-W37 HydrophobicContact CD-CD2 4.23Å; K22-W37 HydrophobicContact CD-CE3 3.81Å; K22-W37 HydrophobicContact CD-CH2 4.45Å; K22-W37 HydrophobicContact CD-CZ3 3.95Å; K22-W37 HydrophobicContact CG-CD2 4.45Å; K22-W37 HydrophobicContact CG-CE3 3.74Å; K22-W37 HydrophobicContact CG-CZ3 4.06Å; K22-W37 PolarHBondContact N-O 3.16Å; K22-W37 PolarHBondContact O-N 3.29Å; E24-W37 HydrophobicContact CB-CH2 3.93Å; E24-W37 HydrophobicContact CB-CZ3 3.6Å; E24-W37 WeakPolarHBondContact OE2-CH2 3.31Å; K35-W37 HydrophobicContact CB-CH2 4.03Å; K35-W37 HydrophobicContact CB-CZ3 4Å; K35-W37 HydrophobicContact CD-CH2 4.44Å; W37-V49 HydrophobicContact CB-CG1 4.4Å; W37-Y50 WeakPolarHBondContact CA-O 3.41Å; W37-L51 HydrophobicContact CD2-CD1 3.86Å; W37-L51 HydrophobicContact CE3-CD1 4.4Å; W37-L51 HydrophobicContact CG-CD1 4.22Å; W37-L51 HydrophobicContact CH2-CD1 4.35Å; W37-L51 HydrophobicContact CZ2-CD1 3.82Å
38	A	96.1	Very high	90.9	Very high	0 Å²	0	73.3 Å²	73.3	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	146.3	179.1	0	0	0	0	0	111.9	C18 V19 M36 W40 V49 Y50 F52	C18-A38 HydrophobicContact CB-CB 3.74Å; V19-A38 CarbonylContact O-C 3.53Å; V19-A38 WeakPolarHBondContact O-CA 3.13Å; V19-A38 WeakPolarHBondContact O-CB 3.47Å; M36-A38 HydrophobicContact CE-CB 4.17Å; M36-A38 HydrophobicContact CG-CB 4.45Å; A38-W40 PolarHBondContact O-N 2.69Å; A38-V49 WeakPolarHBondContact O-CA 3.24Å; A38-Y50 PolarHBondContact N-O 2.77Å; A38-Y50 PolarHBondContact O-N 3.33Å; A38-F52 HydrophobicContact CB-CD2 4.49Å; A38-F52 HydrophobicContact CB-CE2 4.15Å
39	D	96.1	Very high	91.3	Very high	39 Å²	39	75.3 Å²	75.3	21%	0.209	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	110	164.9	-69.8	-43.8	0	0	0	107.8	C18 V19 R21 V49	C18-D39 WeakPolarHBondContact CA-O 3.45Å; V19-D39 HydrophobicContact CB-CB 4.26Å; V19-D39 PolarHBondContact N-O 3.21Å; V19-D39 PolarHBondContact O-N 3.22Å; R21-D39 IonicContact CZ-OD1 3.41Å; R21-D39 IonicContact CZ-OD2 3.65Å; R21-D39 VanDerWaalsContact CZ-OD2 3.24Å; R21-D39 IonicContact NE-OD1 3.7Å; R21-D39 PolarHBondContact NE-OD1 3.17Å; R21-D39 IonicContact NE-OD2 3.91Å; R21-D39 PolarHBondContact NE-OD2 3.41Å; R21-D39 IonicContact NH2-OD1 3.1Å; R21-D39 IonicContact NH2-OD2 2.74Å; R21-D39 PolarHBondContact NH2-OD2 3.43Å; D39-V49 WeakPolarHBondContact OD1-CG2 3.41Å
40	W	95	Very high	91.6	Very high	49 Å²	49	70.4 Å²	70.4	19%	0.186	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	123.5	-176.8	-174.9	19.8	0	0	0	110.2	W7 C18 A38 L42 L47 G48 Y50 F52	W7-W40 AromaticContact CH2-NE1 3.55Å; W7-W40 HydrophobicContact CZ2-CZ2 4.26Å; W7-W40 AromaticContact CZ2-NE1 3.71Å; C18-W40 VanDerWaalsContact SG-CD1 3.59Å; A38-W40 PolarHBondContact O-N 2.69Å; W40-L42 HydrophobicContact CH2-CD2 4.37Å; W40-L42 HydrophobicContact CZ2-CB 4.26Å; W40-L42 HydrophobicContact CZ2-CD1 4.04Å; W40-L42 HydrophobicContact CZ2-CD2 3.91Å; W40-L42 HydrophobicContact CZ2-CG 4.29Å; W40-L47 HydrophobicContact CD2-CD1 3.63Å; W40-L47 HydrophobicContact CE3-CB 4.41Å; W40-L47 HydrophobicContact CE3-CD1 3.53Å; W40-L47 HydrophobicContact CG-CD1 4.28Å; W40-L47 HydrophobicContact CH2-CD1 3.99Å; W40-L47 HydrophobicContact CZ2-CD1 4.09Å; W40-L47 HydrophobicContact CZ3-CD1 3.71Å; W40-L47 PolarHBondContact O-N 2.9Å; W40-G48 PolarHBondContact N-O 2.95Å; W40-Y50 HydrophobicContact CE3-CD1 4.39Å; W40-Y50 HydrophobicContact CE3-CD2 4.24Å; W40-Y50 AromaticContact CE3-CG 3.99Å; W40-Y50 HydrophobicContact CE3-CG 3.99Å; W40-Y50 HydrophobicContact CZ3-CD2 4.43Å; W40-Y50 HydrophobicContact CZ3-CG 4.46Å; W40-F52 HydrophobicContact CD2-CZ 4.34Å; W40-F52 HydrophobicContact CG-CZ 4.33Å
