A0A077ZN72_TRITR Loading...

DUF5641 domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZN72, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 180 aa.

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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	60.1	Low	78.4	Confident	219 Å²	219	79.1 Å²	79.1	100%	1.079	42%	0.416	S	S	*	.				0	-34.7	0	-139.8	170.7	82	0	0	113.3
2	N	75.4	Confident	77.7	Confident	64 Å²	64	75.4 Å²	75.4	34%	0.342	41%	0.411	S	S	.	.			trans	-100.4	17.5	-174.2	-60.4	-24.9	0	0	0	115	P21 S22 L25	N2-P21 HydrophobicContact CB-CB 4.27Å; N2-P21 WeakPolarHBondContact O-CD 3.34Å; N2-S22 WeakPolarHBondContact O-CB 3.38Å; N2-S22 PolarHBondContact O-N 2.69Å; N2-S22 VanDerWaalsContact O-N 3.07Å; N2-L25 VanDerWaalsContact ND2-CD1 3.34Å; N2-L25 WeakPolarHBondContact ND2-CD1 3.42Å
3	S	77.4	Confident	76.6	Confident	57 Å²	57	76.4 Å²	76.4	40%	0.399	41%	0.413	S	S	.	.			trans	-89.9	0.6	-177.8	51.9	0	0	0	0	113.8	P5 T20	S3-P5 WeakPolarHBondContact O-CD 2.98Å; S3-T20 WeakPolarHBondContact O-CG2 3.15Å
4	R	79.7	Confident	75.7	Confident	115 Å²	115	75.6 Å²	75.6	43%	0.434	42%	0.422	S	S	.	.	S	Bend	trans	-70.9	125.9	175.4	-176.8	178.6	177.3	-178.8	0.1	109.3	P21	R4-P21 WeakPolarHBondContact O-CD 3.38Å
5	P	83.5	Confident	75.3	Confident	5 Å²	5	77.9 Å²	77.9	3%	0.032	43%	0.433	C	S	.	.			trans	-65.7	139.2	178.4	-17.3	29.1	0	0	0	112.4	S3 P18 T20 H90 W97 L99	S3-P5 WeakPolarHBondContact O-CD 2.98Å; P5-P18 HydrophobicContact CB-CB 3.5Å; P5-P18 HydrophobicContact CG-CB 3.46Å; P5-P18 VanDerWaalsContact CG-CB 3.46Å; P5-P18 HydrophobicContact CG-CG 4.42Å; P5-T20 HydrophobicContact CB-CG2 4.42Å; P5-T20 HydrophobicContact CG-CG2 4.36Å; P5-H90 WeakPolarHBondContact CB-NE2 3.31Å; P5-H90 VanDerWaalsContact CD-NE2 3.29Å; P5-H90 WeakPolarHBondContact CD-NE2 3.37Å; P5-H90 WeakPolarHBondContact CG-NE2 3.46Å; P5-W97 HydrophobicContact CG-CB 4.1Å; P5-L99 HydrophobicContact CB-CD2 4.15Å; P5-L99 HydrophobicContact CG-CD2 3.89Å
6	L	82.2	Confident	75.4	Confident	62 Å²	62	74.5 Å²	74.5	33%	0.325	41%	0.414	S	S	.	.	S	Bend	trans	-84.3	-45.6	168.1	-63.2	176.2	0	0	0	110.3	L19 P21 F24 Y66 L135	L6-L19 WeakPolarHBondContact CA-O 3.28Å; L6-L19 VanDerWaalsContact CB-O 3.3Å; L6-L19 WeakPolarHBondContact CB-O 3.47Å; L6-L19 PolarHBondContact N-O 3.32Å; L6-P21 HydrophobicContact CD1-CG 4.18Å; L6-P21 HydrophobicContact CD2-CG 3.92Å; L6-P21 HydrophobicContact CG-CG 3.95Å; L6-F24 HydrophobicContact CD1-CE2 4.07Å; L6-Y66 HydrophobicContact CD2-CE2 4.48Å; L6-L135 WeakPolarHBondContact O-CD2 3.35Å
7	T	84.1	Confident	75.8	Confident	47 Å²	47	76.3 Å²	76.3	29%	0.288	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	-170.9	177	-171.1	0	0	0	0	108.7	P18 L19	T7-P18 CarbonylContact O-C 3.52Å; T7-L19 HydrophobicContact CG2-CB 3.75Å; T7-L19 HydrophobicContact CG2-CD2 3.56Å; T7-L19 HydrophobicContact CG2-CG 4.27Å; T7-L19 PolarHBondContact O-N 3.19Å
8	Y	85.3	Confident	76.3	Confident	42 Å²	42	74.3 Å²	74.3	17%	0.165	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	154.7	171.1	58.1	-88.5	0	0	0	110.4	S10 E17 V88 L135 E136	Y8-S10 WeakPolarHBondContact CD2-O 3.37Å; Y8-S10 WeakPolarHBondContact CE2-O 3.48Å; Y8-E17 CarbonylContact C-O 3.55Å; Y8-E17 VanDerWaalsContact CA-O 3.26Å; Y8-E17 WeakPolarHBondContact CA-O 3.48Å; Y8-V88 HydrophobicContact CD1-CB 3.98Å; Y8-V88 HydrophobicContact CD1-CG1 3.87Å; Y8-V88 HydrophobicContact CD1-CG2 4.04Å; Y8-V88 HydrophobicContact CE1-CB 3.65Å; Y8-V88 HydrophobicContact CE1-CG1 4.09Å; Y8-V88 HydrophobicContact CE1-CG2 3.49Å; Y8-V88 VanDerWaalsContact CE1-CG2 3.49Å; Y8-V88 HydrophobicContact CE2-CG2 4.38Å; Y8-L135 HydrophobicContact CD1-CD1 4.11Å; Y8-E136 HydrophobicContact CE1-CG 4.27Å; Y8-E136 WeakPolarHBondContact CE1-OE1 3.44Å; Y8-E136 PolarHBondContact OH-OE1 3.42Å
9	V	82.7	Confident	76.8	Confident	92 Å²	92	72.8 Å²	72.8	56%	0.558	40%	0.401	S	S	*	.	S	Bend	trans	-91.4	-32	-173.8	-178	0	0	0	0	112.6	E17 L19	V9-E17 PolarHBondContact N-O 2.72Å; V9-L19 HydrophobicContact CG2-CB 4.16Å; V9-L19 HydrophobicContact CG2-CD1 4.37Å
10	S	79	Confident	77.1	Confident	35 Å²	35	69.9 Å²	69.9	25%	0.245	39%	0.385	C	S	.	.			trans	-119	143.8	-172.9	107.2	0	0	0	0	112.6	Y8 G12 D15	Y8-S10 WeakPolarHBondContact CD2-O 3.37Å; Y8-S10 WeakPolarHBondContact CE2-O 3.48Å; S10-G12 PolarHBondContact O-N 3.37Å; S10-G12 PolarHBondContact OG-N 3.28Å; S10-D15 WeakPolarHBondContact CB-O 3.42Å; S10-D15 WeakPolarHBondContact OG-CB 3.14Å; S10-D15 PolarHBondContact OG-O 3.3Å
11	D	73.1	Confident	77.3	Confident	132 Å²	132	67.2 Å²	67.2	71%	0.706	37%	0.371	S	S	*	.			trans	-80.9	-2.4	173.9	-163	23	0	0	0	112.6
12	G	70.3	Confident	78.3	Confident	35 Å²	35	58.1 Å²	58.1	36%	0.361	33%	0.329	S	S	.	.			trans	-68.7	135.7	-179.1	0	0	0	0	0	112.1	S10 A14 D15	S10-G12 PolarHBondContact O-N 3.37Å; S10-G12 PolarHBondContact OG-N 3.28Å; G12-A14 PolarHBondContact O-N 3.07Å; G12-D15 PolarHBondContact O-N 2.86Å
13	M	63	Low	78.7	Confident	88 Å²	88	56.6 Å²	56.6	43%	0.433	32%	0.32	S	S	.	.	S	Bend	trans	-64.1	-23.6	176.2	-67.6	-171.2	75.7	0	0	113.7	L16	M13-L16 VanDerWaalsContact O-CD1 3.31Å; M13-L16 WeakPolarHBondContact O-CD1 3.46Å
14	A	64.7	Low	78.6	Confident	65 Å²	65	59.2 Å²	59.2	54%	0.537	32%	0.324	S	S	.	.	S	Bend	trans	-88	-32.7	-179.9	0	0	0	0	0	112.4	G12	G12-A14 PolarHBondContact O-N 3.07Å
15	D	69.5	Low	78.4	Confident	110 Å²	110	56 Å²	56	59%	0.588	32%	0.316	S	S	*	.			trans	-113.7	56.1	-164.3	-61.7	-24.8	0	0	0	111.3	S10 G12 E17	S10-D15 WeakPolarHBondContact CB-O 3.42Å; S10-D15 WeakPolarHBondContact OG-CB 3.14Å; S10-D15 PolarHBondContact OG-O 3.3Å; G12-D15 PolarHBondContact O-N 2.86Å; D15-E17 PolarHBondContact O-N 2.81Å
16	L	75.9	Confident	77.8	Confident	24 Å²	24	61 Å²	61	13%	0.126	34%	0.338	C	S	.	.			trans	-74.3	71.1	171.7	-70.3	98.3	0	0	0	110.3	M13 P18 V88 L99	M13-L16 VanDerWaalsContact O-CD1 3.31Å; M13-L16 WeakPolarHBondContact O-CD1 3.46Å; L16-P18 WeakPolarHBondContact O-CD 3.29Å; L16-V88 HydrophobicContact CD2-CB 4.37Å; L16-V88 HydrophobicContact CD2-CG1 3.43Å; L16-V88 VanDerWaalsContact CD2-CG1 3.43Å; L16-V88 HydrophobicContact CD2-CG2 4Å; L16-L99 HydrophobicContact CB-CB 3.73Å; L16-L99 HydrophobicContact CB-CD1 4.11Å; L16-L99 HydrophobicContact CD2-CB 3.89Å; L16-L99 HydrophobicContact CG-CB 4.48Å
17	E	83.4	Confident	76.9	Confident	105 Å²	105	61.7 Å²	61.7	49%	0.491	34%	0.343	S	S	.	.			trans	-75.5	119.5	173.6	-169.7	-177.8	170.5	0	0	109.6	Y8 V9 D15	Y8-E17 CarbonylContact C-O 3.55Å; Y8-E17 VanDerWaalsContact CA-O 3.26Å; Y8-E17 WeakPolarHBondContact CA-O 3.48Å; V9-E17 PolarHBondContact N-O 2.72Å; D15-E17 PolarHBondContact O-N 2.81Å
18	P	85.2	Confident	75.9	Confident	40 Å²	40	65.2 Å²	65.2	26%	0.26	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	128.2	-178.8	28.6	-31.9	0	0	0	112	P5 T7 L16 T20 M23 L99	P5-P18 HydrophobicContact CB-CB 3.5Å; P5-P18 HydrophobicContact CG-CB 3.46Å; P5-P18 VanDerWaalsContact CG-CB 3.46Å; P5-P18 HydrophobicContact CG-CG 4.42Å; T7-P18 CarbonylContact O-C 3.52Å; L16-P18 WeakPolarHBondContact O-CD 3.29Å; P18-T20 HydrophobicContact CB-CG2 4.08Å; P18-T20 HydrophobicContact CG-CG2 4.35Å; P18-T20 PolarHBondContact O-N 2.62Å; P18-M23 WeakPolarHBondContact O-CE 3.44Å; P18-L99 HydrophobicContact CB-CD1 3.84Å; P18-L99 HydrophobicContact CB-CG 4.16Å
19	L	84.3	Confident	74.8	Confident	47 Å²	47	70.4 Å²	70.4	25%	0.246	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	101.4	166.4	-170.8	62.2	0	0	0	109.9	L6 T7 V9 M23 F24	L6-L19 WeakPolarHBondContact CA-O 3.28Å; L6-L19 VanDerWaalsContact CB-O 3.3Å; L6-L19 WeakPolarHBondContact CB-O 3.47Å; L6-L19 PolarHBondContact N-O 3.32Å; T7-L19 HydrophobicContact CG2-CB 3.75Å; T7-L19 HydrophobicContact CG2-CD2 3.56Å; T7-L19 HydrophobicContact CG2-CG 4.27Å; T7-L19 PolarHBondContact O-N 3.19Å; V9-L19 HydrophobicContact CG2-CB 4.16Å; V9-L19 HydrophobicContact CG2-CD1 4.37Å; L19-M23 HydrophobicContact CD1-SD 3.97Å; L19-F24 HydrophobicContact CD1-CE2 3.87Å; L19-F24 HydrophobicContact CD1-CZ 3.65Å; L19-F24 HydrophobicContact CD2-CE2 4.28Å; L19-F24 HydrophobicContact CD2-CZ 3.91Å; L19-F24 HydrophobicContact CG-CE2 3.86Å; L19-F24 HydrophobicContact CG-CZ 3.87Å
20	T	83.6	Confident	73.6	Confident	14 Å²	14	74 Å²	74	9%	0.086	39%	0.389	C	S	.	.			trans	-103.5	154.9	-177	68.4	0	0	0	0	112.7	S3 P5 P18 S22 M23	S3-T20 WeakPolarHBondContact O-CG2 3.15Å; P5-T20 HydrophobicContact CB-CG2 4.42Å; P5-T20 HydrophobicContact CG-CG2 4.36Å; P18-T20 HydrophobicContact CB-CG2 4.08Å; P18-T20 HydrophobicContact CG-CG2 4.35Å; P18-T20 PolarHBondContact O-N 2.62Å; T20-S22 PolarHBondContact O-N 3.4Å; T20-S22 VanDerWaalsContact O-N 3.15Å; T20-M23 PolarHBondContact N-SD 3.46Å; T20-M23 VanDerWaalsContact N-SD 3.35Å; T20-M23 WeakPolarHBondContact O-CB 3.46Å; T20-M23 VanDerWaalsContact O-CG 3.27Å; T20-M23 WeakPolarHBondContact O-CG 3.49Å; T20-M23 PolarHBondContact O-N 3.08Å; T20-M23 VanDerWaalsContact OG1-CG 3.31Å; T20-M23 WeakPolarHBondContact OG1-CG 3.49Å
21	P	80.9	Confident	72.5	Confident	14 Å²	14	79.9 Å²	79.9	9%	0.091	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-30.4	174.5	-25.5	34.6	0	0	0	113.3	N2 R4 L6 M23 F24 L25 F62	N2-P21 HydrophobicContact CB-CB 4.27Å; N2-P21 WeakPolarHBondContact O-CD 3.34Å; R4-P21 WeakPolarHBondContact O-CD 3.38Å; L6-P21 HydrophobicContact CD1-CG 4.18Å; L6-P21 HydrophobicContact CD2-CG 3.92Å; L6-P21 HydrophobicContact CG-CG 3.95Å; P21-M23 PolarHBondContact O-N 2.91Å; P21-F24 PolarHBondContact O-N 3.12Å; P21-F24 VanDerWaalsContact O-N 3.17Å; P21-L25 WeakPolarHBondContact O-CG 3.43Å; P21-L25 PolarHBondContact O-N 2.88Å; P21-F62 HydrophobicContact CB-CZ 4.27Å; P21-F62 HydrophobicContact CG-CZ 4.24Å