41	V	93.8	Very high	91.9	Very high	15 Å²	15	65.4 Å²	65.4	9%	0.091	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	119.6	169.6	-178.8	0	0	0	0	107.8	S16 Y17 K45 P46	S16-V41 CarbonylContact C-O 3.58Å; S16-V41 VanDerWaalsContact CA-O 3.27Å; S16-V41 WeakPolarHBondContact CA-O 3.2Å; Y17-V41 HydrophobicContact CD1-CB 4.37Å; Y17-V41 HydrophobicContact CD2-CB 4.04Å; Y17-V41 HydrophobicContact CD2-CG2 4.15Å; Y17-V41 HydrophobicContact CE1-CB 4.07Å; Y17-V41 HydrophobicContact CE1-CG1 3.94Å; Y17-V41 HydrophobicContact CE2-CB 3.71Å; Y17-V41 HydrophobicContact CE2-CG1 4.35Å; Y17-V41 HydrophobicContact CE2-CG2 3.47Å; Y17-V41 VanDerWaalsContact CE2-CG2 3.47Å; Y17-V41 HydrophobicContact CG-CB 4.36Å; Y17-V41 PolarHBondContact N-O 2.8Å; Y17-V41 PolarHBondContact O-N 3.16Å; Y17-V41 VanDerWaalsContact O-O 3.09Å; V41-K45 WeakPolarHBondContact CA-O 3.41Å; V41-P46 HydrophobicContact CG2-CB 4.46Å
42	L	90.9	Very high	92.1	Very high	42 Å²	42	60.8 Å²	60.8	22%	0.22	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	121.6	178.8	-176.1	66.5	0	0	0	109.3	W11 W40 G44 K45 L47	W11-L42 HydrophobicContact CZ3-CD1 4.48Å; W40-L42 HydrophobicContact CH2-CD2 4.37Å; W40-L42 HydrophobicContact CZ2-CB 4.26Å; W40-L42 HydrophobicContact CZ2-CD1 4.04Å; W40-L42 HydrophobicContact CZ2-CD2 3.91Å; W40-L42 HydrophobicContact CZ2-CG 4.29Å; L42-G44 PolarHBondContact O-N 2.91Å; L42-K45 PolarHBondContact N-O 2.9Å; L42-K45 WeakPolarHBondContact O-CB 3.22Å; L42-K45 PolarHBondContact O-N 3.32Å; L42-L47 HydrophobicContact CB-CD1 3.56Å; L42-L47 HydrophobicContact CB-CG 4.17Å; L42-L47 HydrophobicContact CD2-CD1 3.99Å; L42-L47 HydrophobicContact CG-CD1 4.43Å
43	R	89	Confident	92.3	Very high	90 Å²	90	61.3 Å²	61.3	34%	0.34	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	43.6	179.4	-56.4	171.3	63.5	-168.7	-2.6	112.3	W11 E14 P15 S16 K45	W11-R43 HydrophobicContact CD2-CG 4.16Å; W11-R43 HydrophobicContact CE3-CG 4.48Å; W11-R43 HydrophobicContact CG-CG 4.17Å; E14-R43 HydrophobicContact CB-CB 3.92Å; E14-R43 HydrophobicContact CB-CG 4.31Å; E14-R43 IonicContact OE1-CZ 3.71Å; E14-R43 IonicContact OE1-NE 3.24Å; E14-R43 IonicContact OE1-NH2 2.84Å; E14-R43 PolarHBondContact OE1-NH2 2.96Å; E14-R43 WeakPolarHBondContact OE2-CG 3.45Å; E14-R43 IonicContact OE2-CZ 3.68Å; E14-R43 VanDerWaalsContact OE2-CZ 3.28Å; E14-R43 IonicContact OE2-NE 3.66Å; E14-R43 PolarHBondContact OE2-NE 2.94Å; E14-R43 IonicContact OE2-NH2 2.82Å; E14-R43 PolarHBondContact OE2-NH2 3.24Å; E14-R43 VanDerWaalsContact OE2-NH2 3.1Å; P15-R43 CarbonylContact O-C 3.53Å; P15-R43 PolarHBondContact O-N 3.49Å; S16-R43 PolarHBondContact OG-N 3.28Å; R43-K45 PolarHBondContact O-N 3.32Å
44	G	87.7	Confident	91.8	Very high	40 Å²	40	64.2 Å²	64.2	41%	0.412	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	-3.6	-176.9	0	0	0	0	0	115.7	P15 L42	P15-G44 PolarHBondContact O-N 2.93Å; L42-G44 PolarHBondContact O-N 2.91Å
45	K	88.3	Confident	90.9	Very high	140 Å²	140	70.2 Å²	70.2	61%	0.609	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	123.6	177.6	-65.8	-173.3	179.2	-176	0	110.9	V41 L42 R43 L47	V41-K45 WeakPolarHBondContact CA-O 3.41Å; L42-K45 PolarHBondContact N-O 2.9Å; L42-K45 WeakPolarHBondContact O-CB 3.22Å; L42-K45 PolarHBondContact O-N 3.32Å; R43-K45 PolarHBondContact O-N 3.32Å; K45-L47 PolarHBondContact O-N 3.45Å
46	P	92.3	Very high	90.1	Very high	107 Å²	107	69.3 Å²	69.3	70%	0.695	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	120.4	172.7	28.9	-32.1	0	0	0	109.7	V41	V41-P46 HydrophobicContact CG2-CB 4.46Å
47	L	92.2	Very high	88.9	Confident	98 Å²	98	73.9 Å²	73.9	51%	0.513	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	-11.5	175.9	-63.3	178.7	0	0	0	112.4	W40 L42 K45	W40-L47 HydrophobicContact CD2-CD1 3.63Å; W40-L47 HydrophobicContact CE3-CB 4.41Å; W40-L47 HydrophobicContact CE3-CD1 3.53Å; W40-L47 HydrophobicContact CG-CD1 4.28Å; W40-L47 HydrophobicContact CH2-CD1 3.99Å; W40-L47 HydrophobicContact CZ2-CD1 4.09Å; W40-L47 HydrophobicContact CZ3-CD1 3.71Å; W40-L47 PolarHBondContact O-N 2.9Å; L42-L47 HydrophobicContact CB-CD1 3.56Å; L42-L47 HydrophobicContact CB-CG 4.17Å; L42-L47 HydrophobicContact CD2-CD1 3.99Å; L42-L47 HydrophobicContact CG-CD1 4.43Å; K45-L47 PolarHBondContact O-N 3.45Å