22	S	82.2	Confident	71.8	Confident	27 Å²	27	76.4 Å²	76.4	19%	0.189	42%	0.419	C	S	.	.	H	α-helix	trans	-56.1	-35.2	175.5	-163.9	0	0	0	0	112.3	N2 T20 F24 L25 Q26	N2-S22 WeakPolarHBondContact O-CB 3.38Å; N2-S22 PolarHBondContact O-N 2.69Å; N2-S22 VanDerWaalsContact O-N 3.07Å; T20-S22 PolarHBondContact O-N 3.4Å; T20-S22 VanDerWaalsContact O-N 3.15Å; S22-F24 PolarHBondContact O-N 3.13Å; S22-L25 PolarHBondContact O-N 2.85Å; S22-Q26 WeakPolarHBondContact O-CB 3.33Å; S22-Q26 WeakPolarHBondContact O-CG 3.3Å; S22-Q26 PolarHBondContact O-N 2.92Å; S22-Q26 PolarHBondContact O-OE1 3.49Å; S22-Q26 VanDerWaalsContact OG-CD 3.24Å; S22-Q26 PolarHBondContact OG-OE1 3.43Å; S22-Q26 VanDerWaalsContact OG-OE1 3.06Å
23	M	82	Confident	71	Confident	33 Å²	33	81.4 Å²	81.4	16%	0.163	44%	0.442	C	S	.	.	H	α-helix	trans	-63.4	-27	-178.2	-53.6	-168.9	155	0	0	113.2	P18 L19 T20 P21 R29	P18-M23 WeakPolarHBondContact O-CE 3.44Å; L19-M23 HydrophobicContact CD1-SD 3.97Å; T20-M23 PolarHBondContact N-SD 3.46Å; T20-M23 VanDerWaalsContact N-SD 3.35Å; T20-M23 WeakPolarHBondContact O-CB 3.46Å; T20-M23 VanDerWaalsContact O-CG 3.27Å; T20-M23 WeakPolarHBondContact O-CG 3.49Å; T20-M23 PolarHBondContact O-N 3.08Å; T20-M23 VanDerWaalsContact OG1-CG 3.31Å; T20-M23 WeakPolarHBondContact OG1-CG 3.49Å; P21-M23 PolarHBondContact O-N 2.91Å; M23-R29 VanDerWaalsContact CB-NH2 3.26Å; M23-R29 PolarHBondContact SD-NH2 3.2Å
24	F	76.3	Confident	70.8	Confident	111 Å²	111	80.7 Å²	80.7	49%	0.487	45%	0.45	S	S	.	.	H	α-helix	trans	-95.7	-25.7	178.6	-58.3	-79.4	0	0	0	113.2	L6 L19 P21 S22	L6-F24 HydrophobicContact CD1-CE2 4.07Å; L19-F24 HydrophobicContact CD1-CE2 3.87Å; L19-F24 HydrophobicContact CD1-CZ 3.65Å; L19-F24 HydrophobicContact CD2-CE2 4.28Å; L19-F24 HydrophobicContact CD2-CZ 3.91Å; L19-F24 HydrophobicContact CG-CE2 3.86Å; L19-F24 HydrophobicContact CG-CZ 3.87Å; P21-F24 PolarHBondContact O-N 3.12Å; P21-F24 VanDerWaalsContact O-N 3.17Å; S22-F24 PolarHBondContact O-N 3.13Å
25	L	75.4	Confident	70.4	Confident	48 Å²	48	84.3 Å²	84.3	25%	0.251	46%	0.46	S	S	.	.	H	α-helix	trans	-87.8	-22.5	-176.7	-69.6	172.2	0	0	0	112.8	N2 P21 S22	N2-L25 VanDerWaalsContact ND2-CD1 3.34Å; N2-L25 WeakPolarHBondContact ND2-CD1 3.42Å; P21-L25 WeakPolarHBondContact O-CG 3.43Å; P21-L25 PolarHBondContact O-N 2.88Å; S22-L25 PolarHBondContact O-N 2.85Å
26	Q	71	Confident	70	Confident	109 Å²	109	82.6 Å²	82.6	51%	0.509	45%	0.454	S	S	.	.			trans	-84.9	116.7	176.2	-72	174.5	-43	0	0	109.4	S22 N28	S22-Q26 WeakPolarHBondContact O-CB 3.33Å; S22-Q26 WeakPolarHBondContact O-CG 3.3Å; S22-Q26 PolarHBondContact O-N 2.92Å; S22-Q26 PolarHBondContact O-OE1 3.49Å; S22-Q26 VanDerWaalsContact OG-CD 3.24Å; S22-Q26 PolarHBondContact OG-OE1 3.43Å; S22-Q26 VanDerWaalsContact OG-OE1 3.06Å; Q26-N28 VanDerWaalsContact C-N 3.31Å; Q26-N28 PolarHBondContact O-N 2.78Å
27	D	64	Low	69.2	Low	78 Å²	78	88.3 Å²	88.3	42%	0.417	49%	0.485	S	S	.	.	S	Bend	trans	-65.9	-35.6	-173.9	-131.7	30.7	0	0	0	112.8	R51	D27-R51 PolarHBondContact O-NH2 3.28Å; D27-R51 IonicContact OD1-CZ 3.64Å; D27-R51 IonicContact OD1-NE 3.37Å; D27-R51 PolarHBondContact OD1-NE 3.15Å; D27-R51 IonicContact OD1-NH1 3.82Å; D27-R51 IonicContact OD1-NH2 3.54Å; D27-R51 PolarHBondContact OD1-NH2 2.94Å; D27-R51 VanDerWaalsContact OD2-CD 3.3Å; D27-R51 WeakPolarHBondContact OD2-CD 3.34Å; D27-R51 IonicContact OD2-CZ 2.85Å; D27-R51 IonicContact OD2-NE 2.64Å; D27-R51 PolarHBondContact OD2-NE 3.37Å; D27-R51 IonicContact OD2-NH1 2.95Å; D27-R51 PolarHBondContact OD2-NH1 3.17Å; D27-R51 VanDerWaalsContact OD2-NH1 3.11Å; D27-R51 IonicContact OD2-NH2 2.73Å; D27-R51 PolarHBondContact OD2-NH2 2.63Å
28	N	61.8	Low	68	Low	121 Å²	121	91.2 Å²	91.2	65%	0.647	50%	0.503	S	S	*	.			trans	-133.6	113.4	-176.9	-63	-19.7	0	0	0	107.9	Q26 Q30	Q26-N28 VanDerWaalsContact C-N 3.31Å; Q26-N28 PolarHBondContact O-N 2.78Å; N28-Q30 VanDerWaalsContact C-N 3.33Å
29	R	62.6	Low	66.9	Low	150 Å²	150	92.7 Å²	92.7	57%	0.566	51%	0.512	S	S	*	.			trans	-82.8	-17.5	167.6	-75.4	170.7	145.5	-174.9	-28.1	112.4	M23	M23-R29 VanDerWaalsContact CB-NH2 3.26Å; M23-R29 PolarHBondContact SD-NH2 3.2Å
30	Q	58.5	Low	66	Low	167 Å²	167	95.1 Å²	95.1	78%	0.78	53%	0.525	S	S	*	.			trans	-86.8	124.1	-179.2	-67.9	177.7	2.2	0	0	109.7	N28 G32	N28-Q30 VanDerWaalsContact C-N 3.33Å; Q30-G32 VanDerWaalsContact C-N 3.32Å; Q30-G32 PolarHBondContact O-N 3.41Å
31	V	54.6	Low	65.3	Low	160 Å²	160	97.8 Å²	97.8	97%	0.97	55%	0.549	S	S	*	.			trans	-81.1	88.8	160.1	-179.2	0	0	0	0	105.5
32	G	58.3	Low	64.9	Low	58 Å²	58	102.6 Å²	102.6	60%	0.598	57%	0.574	S	S	*	*			trans	-167.5	132.3	179.9	0	0	0	0	0	109.6	Q30 A34	Q30-G32 VanDerWaalsContact C-N 3.32Å; Q30-G32 PolarHBondContact O-N 3.41Å; G32-A34 PolarHBondContact O-N 2.98Å
33	V	55	Low	64.2	Low	140 Å²	140	103.9 Å²	103.9	85%	0.848	58%	0.582	S	S	*	*			trans	-78.1	114.3	169.1	-179.5	0	0	0	0	105.6
34	A	57.7	Low	63.7	Low	73 Å²	73	105.8 Å²	105.8	60%	0.603	59%	0.593	S	S	*	*			trans	-69.6	132.8	164.8	0	0	0	0	0	107.4	G32 V36	G32-A34 PolarHBondContact O-N 2.98Å; A34-V36 HydrophobicContact CB-CG2 4.27Å; A34-V36 VanDerWaalsContact O-CG2 3.3Å; A34-V36 WeakPolarHBondContact O-CG2 3.19Å; A34-V36 PolarHBondContact O-N 2.83Å
35	D	56.2	Low	63.8	Low	141 Å²	141	102.7 Å²	102.7	75%	0.754	59%	0.585	S	S	*	*			trans	-63.9	102.9	169.6	-79.3	-23.8	0	0	0	108.2
36	V	61.1	Low	64.1	Low	74 Å²	74	105.2 Å²	105.2	45%	0.448	60%	0.599	S	S	.	*			trans	-104.5	53.2	178.1	-164.5	0	0	0	0	108.8	A34 N38 V39 L44	A34-V36 HydrophobicContact CB-CG2 4.27Å; A34-V36 VanDerWaalsContact O-CG2 3.3Å; A34-V36 WeakPolarHBondContact O-CG2 3.19Å; A34-V36 PolarHBondContact O-N 2.83Å; V36-N38 VanDerWaalsContact C-N 3.27Å; V36-N38 PolarHBondContact O-N 2.85Å; V36-V39 HydrophobicContact CG1-CB 3.76Å; V36-V39 HydrophobicContact CG1-CG2 3.41Å; V36-V39 VanDerWaalsContact CG1-CG2 3.41Å; V36-L44 HydrophobicContact CG1-CD1 4.09Å; V36-L44 HydrophobicContact CG1-CD2 4.14Å
37	D	59	Low	64.6	Low	144 Å²	144	109.4 Å²	109.4	77%	0.77	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	0.3	-172	-71.8	-17.7	0	0	0	114.2
38	N	58.7	Low	65.3	Low	166 Å²	166	107.9 Å²	107.9	89%	0.888	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.3	26.3	-173.2	-129.4	-2.2	0	0	0	115.2	V36	V36-N38 VanDerWaalsContact C-N 3.27Å; V36-N38 PolarHBondContact O-N 2.85Å
39	V	61.1	Low	66.3	Low	71 Å²	71	108 Å²	108	43%	0.43	60%	0.603	S	S	.	*			trans	-115.3	124.3	-177.7	-163.7	0	0	0	0	111.4	V36 A41 S43 L44	V36-V39 HydrophobicContact CG1-CB 3.76Å; V36-V39 HydrophobicContact CG1-CG2 3.41Å; V36-V39 VanDerWaalsContact CG1-CG2 3.41Å; V39-A41 PolarHBondContact O-N 2.86Å; V39-S43 WeakPolarHBondContact CG1-OG 3.42Å; V39-L44 HydrophobicContact CB-CD1 4.01Å; V39-L44 HydrophobicContact CB-CD2 3.91Å; V39-L44 HydrophobicContact CB-CG 3.85Å; V39-L44 HydrophobicContact CG1-CD1 4.23Å; V39-L44 HydrophobicContact CG1-CD2 3.51Å; V39-L44 HydrophobicContact CG1-CG 3.5Å; V39-L44 HydrophobicContact CG2-CD2 4.5Å
40	D	66.9	Low	67.4	Low	98 Å²	98	108 Å²	108	52%	0.524	60%	0.604	S	S	.	*			trans	-54.6	127.7	175.3	167.8	37.3	0	0	0	111.1	N42 S43 L44	D40-N42 PolarHBondContact O-N 2.85Å; D40-N42 PolarHBondContact OD1-N 3.14Å; D40-N42 WeakPolarHBondContact OD2-CB 3.33Å; D40-S43 PolarHBondContact O-N 2.89Å; D40-S43 PolarHBondContact O-OG 3.31Å; D40-S43 PolarHBondContact OD2-N 2.86Å; D40-L44 PolarHBondContact O-N 3.49Å
41	A	68.9	Low	68.6	Low	71 Å²	71	104.9 Å²	104.9	59%	0.587	59%	0.585	S	S	*	*	H	α-helix	trans	-55.8	-34.2	-178.3	0	0	0	0	0	112.6	V39 S45	V39-A41 PolarHBondContact O-N 2.86Å; A41-S45 VanDerWaalsContact O-CB 3.25Å; A41-S45 WeakPolarHBondContact O-CB 3.4Å; A41-S45 PolarHBondContact O-N 2.83Å
42	N	71.2	Confident	69.9	Low	115 Å²	115	102.8 Å²	102.8	62%	0.615	57%	0.565	S	S	*	*	H	α-helix	trans	-71.1	-41.3	176.8	-81.6	-9.8	0	0	0	111.9	D40 S45 N46	D40-N42 PolarHBondContact O-N 2.85Å; D40-N42 PolarHBondContact OD1-N 3.14Å; D40-N42 WeakPolarHBondContact OD2-CB 3.33Å; N42-S45 PolarHBondContact O-N 3.08Å; N42-N46 WeakPolarHBondContact O-CB 3.29Å; N42-N46 PolarHBondContact O-N 2.89Å; N42-N46 PolarHBondContact O-ND2 3.46Å
43	S	68.8	Low	71.3	Confident	53 Å²	53	108.7 Å²	108.7	37%	0.371	57%	0.569	S	S	.	*	H	α-helix	trans	-63.4	-41.4	174.4	80.1	0	0	0	0	112.4	V39 D40 N46 R47	V39-S43 WeakPolarHBondContact CG1-OG 3.42Å; D40-S43 PolarHBondContact O-N 2.89Å; D40-S43 PolarHBondContact O-OG 3.31Å; D40-S43 PolarHBondContact OD2-N 2.86Å; S43-N46 PolarHBondContact O-N 3.09Å; S43-R47 WeakPolarHBondContact O-CB 3.46Å; S43-R47 PolarHBondContact O-N 3.45Å
44	L	71	Confident	72.8	Confident	74 Å²	74	105.8 Å²	105.8	39%	0.387	55%	0.548	S	S	.	.	H	α-helix	trans	-61.9	-44.5	173	-73	176.2	0	0	0	111.3	V36 V39 D40 R47 A48	V36-L44 HydrophobicContact CG1-CD1 4.09Å; V36-L44 HydrophobicContact CG1-CD2 4.14Å; V39-L44 HydrophobicContact CB-CD1 4.01Å; V39-L44 HydrophobicContact CB-CD2 3.91Å; V39-L44 HydrophobicContact CB-CG 3.85Å; V39-L44 HydrophobicContact CG1-CD1 4.23Å; V39-L44 HydrophobicContact CG1-CD2 3.51Å; V39-L44 HydrophobicContact CG1-CG 3.5Å; V39-L44 HydrophobicContact CG2-CD2 4.5Å; D40-L44 PolarHBondContact O-N 3.49Å; L44-R47 PolarHBondContact O-N 3.39Å; L44-A48 WeakPolarHBondContact O-CB 3.49Å; L44-A48 PolarHBondContact O-N 3.34Å
45	S	77.5	Confident	74	Confident	46 Å²	46	104.6 Å²	104.6	32%	0.322	53%	0.531	S	S	.	.	H	α-helix	trans	-62.3	-45.6	178.2	-174	0	0	0	0	111.7	A41 N42 A48 K49	A41-S45 VanDerWaalsContact O-CB 3.25Å; A41-S45 WeakPolarHBondContact O-CB 3.4Å; A41-S45 PolarHBondContact O-N 2.83Å; N42-S45 PolarHBondContact O-N 3.08Å; S45-A48 PolarHBondContact O-N 3.14Å; S45-K49 WeakPolarHBondContact O-CB 3.19Å; S45-K49 WeakPolarHBondContact O-CG 3.27Å; S45-K49 PolarHBondContact O-N 3.21Å; S45-K49 WeakPolarHBondContact OG-CE 3.26Å
46	N	81.4	Confident	75.4	Confident	101 Å²	101	104.6 Å²	104.6	54%	0.54	52%	0.524	S	S	.	.	H	α-helix	trans	-65.9	-44.4	178.5	-73.5	-23.9	0	0	0	112	N42 S43 K49 Y50	N42-N46 WeakPolarHBondContact O-CB 3.29Å; N42-N46 PolarHBondContact O-N 2.89Å; N42-N46 PolarHBondContact O-ND2 3.46Å; S43-N46 PolarHBondContact O-N 3.09Å; N46-K49 PolarHBondContact O-N 3.07Å; N46-Y50 WeakPolarHBondContact O-CB 3.17Å; N46-Y50 PolarHBondContact O-N 2.87Å