48	G	93.9	Very high	87.5	Confident	34 Å²	34	79.1 Å²	79.1	35%	0.351	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	95.5	-163.2	-177.4	0	0	0	0	0	112.7	W40 Y50	W40-G48 PolarHBondContact N-O 2.95Å; G48-Y50 PolarHBondContact O-N 2.8Å
49	V	95.1	Very high	86.6	Confident	86 Å²	86	84.9 Å²	84.9	52%	0.521	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	121.2	-179.1	-178.3	0	0	0	0	109.3	W37 A38 D39	W37-V49 HydrophobicContact CB-CG1 4.4Å; A38-V49 WeakPolarHBondContact O-CA 3.24Å; D39-V49 WeakPolarHBondContact OD1-CG2 3.41Å
50	Y	94.3	Very high	86.3	Confident	118 Å²	118	85.1 Å²	85.1	46%	0.463	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	143.1	176	-166.7	-99.5	0	0	0	111.3	W37 A38 W40 G48 F52	W37-Y50 WeakPolarHBondContact CA-O 3.41Å; A38-Y50 PolarHBondContact N-O 2.77Å; A38-Y50 PolarHBondContact O-N 3.33Å; W40-Y50 HydrophobicContact CE3-CD1 4.39Å; W40-Y50 HydrophobicContact CE3-CD2 4.24Å; W40-Y50 AromaticContact CE3-CG 3.99Å; W40-Y50 HydrophobicContact CE3-CG 3.99Å; W40-Y50 HydrophobicContact CZ3-CD2 4.43Å; W40-Y50 HydrophobicContact CZ3-CG 4.46Å; G48-Y50 PolarHBondContact O-N 2.8Å; Y50-F52 AromaticContact CD1-CD1 3.94Å; Y50-F52 HydrophobicContact CD1-CD1 3.94Å; Y50-F52 AromaticContact CD1-CD2 3.91Å; Y50-F52 HydrophobicContact CD1-CD2 3.91Å; Y50-F52 AromaticContact CD1-CE1 3.75Å; Y50-F52 HydrophobicContact CD1-CE1 3.75Å; Y50-F52 AromaticContact CD1-CE2 3.72Å; Y50-F52 HydrophobicContact CD1-CE2 3.72Å; Y50-F52 HydrophobicContact CD1-CG 4.01Å; Y50-F52 AromaticContact CD1-CZ 3.64Å; Y50-F52 HydrophobicContact CD1-CZ 3.64Å; Y50-F52 HydrophobicContact CE1-CD1 4.1Å; Y50-F52 HydrophobicContact CE1-CE1 4.1Å; Y50-F52 HydrophobicContact CE1-CG 4.43Å; Y50-F52 HydrophobicContact CE1-CZ 4.44Å; Y50-F52 HydrophobicContact CG-CE2 4.38Å; Y50-F52 HydrophobicContact CG-CZ 4.4Å
51	L	94.7	Very high	86.1	Confident	69 Å²	69	85 Å²	85	36%	0.361	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	111.3	174.4	172.5	57.6	0	0	0	109.9	K35 W37 T53	K35-L51 HydrophobicContact CB-CD1 4.11Å; W37-L51 HydrophobicContact CD2-CD1 3.86Å; W37-L51 HydrophobicContact CE3-CD1 4.4Å; W37-L51 HydrophobicContact CG-CD1 4.22Å; W37-L51 HydrophobicContact CH2-CD1 4.35Å; W37-L51 HydrophobicContact CZ2-CD1 3.82Å; L51-T53 HydrophobicContact CD1-CG2 3.89Å; L51-T53 HydrophobicContact CD2-CG2 3.72Å; L51-T53 HydrophobicContact CG-CG2 3.6Å; L51-T53 PolarHBondContact O-N 2.94Å
52	F	91.7	Very high	86	Confident	13 Å²	13	88.8 Å²	88.8	6%	0.057	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	102.5	170.7	-61.6	-89	0	0	0	108.9	K35 M36 A38 W40 Y50 L56 W61	K35-F52 WeakPolarHBondContact CA-O 3.49Å; M36-F52 HydrophobicContact CB-CB 4.3Å; M36-F52 HydrophobicContact CE-CB 4.2Å; M36-F52 HydrophobicContact CE-CD2 3.41Å; M36-F52 VanDerWaalsContact CE-CD2 3.41Å; M36-F52 HydrophobicContact CE-CE2 3.91Å; M36-F52 HydrophobicContact CE-CG 3.82Å; M36-F52 PolarHBondContact N-O 2.96Å; M36-F52 PolarHBondContact O-N 2.99Å; A38-F52 HydrophobicContact CB-CD2 4.49Å; A38-F52 HydrophobicContact CB-CE2 4.15Å; W40-F52 HydrophobicContact CD2-CZ 4.34Å; W40-F52 HydrophobicContact CG-CZ 4.33Å; Y50-F52 AromaticContact CD1-CD1 3.94Å; Y50-F52 HydrophobicContact CD1-CD1 3.94Å; Y50-F52 AromaticContact CD1-CD2 3.91Å; Y50-F52 HydrophobicContact CD1-CD2 3.91Å; Y50-F52 AromaticContact CD1-CE1 3.75Å; Y50-F52 HydrophobicContact CD1-CE1 3.75Å; Y50-F52 AromaticContact CD1-CE2 3.72Å; Y50-F52 HydrophobicContact CD1-CE2 3.72Å; Y50-F52 HydrophobicContact CD1-CG 4.01Å; Y50-F52 AromaticContact CD1-CZ 3.64Å; Y50-F52 HydrophobicContact CD1-CZ 3.64Å; Y50-F52 HydrophobicContact CE1-CD1 4.1Å; Y50-F52 HydrophobicContact CE1-CE1 4.1Å; Y50-F52 HydrophobicContact CE1-CG 4.43Å; Y50-F52 HydrophobicContact CE1-CZ 4.44Å; Y50-F52 HydrophobicContact CG-CE2 4.38Å; Y50-F52 HydrophobicContact CG-CZ 4.4Å; F52-L56 HydrophobicContact CB-CD1 4.39Å; F52-L56 HydrophobicContact CB-CG 4.44Å; F52-W61 HydrophobicContact CD1-CH2 4.16Å; F52-W61 HydrophobicContact CD1-CZ2 4.22Å; F52-W61 AromaticContact CE1-CH2 3.98Å; F52-W61 HydrophobicContact CE1-CH2 3.98Å; F52-W61 HydrophobicContact CE1-CZ2 4.42Å; F52-W61 HydrophobicContact CZ-CH2 4.33Å