47	R	82	Confident	76.7	Confident	196 Å²	196	104.1 Å²	104.1	74%	0.74	52%	0.523	S	S	*	.	H	α-helix	trans	-63.2	-42.8	175.7	-175.3	173.8	175.1	158.8	-2.1	111.7	S43 L44 Y50 R51	S43-R47 WeakPolarHBondContact O-CB 3.46Å; S43-R47 PolarHBondContact O-N 3.45Å; L44-R47 PolarHBondContact O-N 3.39Å; R47-Y50 PolarHBondContact O-N 2.8Å; R47-R51 WeakPolarHBondContact O-CB 3.46Å; R47-R51 PolarHBondContact O-N 3.2Å
48	A	80	Confident	78.1	Confident	46 Å²	46	101 Å²	101	38%	0.38	51%	0.506	S	S	.	.	H	α-helix	trans	-63.6	-44.8	175.9	0	0	0	0	0	111.8	L44 S45 Y50 R51 Q52	L44-A48 WeakPolarHBondContact O-CB 3.49Å; L44-A48 PolarHBondContact O-N 3.34Å; S45-A48 PolarHBondContact O-N 3.14Å; A48-Y50 PolarHBondContact O-N 3.43Å; A48-R51 PolarHBondContact O-N 3.02Å; A48-Q52 WeakPolarHBondContact O-CB 2.97Å; A48-Q52 VanDerWaalsContact O-CG 3.26Å; A48-Q52 WeakPolarHBondContact O-CG 3.03Å; A48-Q52 PolarHBondContact O-N 2.83Å
49	K	81.7	Confident	79.2	Confident	124 Å²	124	100.5 Å²	100.5	54%	0.539	49%	0.492	S	S	.	.	H	α-helix	trans	-60.3	-44	174.7	-75.3	171.2	-173.9	173.4	0	111.9	S45 N46 Q52 R53	S45-K49 WeakPolarHBondContact O-CB 3.19Å; S45-K49 WeakPolarHBondContact O-CG 3.27Å; S45-K49 PolarHBondContact O-N 3.21Å; S45-K49 WeakPolarHBondContact OG-CE 3.26Å; N46-K49 PolarHBondContact O-N 3.07Å; K49-Q52 PolarHBondContact O-N 2.79Å; K49-R53 WeakPolarHBondContact O-CB 3.42Å; K49-R53 PolarHBondContact O-N 3.39Å
50	Y	86.1	Confident	80.4	Confident	149 Å²	149	106.1 Å²	106.1	58%	0.584	51%	0.505	S	S	*	.	H	α-helix	trans	-62.2	-47.4	176.8	179.3	-109.6	0	0	0	111.7	N46 R47 A48 Q52 R53 L54	N46-Y50 WeakPolarHBondContact O-CB 3.17Å; N46-Y50 PolarHBondContact O-N 2.87Å; R47-Y50 PolarHBondContact O-N 2.8Å; A48-Y50 PolarHBondContact O-N 3.43Å; Y50-Q52 PolarHBondContact O-N 3.29Å; Y50-R53 WeakPolarHBondContact O-CB 3.23Å; Y50-R53 PolarHBondContact O-N 2.82Å; Y50-R53 VanDerWaalsContact O-N 3.12Å; Y50-L54 HydrophobicContact CD1-CD1 3.99Å; Y50-L54 HydrophobicContact CD1-CG 4.47Å; Y50-L54 HydrophobicContact CE1-CD1 3.4Å; Y50-L54 VanDerWaalsContact CE1-CD1 3.4Å; Y50-L54 HydrophobicContact CE1-CG 4.07Å; Y50-L54 HydrophobicContact CE2-CD1 4.46Å; Y50-L54 HydrophobicContact CE2-CD2 4.41Å; Y50-L54 HydrophobicContact CE2-CG 4.29Å; Y50-L54 PolarHBondContact O-N 3.22Å
51	R	83.7	Confident	81.3	Confident	102 Å²	102	109.4 Å²	109.4	39%	0.385	51%	0.51	S	S	.	.	H	α-helix	trans	-59.3	-45.5	176	-168.5	176.3	-170.7	-177.7	-0.6	111.8	D27 R47 A48 R53 L54 M55	D27-R51 PolarHBondContact O-NH2 3.28Å; D27-R51 IonicContact OD1-CZ 3.64Å; D27-R51 IonicContact OD1-NE 3.37Å; D27-R51 PolarHBondContact OD1-NE 3.15Å; D27-R51 IonicContact OD1-NH1 3.82Å; D27-R51 IonicContact OD1-NH2 3.54Å; D27-R51 PolarHBondContact OD1-NH2 2.94Å; D27-R51 VanDerWaalsContact OD2-CD 3.3Å; D27-R51 WeakPolarHBondContact OD2-CD 3.34Å; D27-R51 IonicContact OD2-CZ 2.85Å; D27-R51 IonicContact OD2-NE 2.64Å; D27-R51 PolarHBondContact OD2-NE 3.37Å; D27-R51 IonicContact OD2-NH1 2.95Å; D27-R51 PolarHBondContact OD2-NH1 3.17Å; D27-R51 VanDerWaalsContact OD2-NH1 3.11Å; D27-R51 IonicContact OD2-NH2 2.73Å; D27-R51 PolarHBondContact OD2-NH2 2.63Å; R47-R51 WeakPolarHBondContact O-CB 3.46Å; R47-R51 PolarHBondContact O-N 3.2Å; A48-R51 PolarHBondContact O-N 3.02Å; R51-R53 VanDerWaalsContact C-N 3.33Å; R51-R53 PolarHBondContact O-N 2.73Å; R51-L54 PolarHBondContact O-N 3.29Å; R51-M55 WeakPolarHBondContact O-CG 3.21Å; R51-M55 PolarHBondContact O-N 3.47Å
52	Q	81.4	Confident	81.9	Confident	116 Å²	116	109.3 Å²	109.3	54%	0.542	50%	0.497	S	S	.	.	H	α-helix	trans	-60.5	-40.1	174.4	-74.4	178.2	0.8	0	0	112.3	A48 K49 Y50 M55 K56	A48-Q52 WeakPolarHBondContact O-CB 2.97Å; A48-Q52 VanDerWaalsContact O-CG 3.26Å; A48-Q52 WeakPolarHBondContact O-CG 3.03Å; A48-Q52 PolarHBondContact O-N 2.83Å; K49-Q52 PolarHBondContact O-N 2.79Å; Y50-Q52 PolarHBondContact O-N 3.29Å; Q52-M55 PolarHBondContact O-N 3.03Å; Q52-K56 WeakPolarHBondContact O-CB 3.21Å; Q52-K56 VanDerWaalsContact O-CG 3.31Å; Q52-K56 WeakPolarHBondContact O-CG 3.29Å; Q52-K56 PolarHBondContact O-N 2.95Å
53	R	87	Confident	82.4	Confident	182 Å²	182	112.3 Å²	112.3	69%	0.687	50%	0.499	S	S	*	.	H	α-helix	trans	-63.3	-47.1	175.5	-175.4	179.1	179.6	178.5	-0.3	111.2	K49 Y50 R51 M55 K56 C57	K49-R53 WeakPolarHBondContact O-CB 3.42Å; K49-R53 PolarHBondContact O-N 3.39Å; Y50-R53 WeakPolarHBondContact O-CB 3.23Å; Y50-R53 PolarHBondContact O-N 2.82Å; Y50-R53 VanDerWaalsContact O-N 3.12Å; R51-R53 VanDerWaalsContact C-N 3.33Å; R51-R53 PolarHBondContact O-N 2.73Å; R53-M55 PolarHBondContact O-N 3.37Å; R53-K56 PolarHBondContact O-N 3.16Å; R53-C57 PolarHBondContact O-N 2.91Å; R53-C57 PolarHBondContact O-SG 3.21Å; R53-C57 VanDerWaalsContact O-SG 3.37Å
54	L	87.7	Confident	83.1	Confident	80 Å²	80	113.9 Å²	113.9	42%	0.419	51%	0.507	S	S	.	.	H	α-helix	trans	-58.9	-45.9	175.6	-72.2	-179.3	0	0	0	111.7	Y50 R51 K56 C57 L58	Y50-L54 HydrophobicContact CD1-CD1 3.99Å; Y50-L54 HydrophobicContact CD1-CG 4.47Å; Y50-L54 HydrophobicContact CE1-CD1 3.4Å; Y50-L54 VanDerWaalsContact CE1-CD1 3.4Å; Y50-L54 HydrophobicContact CE1-CG 4.07Å; Y50-L54 HydrophobicContact CE2-CD1 4.46Å; Y50-L54 HydrophobicContact CE2-CD2 4.41Å; Y50-L54 HydrophobicContact CE2-CG 4.29Å; Y50-L54 PolarHBondContact O-N 3.22Å; R51-L54 PolarHBondContact O-N 3.29Å; L54-K56 PolarHBondContact O-N 3.26Å; L54-C57 PolarHBondContact O-N 2.99Å; L54-L58 WeakPolarHBondContact O-CB 3.45Å; L54-L58 PolarHBondContact O-N 2.94Å
55	M	83.4	Confident	83.8	Confident	48 Å²	48	115.6 Å²	115.6	24%	0.236	51%	0.513	C	S	.	.	H	α-helix	trans	-63.4	-39	177.6	-72.3	-60.4	114	0	0	112.7	R51 Q52 R53 L58 R59	R51-M55 WeakPolarHBondContact O-CG 3.21Å; R51-M55 PolarHBondContact O-N 3.47Å; Q52-M55 PolarHBondContact O-N 3.03Å; R53-M55 PolarHBondContact O-N 3.37Å; M55-L58 HydrophobicContact CE-CD2 4.07Å; M55-L58 HydrophobicContact SD-CD2 4.29Å; M55-R59 VanDerWaalsContact O-CB 3.22Å; M55-R59 WeakPolarHBondContact O-CB 3.4Å; M55-R59 PolarHBondContact O-N 2.92Å
56	K	85.3	Confident	83.7	Confident	141 Å²	141	116.9 Å²	116.9	61%	0.613	51%	0.511	S	S	*	.	H	α-helix	trans	-62.1	-45.4	173	-77.1	174.2	-178.4	178.3	0	111.3	Q52 R53 L54 R59 R60	Q52-K56 WeakPolarHBondContact O-CB 3.21Å; Q52-K56 VanDerWaalsContact O-CG 3.31Å; Q52-K56 WeakPolarHBondContact O-CG 3.29Å; Q52-K56 PolarHBondContact O-N 2.95Å; R53-K56 PolarHBondContact O-N 3.16Å; L54-K56 PolarHBondContact O-N 3.26Å; K56-R59 PolarHBondContact O-N 3.47Å; K56-R60 WeakPolarHBondContact O-CB 3.45Å; K56-R60 PolarHBondContact O-N 3.43Å
57	C	88.9	Confident	83.4	Confident	63 Å²	63	115.4 Å²	115.4	43%	0.426	50%	0.503	S	S	.	.	H	α-helix	trans	-62.8	-47.5	176.6	-71.7	0	0	0	0	111.9	R53 L54 R59 R60 R61	R53-C57 PolarHBondContact O-N 2.91Å; R53-C57 PolarHBondContact O-SG 3.21Å; R53-C57 VanDerWaalsContact O-SG 3.37Å; L54-C57 PolarHBondContact O-N 2.99Å; C57-R59 PolarHBondContact O-N 3.49Å; C57-R60 PolarHBondContact O-N 3.42Å; C57-R61 PolarHBondContact O-N 2.89Å
58	L	86.9	Confident	83	Confident	79 Å²	79	107 Å²	107	41%	0.414	48%	0.478	S	S	.	.	H	α-helix	trans	-59.1	-48.5	177.3	-176.6	71.2	0	0	0	110.6	L54 M55 R60 R61 F62	L54-L58 WeakPolarHBondContact O-CB 3.45Å; L54-L58 PolarHBondContact O-N 2.94Å; M55-L58 HydrophobicContact CE-CD2 4.07Å; M55-L58 HydrophobicContact SD-CD2 4.29Å; L58-R60 VanDerWaalsContact C-N 3.31Å; L58-R60 PolarHBondContact O-N 3Å; L58-R61 PolarHBondContact O-N 3.46Å; L58-F62 WeakPolarHBondContact O-CB 3.43Å; L58-F62 PolarHBondContact O-N 2.74Å
59	R	81.8	Confident	82.6	Confident	155 Å²	155	111 Å²	111	59%	0.585	49%	0.488	S	S	*	.	H	α-helix	trans	-60.5	-40.4	178.2	-170.5	-178.5	-58.4	157.3	3.2	112	M55 K56 C57 R63	M55-R59 VanDerWaalsContact O-CB 3.22Å; M55-R59 WeakPolarHBondContact O-CB 3.4Å; M55-R59 PolarHBondContact O-N 2.92Å; K56-R59 PolarHBondContact O-N 3.47Å; C57-R59 PolarHBondContact O-N 3.49Å; R59-R63 VanDerWaalsContact O-CB 3.26Å; R59-R63 WeakPolarHBondContact O-CB 3.35Å; R59-R63 PolarHBondContact O-N 2.96Å
60	R	86.1	Confident	82.1	Confident	190 Å²	190	108.5 Å²	108.5	72%	0.717	48%	0.481	S	S	*	.	H	α-helix	trans	-63.1	-54.7	175.8	-177.7	179.2	175.5	-179.5	-0.8	110.9	K56 C57 L58 R63 T64	K56-R60 WeakPolarHBondContact O-CB 3.45Å; K56-R60 PolarHBondContact O-N 3.43Å; C57-R60 PolarHBondContact O-N 3.42Å; L58-R60 VanDerWaalsContact C-N 3.31Å; L58-R60 PolarHBondContact O-N 3Å; R60-R63 PolarHBondContact O-N 2.89Å; R60-T64 WeakPolarHBondContact O-CG2 3.31Å; R60-T64 PolarHBondContact O-N 2.83Å; R60-T64 PolarHBondContact O-OG1 3.11Å; R60-T64 VanDerWaalsContact O-OG1 3.05Å
61	R	86.9	Confident	81	Confident	167 Å²	167	108.6 Å²	108.6	63%	0.63	49%	0.49	S	S	*	.	H	α-helix	trans	-61.4	-46.6	-179.8	-73.5	-170.7	179.9	176.8	-1.5	112.1	C57 L58 R63 T64 E65	C57-R61 PolarHBondContact O-N 2.89Å; L58-R61 PolarHBondContact O-N 3.46Å; R61-R63 VanDerWaalsContact C-N 3.32Å; R61-R63 PolarHBondContact O-N 2.98Å; R61-T64 WeakPolarHBondContact CA-OG1 3.48Å; R61-T64 PolarHBondContact O-N 3.07Å; R61-T64 PolarHBondContact O-OG1 3.26Å; R61-E65 WeakPolarHBondContact CG-OE1 3.25Å; R61-E65 VanDerWaalsContact O-CB 3.25Å; R61-E65 WeakPolarHBondContact O-CB 3.49Å; R61-E65 WeakPolarHBondContact O-CG 3.46Å; R61-E65 PolarHBondContact O-N 3.18Å