53	T	87.6	Confident	86.2	Confident	72 Å²	72	92.6 Å²	92.6	44%	0.442	48%	0.477	S	S	.	.			trans	-105.9	-26.7	171.5	54.6	0	0	0	0	113.1	K35 L51	K35-T53 HydrophobicContact CD-CG2 4.16Å; K35-T53 HydrophobicContact CG-CG2 4.01Å; L51-T53 HydrophobicContact CD1-CG2 3.89Å; L51-T53 HydrophobicContact CD2-CG2 3.72Å; L51-T53 HydrophobicContact CG-CG2 3.6Å; L51-T53 PolarHBondContact O-N 2.94Å
54	K	76.7	Confident	86.4	Confident	171 Å²	171	88.5 Å²	88.5	74%	0.743	46%	0.461	S	S	*	.	S	Bend	trans	-123.6	158.2	-179.5	-64.8	179.4	-177.6	-177.9	0	108	L56	K54-L56 VanDerWaalsContact C-N 3.34Å; K54-L56 PolarHBondContact O-N 3.13Å
55	E	70.8	Confident	86.7	Confident	138 Å²	138	91.8 Å²	91.8	65%	0.645	47%	0.466	S	S	*	.			trans	65.3	29.7	177.8	-46.9	179	179.1	0	0	115.6	K4 N57	K4-E55 PolarHBondContact NZ-O 3.15Å; E55-N57 PolarHBondContact O-N 3.41Å
56	L	75.4	Confident	86.9	Confident	58 Å²	58	94.1 Å²	94.1	30%	0.304	48%	0.476	S	S	.	.			trans	-75.2	42.4	162.8	-82.1	146.8	0	0	0	111	G34 M36 F52 K54 R58	G34-L56 VanDerWaalsContact O-CD1 3.24Å; G34-L56 WeakPolarHBondContact O-CD1 3.34Å; M36-L56 HydrophobicContact CB-CD2 4.47Å; F52-L56 HydrophobicContact CB-CD1 4.39Å; F52-L56 HydrophobicContact CB-CG 4.44Å; K54-L56 VanDerWaalsContact C-N 3.34Å; K54-L56 PolarHBondContact O-N 3.13Å; L56-R58 PolarHBondContact O-N 3.35Å
57	N	69.3	Low	87	Confident	113 Å²	113	95.8 Å²	95.8	60%	0.604	47%	0.474	S	S	*	.			trans	-54.4	117.3	-177.7	-80.7	-7.5	0	0	0	110.3	E55 C59 D60	E55-N57 PolarHBondContact O-N 3.41Å; N57-C59 PolarHBondContact O-N 2.78Å; N57-D60 PolarHBondContact O-N 2.86Å
58	R	67.7	Low	87.1	Confident	169 Å²	169	95 Å²	95	64%	0.638	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.1	-37.2	-171.5	-108.9	175.8	156	-134.2	-20.8	115.2	M32 L56	M32-R58 VanDerWaalsContact CG-CZ 3.46Å; M32-R58 PolarHBondContact SD-NE 2.89Å; M32-R58 PolarHBondContact SD-NH1 2.91Å; M32-R58 PolarHBondContact SD-NH2 2.94Å; L56-R58 PolarHBondContact O-N 3.35Å
59	C	76.2	Confident	87	Confident	121 Å²	121	95.6 Å²	95.6	82%	0.818	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-9.8	-167.6	-54.9	0	0	0	0	115.1	N57	N57-C59 PolarHBondContact O-N 2.78Å
60	D	89.3	Confident	86.7	Confident	44 Å²	44	95 Å²	95	24%	0.235	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-22.6	-176.6	-162.7	28.5	0	0	0	112.3	K4 G5 I6 N57 H62	K4-D60 CarbonylContact C-O 3.54Å; K4-D60 WeakPolarHBondContact CA-O 3.19Å; G5-D60 WeakPolarHBondContact CA-OD1 3.01Å; G5-D60 PolarHBondContact N-O 2.92Å; G5-D60 PolarHBondContact N-OD1 3.16Å; I6-D60 WeakPolarHBondContact CG2-OD2 3.43Å; I6-D60 PolarHBondContact N-OD1 3.19Å; N57-D60 PolarHBondContact O-N 2.86Å; D60-H62 PolarHBondContact O-CE1 2.84Å; D60-H62 PolarHBondContact O-ND1 2.82Å
61	W	91.5	Very high	86.5	Confident	47 Å²	47	93.8 Å²	93.8	18%	0.178	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	134.9	-178.7	-63.7	99.9	0	0	0	112.2	V2 T3 K4 W7 M36 F52	V2-W61 HydrophobicContact CB-CE3 4.3Å; V2-W61 HydrophobicContact CG2-CE3 3.99Å; V2-W61 HydrophobicContact CG2-CZ3 3.99Å; T3-W61 CarbonylContact O-C 3.48Å; T3-W61 WeakPolarHBondContact O-CA 3.36Å; K4-W61 HydrophobicContact CD-CH2 4.3Å; K4-W61 HydrophobicContact CD-CZ2 4.24Å; K4-W61 HydrophobicContact CG-CD2 3.88Å; K4-W61 HydrophobicContact CG-CE3 3.7Å; K4-W61 HydrophobicContact CG-CH2 4.05Å; K4-W61 HydrophobicContact CG-CZ2 4.21Å; K4-W61 HydrophobicContact CG-CZ3 3.78Å; W7-W61 HydrophobicContact CH2-CH2 4.25Å; W7-W61 HydrophobicContact CH2-CZ3 4.12Å; W7-W61 HydrophobicContact CZ3-CZ3 4.36Å; M36-W61 HydrophobicContact CE-CH2 4Å; M36-W61 HydrophobicContact CE-CZ2 4.41Å; M36-W61 HydrophobicContact CE-CZ3 4.39Å; F52-W61 HydrophobicContact CD1-CH2 4.16Å; F52-W61 HydrophobicContact CD1-CZ2 4.22Å; F52-W61 AromaticContact CE1-CH2 3.98Å; F52-W61 HydrophobicContact CE1-CH2 3.98Å; F52-W61 HydrophobicContact CE1-CZ2 4.42Å; F52-W61 HydrophobicContact CZ-CH2 4.33Å