62	F	81.5	Confident	79.9	Confident	69 Å²	69	111.1 Å²	111.1	30%	0.303	51%	0.506	S	S	.	.	I	π-helix	trans	-57	-46.1	175.2	-174	-96	0	0	0	111	P21 L58 T64 Y66 L67	P21-F62 HydrophobicContact CB-CZ 4.27Å; P21-F62 HydrophobicContact CG-CZ 4.24Å; L58-F62 WeakPolarHBondContact O-CB 3.43Å; L58-F62 PolarHBondContact O-N 2.74Å; F62-T64 PolarHBondContact O-N 2.9Å; F62-Y66 HydrophobicContact CD1-CD1 4.44Å; F62-Y66 HydrophobicContact CD2-CD1 4.37Å; F62-Y66 HydrophobicContact CD2-CG 4.28Å; F62-Y66 AromaticContact CE1-CD1 3.75Å; F62-Y66 HydrophobicContact CE1-CD1 3.75Å; F62-Y66 HydrophobicContact CE1-CE1 4.24Å; F62-Y66 AromaticContact CE2-CD1 3.66Å; F62-Y66 HydrophobicContact CE2-CD1 3.66Å; F62-Y66 HydrophobicContact CE2-CD2 4.4Å; F62-Y66 HydrophobicContact CE2-CE1 4.14Å; F62-Y66 AromaticContact CE2-CG 3.8Å; F62-Y66 HydrophobicContact CE2-CG 3.8Å; F62-Y66 AromaticContact CZ-CD1 3.31Å; F62-Y66 HydrophobicContact CZ-CD1 3.31Å; F62-Y66 AromaticContact CZ-CE1 3.58Å; F62-Y66 HydrophobicContact CZ-CE1 3.58Å; F62-Y66 AromaticContact CZ-CG 3.96Å; F62-Y66 HydrophobicContact CZ-CG 3.96Å; F62-Y66 WeakPolarHBondContact O-CA 3.41Å; F62-Y66 WeakPolarHBondContact O-CB 3.22Å; F62-Y66 PolarHBondContact O-N 3.06Å; F62-L67 PolarHBondContact O-N 3.36Å
63	R	81.1	Confident	79	Confident	177 Å²	177	113.8 Å²	113.8	67%	0.668	51%	0.512	S	S	*	.	I	π-helix	trans	-62.7	-45.7	176.9	-171.1	-175.5	171.5	100.5	-2.4	112.1	R59 R60 R61 L67	R59-R63 VanDerWaalsContact O-CB 3.26Å; R59-R63 WeakPolarHBondContact O-CB 3.35Å; R59-R63 PolarHBondContact O-N 2.96Å; R60-R63 PolarHBondContact O-N 2.89Å; R61-R63 VanDerWaalsContact C-N 3.32Å; R61-R63 PolarHBondContact O-N 2.98Å; R63-L67 HydrophobicContact CG-CD1 3.83Å; R63-L67 VanDerWaalsContact O-CB 3.27Å; R63-L67 WeakPolarHBondContact O-CB 3.15Å
64	T	83.8	Confident	77.5	Confident	86 Å²	86	109.2 Å²	109.2	53%	0.528	51%	0.505	S	S	.	.	I	π-helix	trans	-76	-43.6	-174.4	50.6	0	0	0	0	112.8	R60 R61 F62	R60-T64 WeakPolarHBondContact O-CG2 3.31Å; R60-T64 PolarHBondContact O-N 2.83Å; R60-T64 PolarHBondContact O-OG1 3.11Å; R60-T64 VanDerWaalsContact O-OG1 3.05Å; R61-T64 WeakPolarHBondContact CA-OG1 3.48Å; R61-T64 PolarHBondContact O-N 3.07Å; R61-T64 PolarHBondContact O-OG1 3.26Å; F62-T64 PolarHBondContact O-N 2.9Å
65	E	85.6	Confident	75.9	Confident	111 Å²	111	113.4 Å²	113.4	52%	0.519	53%	0.528	S	S	.	.	I	π-helix	trans	-86.2	-50.2	-173.1	-61.9	171.9	-145.6	0	0	110.8	R61 Q69	R61-E65 WeakPolarHBondContact CG-OE1 3.25Å; R61-E65 VanDerWaalsContact O-CB 3.25Å; R61-E65 WeakPolarHBondContact O-CB 3.49Å; R61-E65 WeakPolarHBondContact O-CG 3.46Å; R61-E65 PolarHBondContact O-N 3.18Å; E65-Q69 WeakPolarHBondContact O-CG 3.49Å; E65-Q69 PolarHBondContact O-N 2.97Å; E65-Q69 VanDerWaalsContact O-N 3.16Å
66	Y	75.7	Confident	74.5	Confident	73 Å²	73	116.7 Å²	116.7	29%	0.286	54%	0.538	S	S	.	.	I	π-helix	trans	-76.5	-47.7	-175.4	177.3	-100.4	0	0	0	112.7	L6 F62 G68 Q69 I70	L6-Y66 HydrophobicContact CD2-CE2 4.48Å; F62-Y66 HydrophobicContact CD1-CD1 4.44Å; F62-Y66 HydrophobicContact CD2-CD1 4.37Å; F62-Y66 HydrophobicContact CD2-CG 4.28Å; F62-Y66 AromaticContact CE1-CD1 3.75Å; F62-Y66 HydrophobicContact CE1-CD1 3.75Å; F62-Y66 HydrophobicContact CE1-CE1 4.24Å; F62-Y66 AromaticContact CE2-CD1 3.66Å; F62-Y66 HydrophobicContact CE2-CD1 3.66Å; F62-Y66 HydrophobicContact CE2-CD2 4.4Å; F62-Y66 HydrophobicContact CE2-CE1 4.14Å; F62-Y66 AromaticContact CE2-CG 3.8Å; F62-Y66 HydrophobicContact CE2-CG 3.8Å; F62-Y66 AromaticContact CZ-CD1 3.31Å; F62-Y66 HydrophobicContact CZ-CD1 3.31Å; F62-Y66 AromaticContact CZ-CE1 3.58Å; F62-Y66 HydrophobicContact CZ-CE1 3.58Å; F62-Y66 AromaticContact CZ-CG 3.96Å; F62-Y66 HydrophobicContact CZ-CG 3.96Å; F62-Y66 WeakPolarHBondContact O-CA 3.41Å; F62-Y66 WeakPolarHBondContact O-CB 3.22Å; F62-Y66 PolarHBondContact O-N 3.06Å; Y66-G68 VanDerWaalsContact C-N 3.3Å; Y66-G68 PolarHBondContact O-N 3.17Å; Y66-Q69 PolarHBondContact O-N 3.25Å; Y66-I70 HydrophobicContact CD1-CD1 3.78Å; Y66-I70 HydrophobicContact CE1-CD1 3.26Å; Y66-I70 HydrophobicContact CE1-CG1 4.32Å; Y66-I70 HydrophobicContact CE2-CD1 4.39Å; Y66-I70 WeakPolarHBondContact O-CG1 3.41Å; Y66-I70 PolarHBondContact O-N 2.78Å
67	L	73.9	Confident	72.9	Confident	69 Å²	69	113.7 Å²	113.7	36%	0.361	55%	0.547	S	S	.	.	H	α-helix	trans	-68.8	-32.2	177.2	-57.2	-179.7	0	0	0	112	F62 R63 Q69 I70 L71	F62-L67 PolarHBondContact O-N 3.36Å; R63-L67 HydrophobicContact CG-CD1 3.83Å; R63-L67 VanDerWaalsContact O-CB 3.27Å; R63-L67 WeakPolarHBondContact O-CB 3.15Å; L67-Q69 VanDerWaalsContact C-N 3.31Å; L67-Q69 PolarHBondContact O-N 3.38Å; L67-I70 HydrophobicContact CD2-CD1 4.09Å; L67-I70 PolarHBondContact O-N 3.37Å; L67-L71 WeakPolarHBondContact O-CG 3.38Å; L67-L71 PolarHBondContact O-N 3.24Å
68	G	74	Confident	71.3	Confident	21 Å²	21	117.5 Å²	117.5	22%	0.216	56%	0.557	C	S	.	*	H	α-helix	trans	-57.7	-44.9	172.5	0	0	0	0	0	111.6	Y66 L71 Q72	Y66-G68 VanDerWaalsContact C-N 3.3Å; Y66-G68 PolarHBondContact O-N 3.17Å; G68-L71 PolarHBondContact O-N 3.05Å; G68-Q72 WeakPolarHBondContact O-CB 3.2Å; G68-Q72 VanDerWaalsContact O-CG 3.28Å; G68-Q72 WeakPolarHBondContact O-CG 3.27Å; G68-Q72 PolarHBondContact O-N 2.79Å; G68-Q72 VanDerWaalsContact O-N 3.09Å