62	H	92.4	Very high	86.2	Confident	94 Å²	94	92.4 Å²	92.4	44%	0.435	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	132.4	177.7	-64.6	70.2	0	0	0	109.3	V2 T3 D60	V2-H62 WeakPolarHBondContact CA-O 3.47Å; T3-H62 HydrophobicContact CG2-CB 4.07Å; T3-H62 PolarHBondContact N-O 3.45Å; T3-H62 PolarHBondContact O-N 2.86Å; D60-H62 PolarHBondContact O-CE1 2.84Å; D60-H62 PolarHBondContact O-ND1 2.82Å
63	L	93.8	Very high	86.1	Confident	123 Å²	123	95.9 Å²	95.9	64%	0.644	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.5	132.2	172.5	-175	69.8	0	0	0	109.2	V2	V2-L63 HydrophobicContact CG1-CD1 4.11Å
64	I	94	Very high	85.9	Confident	4 Å²	4	100.2 Å²	100.2	2%	0.021	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-95.3	126.9	171	-61	175.2	0	0	0	107.8	M1 T3 E68 E69 F72	M1-I64 HydrophobicContact CB-CB 4.35Å; M1-I64 HydrophobicContact CE-CB 4.03Å; M1-I64 HydrophobicContact CE-CD1 3.69Å; M1-I64 HydrophobicContact CE-CG1 4.46Å; M1-I64 HydrophobicContact CE-CG2 3.74Å; M1-I64 HydrophobicContact CG-CD1 4.3Å; M1-I64 PolarHBondContact O-N 2.74Å; T3-I64 HydrophobicContact CG2-CD1 3.8Å; T3-I64 HydrophobicContact CG2-CG1 3.96Å; I64-E68 HydrophobicContact CG2-CB 4.1Å; I64-E69 HydrophobicContact CG2-CG 4.21Å; I64-F72 HydrophobicContact CD1-CB 4.42Å; I64-F72 HydrophobicContact CD1-CD1 3.4Å; I64-F72 VanDerWaalsContact CD1-CD1 3.4Å; I64-F72 HydrophobicContact CD1-CD2 3.89Å; I64-F72 HydrophobicContact CD1-CE1 3.46Å; I64-F72 VanDerWaalsContact CD1-CE1 3.46Å; I64-F72 HydrophobicContact CD1-CE2 3.96Å; I64-F72 HydrophobicContact CD1-CG 3.62Å; I64-F72 HydrophobicContact CD1-CZ 3.74Å; I64-F72 HydrophobicContact CG2-CB 4.41Å
65	H	93.7	Very high	85.5	Confident	108 Å²	108	97.8 Å²	97.8	50%	0.5	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-68.9	147.7	-179.4	-76.4	-91.7	0	0	0	111.4	H67 E68 E69	H65-H67 VanDerWaalsContact C-N 3.25Å; H65-H67 VanDerWaalsContact CB-CE1 3.42Å; H65-H67 WeakPolarHBondContact CB-CE1 3.38Å; H65-H67 AromaticContact CG-CE1 3.94Å; H65-H67 PolarHBondContact O-N 3.41Å; H65-H67 VanDerWaalsContact O-N 3.16Å; H65-E68 HydrophobicContact CB-CG 4.26Å; H65-E68 PolarHBondContact O-N 3.29Å; H65-E69 WeakPolarHBondContact O-CG 3.34Å; H65-E69 PolarHBondContact O-N 3.4Å
66	K	93.1	Very high	85.6	Confident	190 Å²	190	94.8 Å²	94.8	83%	0.826	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-40.2	-176.8	-79	-171.9	175.8	-178.7	0	113.9	E68 E69	K66-E68 VanDerWaalsContact C-N 3.31Å; K66-E68 PolarHBondContact O-N 3.01Å; K66-E69 PolarHBondContact O-N 2.85Å
67	H	94.2	Very high	85.3	Confident	142 Å²	142	100.6 Å²	100.6	66%	0.657	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-24.8	-178.8	59.9	-89.3	0	0	0	112.9	H65	H65-H67 VanDerWaalsContact C-N 3.25Å; H65-H67 VanDerWaalsContact CB-CE1 3.42Å; H65-H67 WeakPolarHBondContact CB-CE1 3.38Å; H65-H67 AromaticContact CG-CE1 3.94Å; H65-H67 PolarHBondContact O-N 3.41Å; H65-H67 VanDerWaalsContact O-N 3.16Å
68	E	92.8	Very high	85.2	Confident	82 Å²	82	98.5 Å²	98.5	38%	0.383	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-11.9	178.4	-54.5	-177.9	158.3	0	0	112.5	I64 H65 K66 A70 D71 F72	I64-E68 HydrophobicContact CG2-CB 4.1Å; H65-E68 HydrophobicContact CB-CG 4.26Å; H65-E68 PolarHBondContact O-N 3.29Å; K66-E68 VanDerWaalsContact C-N 3.31Å; K66-E68 PolarHBondContact O-N 3.01Å; E68-A70 VanDerWaalsContact C-N 3.27Å; E68-A70 PolarHBondContact O-N 2.86Å; E68-D71 PolarHBondContact O-N 2.87Å; E68-F72 WeakPolarHBondContact O-CB 3.35Å; E68-F72 PolarHBondContact O-N 3.06Å
69	E	92.7	Very high	85.2	Confident	45 Å²	45	94.5 Å²	94.5	21%	0.21	49%	0.488	C	S	.	.	H	α-helix	trans	-61.8	-36.4	-173.5	-66.1	-161.4	165.3	0	0	112.6	M1 I64 H65 K66 K73	M1-E69 HydrophobicContact CB-CG 4.27Å; M1-E69 VanDerWaalsContact CB-OE1 3.22Å; M1-E69 WeakPolarHBondContact CB-OE1 3.43Å; M1-E69 HydrophobicContact CE-CB 3.89Å; M1-E69 HydrophobicContact CE-CG 3.84Å; M1-E69 PolarHBondContact N-OE1 3.4Å; I64-E69 HydrophobicContact CG2-CG 4.21Å; H65-E69 WeakPolarHBondContact O-CG 3.34Å; H65-E69 PolarHBondContact O-N 3.4Å; K66-E69 PolarHBondContact O-N 2.85Å; E69-K73 WeakPolarHBondContact O-CB 3.32Å; E69-K73 WeakPolarHBondContact O-CG 3.19Å; E69-K73 PolarHBondContact O-N 3.21Å; E69-K73 VanDerWaalsContact O-N 3.11Å; E69-K73 IonicContact OE2-NZ 3.28Å
70	A	89.9	Confident	85.1	Confident	73 Å²	73	98.5 Å²	98.5	60%	0.603	49%	0.491	S	S	*	.	H	α-helix	trans	-65.1	-43.8	179.2	0	0	0	0	0	111.6	E68 K73	E68-A70 VanDerWaalsContact C-N 3.27Å; E68-A70 PolarHBondContact O-N 2.86Å; A70-K73 PolarHBondContact O-N 3.04Å
71	D	89.2	Confident	84.4	Confident	93 Å²	93	102 Å²	102	50%	0.497	51%	0.51	S	S	.	.	H	α-helix	trans	-71.6	-37.9	179.3	-69.4	-28.9	0	0	0	111.8	E68 K73 R74	E68-D71 PolarHBondContact O-N 2.87Å; D71-K73 VanDerWaalsContact C-N 3.28Å; D71-K73 PolarHBondContact O-N 2.96Å; D71-R74 WeakPolarHBondContact O-CB 3.17Å; D71-R74 PolarHBondContact O-N 3.41Å; D71-R74 IonicContact OD1-CZ 3.25Å; D71-R74 VanDerWaalsContact OD1-CZ 3.25Å; D71-R74 IonicContact OD1-NE 3.19Å; D71-R74 PolarHBondContact OD1-NE 2.98Å; D71-R74 IonicContact OD1-NH2 2.74Å; D71-R74 PolarHBondContact OD1-NH2 3.5Å
72	F	88.8	Confident	83.9	Confident	41 Å²	41	111.4 Å²	111.4	18%	0.18	55%	0.545	C	S	.	.	H	α-helix	trans	-68.1	-28.2	178.3	-160.9	-91	0	0	0	113.1	M1 T3 R8 P15 Y17 I64 E68 R74	M1-F72 HydrophobicContact CE-CB 4.01Å; M1-F72 HydrophobicContact CE-CD1 3.93Å; M1-F72 HydrophobicContact CE-CG 4.27Å; T3-F72 HydrophobicContact CG2-CZ 4.37Å; R8-F72 VanDerWaalsContact NH2-CE2 3.27Å; P15-F72 HydrophobicContact CB-CD1 4.44Å; P15-F72 HydrophobicContact CB-CE1 4.34Å; P15-F72 WeakPolarHBondContact CB-O 3.33Å; Y17-F72 AromaticContact CD1-CD1 3.83Å; Y17-F72 HydrophobicContact CD1-CD1 3.83Å; Y17-F72 AromaticContact CD1-CE1 3.87Å; Y17-F72 HydrophobicContact CD1-CE1 3.87Å; Y17-F72 HydrophobicContact CG-CD1 4.42Å; Y17-F72 HydrophobicContact CG-CE1 4.38Å; I64-F72 HydrophobicContact CD1-CB 4.42Å; I64-F72 HydrophobicContact CD1-CD1 3.4Å; I64-F72 VanDerWaalsContact CD1-CD1 3.4Å; I64-F72 HydrophobicContact CD1-CD2 3.89Å; I64-F72 HydrophobicContact CD1-CE1 3.46Å; I64-F72 VanDerWaalsContact CD1-CE1 3.46Å; I64-F72 HydrophobicContact CD1-CE2 3.96Å; I64-F72 HydrophobicContact CD1-CG 3.62Å; I64-F72 HydrophobicContact CD1-CZ 3.74Å; I64-F72 HydrophobicContact CG2-CB 4.41Å; E68-F72 WeakPolarHBondContact O-CB 3.35Å; E68-F72 PolarHBondContact O-N 3.06Å; F72-R74 VanDerWaalsContact C-N 3.3Å
73	K	88.2	Confident	83.4	Confident	85 Å²	85	113.9 Å²	113.9	37%	0.37	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.4	-9.5	177.3	-74.7	174.6	-174.8	168.4	0	113.5	M1 Y17 E69 A70 D71 P75	M1-K73 HydrophobicContact CE-CG 4.41Å; M1-K73 HydrophobicContact SD-CG 4.35Å; Y17-K73 HydrophobicContact CE1-CG 4.04Å; Y17-K73 HydrophobicContact CE2-CG 4.45Å; E69-K73 WeakPolarHBondContact O-CB 3.32Å; E69-K73 WeakPolarHBondContact O-CG 3.19Å; E69-K73 PolarHBondContact O-N 3.21Å; E69-K73 VanDerWaalsContact O-N 3.11Å; E69-K73 IonicContact OE2-NZ 3.28Å; A70-K73 PolarHBondContact O-N 3.04Å; D71-K73 VanDerWaalsContact C-N 3.28Å; D71-K73 PolarHBondContact O-N 2.96Å; K73-P75 WeakPolarHBondContact O-CD 3.41Å; K73-P75 VanDerWaalsContact O-N 3.13Å
74	R	84.3	Confident	83.1	Confident	164 Å²	164	112.6 Å²	112.6	62%	0.619	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-56.1	122.7	-175.4	-76.7	-175.2	-167.9	-169	8.3	109.9	D71 F72 V76	D71-R74 WeakPolarHBondContact O-CB 3.17Å; D71-R74 PolarHBondContact O-N 3.41Å; D71-R74 IonicContact OD1-CZ 3.25Å; D71-R74 VanDerWaalsContact OD1-CZ 3.25Å; D71-R74 IonicContact OD1-NE 3.19Å; D71-R74 PolarHBondContact OD1-NE 2.98Å; D71-R74 IonicContact OD1-NH2 2.74Å; D71-R74 PolarHBondContact OD1-NH2 3.5Å; F72-R74 VanDerWaalsContact C-N 3.3Å; R74-V76 PolarHBondContact O-N 2.79Å
75	P	69	Low	82.8	Confident	120 Å²	120	117.6 Å²	117.6	78%	0.779	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-66.3	121.9	179.5	25.1	-30.5	0	0	0	108.3	K73	K73-P75 WeakPolarHBondContact O-CD 3.41Å; K73-P75 VanDerWaalsContact O-N 3.13Å
76	V	71.4	Confident	82.5	Confident	74 Å²	74	121.6 Å²	121.6	45%	0.448	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-94.1	124.5	163.1	179.7	0	0	0	0	105.8	K13 R74 P78	K13-V76 HydrophobicContact CB-CG1 4.46Å; K13-V76 WeakPolarHBondContact O-CB 3.32Å; K13-V76 VanDerWaalsContact O-CG1 3.31Å; K13-V76 WeakPolarHBondContact O-CG1 3.49Å; K13-V76 WeakPolarHBondContact O-CG2 3.24Å; R74-V76 PolarHBondContact O-N 2.79Å; V76-P78 WeakPolarHBondContact O-CD 3.41Å
77	E	70.1	Confident	82.1	Confident	181 Å²	181	118.2 Å²	118.2	85%	0.846	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-53.4	118	176.2	-77.4	-168.7	150.4	0	0	108.6
78	P	66.4	Low	81.7	Confident	69 Å²	69	116.1 Å²	116.1	45%	0.448	61%	0.61	S	S	.	*	P	Polyproline II helix	trans	-63.1	138.2	179	25	-31.6	0	0	0	107.6	V76 K80	V76-P78 WeakPolarHBondContact O-CD 3.41Å; P78-K80 PolarHBondContact O-N 3.32Å; P78-K80 VanDerWaalsContact O-N 3.11Å
79	P	69	Low	81.4	Confident	84 Å²	84	116.2 Å²	116.2	55%	0.545	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-54.5	125.9	174.4	21.3	-29.7	0	0	0	108.4	E14 L81	E14-P79 WeakPolarHBondContact OE1-CD 2.92Å; P79-L81 VanDerWaalsContact C-N 3.26Å; P79-L81 PolarHBondContact O-N 2.83Å
80	K	72.5	Confident	81.3	Confident	205 Å²	205	117.9 Å²	117.9	89%	0.891	63%	0.627	S	S	*	*			trans	-63	88.7	177.3	-77.7	-179.2	-179.6	172.4	0	109.1	P78 R82	P78-K80 PolarHBondContact O-N 3.32Å; P78-K80 VanDerWaalsContact O-N 3.11Å; K80-R82 PolarHBondContact O-N 3.22Å; K80-R82 VanDerWaalsContact O-N 3.15Å
81	L	75.1	Confident	81.1	Confident	119 Å²	119	120.6 Å²	120.6	62%	0.623	63%	0.631	S	S	*	*			trans	-70.6	108.3	176.3	-122.5	119.7	0	0	0	108.2	P79 M83	P79-L81 VanDerWaalsContact C-N 3.26Å; P79-L81 PolarHBondContact O-N 2.83Å; L81-M83 HydrophobicContact CD2-SD 3.71Å; L81-M83 PolarHBondContact O-N 3.3Å; L81-M83 VanDerWaalsContact O-N 3.16Å
82	R	81.5	Confident	80.9	Confident	243 Å²	243	122.9 Å²	122.9	92%	0.917	64%	0.642	S	S	*	*			trans	-79	94	170.5	-71.2	-171.1	176	-165.6	-0.4	108.3	K80	K80-R82 PolarHBondContact O-N 3.22Å; K80-R82 VanDerWaalsContact O-N 3.15Å
83	M	82	Confident	80.6	Confident	147 Å²	147	126.4 Å²	126.4	72%	0.724	66%	0.659	S	S	*	*			trans	-68.9	140.5	171.5	-64.6	-64.7	-119.4	0	0	109.5	L81 A85	L81-M83 HydrophobicContact CD2-SD 3.71Å; L81-M83 PolarHBondContact O-N 3.3Å; L81-M83 VanDerWaalsContact O-N 3.16Å; M83-A85 PolarHBondContact O-N 3.25Å
84	P	87.6	Confident	80.2	Confident	95 Å²	95	128.9 Å²	128.9	62%	0.617	67%	0.667	S	S	*	*			trans	-62.9	129.8	173.8	25.7	-32	0	0	0	109.5	K86	P84-K86 PolarHBondContact O-N 2.96Å
85	A	86.7	Confident	79.9	Confident	110 Å²	110	130.3 Å²	130.3	91%	0.909	67%	0.673	S	S	*	*	S	Bend	trans	-69.2	-23.1	-179.6	0	0	0	0	0	113	M83	M83-A85 PolarHBondContact O-N 3.25Å
86	K	87.1	Confident	80.1	Confident	191 Å²	191	131.2 Å²	131.2	83%	0.83	67%	0.672	S	S	*	*			trans	-135.5	128	177.8	-67.1	-177.2	-179.7	179.9	0	109.3	P84	P84-K86 PolarHBondContact O-N 2.96Å
87	T	86.4	Confident	79.4	Confident	119 Å²	119	140.6 Å²	140.6	73%	0.73	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-95.1	133.3	163.3	32.2	0	0	0	0	108.5	L89	T87-L89 PolarHBondContact O-N 2.83Å
88	P	86	Confident	79.9	Confident	99 Å²	99	138.6 Å²	138.6	64%	0.643	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-62.2	138.9	177.2	23.7	-30.8	0	0	0	110.2	R94	P88-R94 VanDerWaalsContact CB-NH2 3.29Å
89	L	86	Confident	80.6	Confident	84 Å²	84	142.2 Å²	142.2	44%	0.44	70%	0.704	S	S	.	*	P	Polyproline II helix	trans	-59	136.9	172	-75.3	163.5	0	0	0	109.8	T87 E93 R94	T87-L89 PolarHBondContact O-N 2.83Å; L89-E93 HydrophobicContact CD2-CB 4.47Å; L89-E93 WeakPolarHBondContact CD2-OE2 3.47Å; L89-R94 HydrophobicContact CB-CG 3.83Å; L89-R94 PolarHBondContact O-NE 3.31Å
90	P	89.2	Confident	81.2	Confident	79 Å²	79	145.4 Å²	145.4	51%	0.513	71%	0.713	S	S	.	*	P	Polyproline II helix	trans	-59.1	149.4	172.7	23.8	-30.2	0	0	0	110.3	L92 E93 R94	P90-L92 VanDerWaalsContact C-N 3.27Å; P90-L92 PolarHBondContact O-N 2.85Å; P90-L92 VanDerWaalsContact O-N 3.16Å; P90-E93 VanDerWaalsContact CD-OE2 3.29Å; P90-E93 WeakPolarHBondContact CD-OE2 3.19Å; P90-E93 HydrophobicContact CG-CB 4.26Å; P90-E93 HydrophobicContact CG-CG 4.19Å; P90-E93 WeakPolarHBondContact CG-OE2 3.45Å; P90-E93 PolarHBondContact O-N 2.81Å; P90-E93 VanDerWaalsContact O-N 3.08Å; P90-R94 PolarHBondContact O-N 2.89Å
91	L	86.6	Confident	81.8	Confident	130 Å²	130	141.9 Å²	141.9	68%	0.681	70%	0.703	S	S	*	*	H	α-helix	trans	-54.3	-41.9	-168.1	-68.8	169.5	0	0	0	112.8	E93 R94 Y95	L91-E93 PolarHBondContact O-N 3.22Å; L91-R94 WeakPolarHBondContact O-CB 3.35Å; L91-R94 PolarHBondContact O-N 2.79Å; L91-R94 VanDerWaalsContact O-N 3.17Å; L91-Y95 VanDerWaalsContact O-CD2 3.27Å; L91-Y95 WeakPolarHBondContact O-CD2 3.33Å
92	L	86.2	Confident	82.2	Confident	141 Å²	141	143.4 Å²	143.4	74%	0.738	71%	0.708	S	S	*	*	H	α-helix	trans	-63.4	-39.3	-178.5	-150.4	95	0	0	0	112.8	P90 R94 Y95	P90-L92 VanDerWaalsContact C-N 3.27Å; P90-L92 PolarHBondContact O-N 2.85Å; P90-L92 VanDerWaalsContact O-N 3.16Å; L92-R94 VanDerWaalsContact C-N 3.27Å; L92-R94 PolarHBondContact O-N 2.84Å; L92-Y95 PolarHBondContact O-N 2.82Å
93	E	82.1	Confident	82.2	Confident	115 Å²	115	136.7 Å²	136.7	54%	0.537	69%	0.694	S	S	.	*	H	α-helix	trans	-71.6	-22	178.1	-78.7	-174.2	150.8	0	0	112.8	L89 P90 L91 Y95	L89-E93 HydrophobicContact CD2-CB 4.47Å; L89-E93 WeakPolarHBondContact CD2-OE2 3.47Å; P90-E93 VanDerWaalsContact CD-OE2 3.29Å; P90-E93 WeakPolarHBondContact CD-OE2 3.19Å; P90-E93 HydrophobicContact CG-CB 4.26Å; P90-E93 HydrophobicContact CG-CG 4.19Å; P90-E93 WeakPolarHBondContact CG-OE2 3.45Å; P90-E93 PolarHBondContact O-N 2.81Å; P90-E93 VanDerWaalsContact O-N 3.08Å; L91-E93 PolarHBondContact O-N 3.22Å; E93-Y95 VanDerWaalsContact C-N 3.31Å
94	R	80.2	Confident	82.2	Confident	138 Å²	138	136 Å²	136	52%	0.521	69%	0.692	S	S	.	*	H	α-helix	trans	-71	-26	175.5	-67.2	-175.7	-176.8	-160.7	-3.2	113.1	P88 L89 P90 L91 L92	P88-R94 VanDerWaalsContact CB-NH2 3.29Å; L89-R94 HydrophobicContact CB-CG 3.83Å; L89-R94 PolarHBondContact O-NE 3.31Å; P90-R94 PolarHBondContact O-N 2.89Å; L91-R94 WeakPolarHBondContact O-CB 3.35Å; L91-R94 PolarHBondContact O-N 2.79Å; L91-R94 VanDerWaalsContact O-N 3.17Å; L92-R94 VanDerWaalsContact C-N 3.27Å; L92-R94 PolarHBondContact O-N 2.84Å
95	Y	77.9	Confident	81.8	Confident	193 Å²	193	139.2 Å²	139.2	76%	0.757	70%	0.697	S	S	*	*	H	α-helix	trans	-89.5	-16.9	-177.1	-78.2	-80.7	0	0	0	114.1	L91 L92 E93	L91-Y95 VanDerWaalsContact O-CD2 3.27Å; L91-Y95 WeakPolarHBondContact O-CD2 3.33Å; L92-Y95 PolarHBondContact O-N 2.82Å; E93-Y95 VanDerWaalsContact C-N 3.31Å
96	N	72.4	Confident	81.4	Confident	140 Å²	140	141.6 Å²	141.6	75%	0.749	68%	0.68	S	S	*	*			trans	-96	21.7	-177.6	-74.1	-15.1	0	0	0	113.8
97	R	57	Low	80.9	Confident	270 Å²	270	137.1 Å²	137.1	100%	1.019	67%	0.666	S	S	*	*			trans	-129.4	0	-176	-149.3	-175.7	-161.2	-167.6	5.1	110.7

Retrieved 97 of 97 residues in 71.1 ms (Link to these results)

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