69	Q	73	Confident	69.9	Low	128 Å²	128	121.4 Å²	121.4	60%	0.598	57%	0.566	S	S	*	*	H	α-helix	trans	-65.3	-37.3	175.1	-72.5	170.4	18.8	0	0	113.1	E65 Y66 L67 Q72 R73	E65-Q69 WeakPolarHBondContact O-CG 3.49Å; E65-Q69 PolarHBondContact O-N 2.97Å; E65-Q69 VanDerWaalsContact O-N 3.16Å; Y66-Q69 PolarHBondContact O-N 3.25Å; L67-Q69 VanDerWaalsContact C-N 3.31Å; L67-Q69 PolarHBondContact O-N 3.38Å; Q69-Q72 PolarHBondContact O-N 2.89Å; Q69-R73 PolarHBondContact O-N 3.34Å
70	I	70.1	Confident	68.8	Low	73 Å²	73	116.2 Å²	116.2	37%	0.374	55%	0.552	S	S	.	*	H	α-helix	trans	-62.9	-46.4	177	-70.9	171.5	0	0	0	110.9	Y66 L67 Q72 R73	Y66-I70 HydrophobicContact CD1-CD1 3.78Å; Y66-I70 HydrophobicContact CE1-CD1 3.26Å; Y66-I70 HydrophobicContact CE1-CG1 4.32Å; Y66-I70 HydrophobicContact CE2-CD1 4.39Å; Y66-I70 WeakPolarHBondContact O-CG1 3.41Å; Y66-I70 PolarHBondContact O-N 2.78Å; L67-I70 HydrophobicContact CD2-CD1 4.09Å; L67-I70 PolarHBondContact O-N 3.37Å; I70-Q72 VanDerWaalsContact C-N 3.33Å; I70-R73 PolarHBondContact O-N 3.17Å
71	L	64.1	Low	67.6	Low	150 Å²	150	111.7 Å²	111.7	79%	0.785	55%	0.55	S	S	*	.	H	α-helix	trans	-68.1	-33.4	-179	-71	169.9	0	0	0	112.4	L67 G68 R73	L67-L71 WeakPolarHBondContact O-CG 3.38Å; L67-L71 PolarHBondContact O-N 3.24Å; G68-L71 PolarHBondContact O-N 3.05Å; L71-R73 PolarHBondContact O-N 2.99Å
72	Q	59.8	Low	67.2	Low	156 Å²	156	105.6 Å²	105.6	73%	0.729	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-7.5	178.6	-74.2	179.5	22.4	0	0	113.9	G68 Q69 I70 P74	G68-Q72 WeakPolarHBondContact O-CB 3.2Å; G68-Q72 VanDerWaalsContact O-CG 3.28Å; G68-Q72 WeakPolarHBondContact O-CG 3.27Å; G68-Q72 PolarHBondContact O-N 2.79Å; G68-Q72 VanDerWaalsContact O-N 3.09Å; Q69-Q72 PolarHBondContact O-N 2.89Å; I70-Q72 VanDerWaalsContact C-N 3.33Å; Q72-P74 WeakPolarHBondContact O-CD 3.3Å; Q72-P74 VanDerWaalsContact O-N 3.16Å
73	R	62	Low	67.3	Low	172 Å²	172	103 Å²	103	65%	0.649	53%	0.528	S	S	*	.	S	Bend	trans	-75.6	105.3	176	-154.3	172.3	-167.8	-139.2	3.1	107.3	Q69 I70 L71 N75	Q69-R73 PolarHBondContact O-N 3.34Å; I70-R73 PolarHBondContact O-N 3.17Å; L71-R73 PolarHBondContact O-N 2.99Å; R73-N75 PolarHBondContact O-N 3.2Å; R73-N75 VanDerWaalsContact O-N 3.17Å
74	P	55.3	Low	67.6	Low	86 Å²	86	96.8 Å²	96.8	56%	0.558	51%	0.514	S	S	*	.			trans	-56.1	131.9	171.5	26.1	-33.3	0	0	0	105.9	Q72 R76	Q72-P74 WeakPolarHBondContact O-CD 3.3Å; Q72-P74 VanDerWaalsContact O-N 3.16Å; P74-R76 HydrophobicContact CG-CG 4.28Å; P74-R76 WeakPolarHBondContact O-CG 3.49Å; P74-R76 PolarHBondContact O-N 3.23Å
75	N	55.1	Low	67.9	Low	167 Å²	167	97 Å²	97	89%	0.893	52%	0.516	S	S	*	.			trans	-58.6	86.7	173.8	-168.2	14.4	0	0	0	106.6	R73 G77	R73-N75 PolarHBondContact O-N 3.2Å; R73-N75 VanDerWaalsContact O-N 3.17Å; N75-G77 VanDerWaalsContact C-N 3.25Å; N75-G77 PolarHBondContact O-N 3.15Å
76	R	53.7	Low	68	Low	117 Å²	117	92.9 Å²	92.9	44%	0.442	50%	0.503	S	S	.	.			trans	-69.9	97.4	-177.5	-73.6	-169	177	-176.2	-3.9	103.1	P74 K78	P74-R76 HydrophobicContact CG-CG 4.28Å; P74-R76 WeakPolarHBondContact O-CG 3.49Å; P74-R76 PolarHBondContact O-N 3.23Å; R76-K78 HydrophobicContact CB-CG 4.27Å; R76-K78 PolarHBondContact O-N 2.98Å
77	G	51.7	Low	68.6	Low	79 Å²	79	91.4 Å²	91.4	81%	0.814	50%	0.5	S	S	*	.			trans	-61.1	23.3	171.9	0	0	0	0	0	113.5	N75 R79	N75-G77 VanDerWaalsContact C-N 3.25Å; N75-G77 PolarHBondContact O-N 3.15Å; G77-R79 PolarHBondContact O-N 2.73Å
78	K	55.2	Low	69.3	Low	143 Å²	143	88.7 Å²	88.7	62%	0.622	49%	0.486	S	S	*	.			trans	-62.9	129.9	161.4	-63.4	-172.4	178.1	-166.6	0	106	R76	R76-K78 HydrophobicContact CB-CG 4.27Å; R76-K78 PolarHBondContact O-N 2.98Å
79	R	56.7	Low	69.9	Low	161 Å²	161	87.7 Å²	87.7	61%	0.608	48%	0.476	S	S	*	.			trans	-47.3	153.8	164.6	-66.5	-175	177	-162.5	1.5	108.3	G77 S81	G77-R79 PolarHBondContact O-N 2.73Å; R79-S81 PolarHBondContact O-N 3.21Å
80	P	59.4	Low	70.5	Confident	45 Å²	45	81.9 Å²	81.9	29%	0.292	45%	0.449	S	S	.	.	S	Bend	trans	-64	69.4	171	29.4	-36.6	0	0	0	109.8	G82 I83 L129	P80-G82 PolarHBondContact O-N 3.06Å; P80-I83 HydrophobicContact CB-CD1 3.97Å; P80-I83 HydrophobicContact CB-CG1 4.43Å; P80-L129 HydrophobicContact CB-CB 4.34Å; P80-L129 HydrophobicContact CG-CB 3.55Å
81	S	61.1	Low	70.9	Confident	95 Å²	95	78.7 Å²	78.7	66%	0.664	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	33.9	-170.2	68.8	0	0	0	0	111.1	R79	R79-S81 PolarHBondContact O-N 3.21Å
82	G	77.9	Confident	71.1	Confident	40 Å²	40	74.8 Å²	74.8	41%	0.412	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152.1	10.4	-174.3	0	0	0	0	0	114.1	P80	P80-G82 PolarHBondContact O-N 3.06Å
83	I	84.1	Confident	71.4	Confident	14 Å²	14	70.2 Å²	70.2	7%	0.072	39%	0.393	C	S	.	.			trans	-85.9	114.6	174.5	-60.8	177.8	0	0	0	107.6	P80 D87 V89 V102 L105 L129 L132 P134	P80-I83 HydrophobicContact CB-CD1 3.97Å; P80-I83 HydrophobicContact CB-CG1 4.43Å; I83-D87 WeakPolarHBondContact CA-OD2 3.09Å; I83-V89 HydrophobicContact CD1-CG1 4.49Å; I83-V89 HydrophobicContact CG2-CG1 4.15Å; I83-V102 HydrophobicContact CG2-CB 4.49Å; I83-V102 HydrophobicContact CG2-CG1 4.43Å; I83-V102 HydrophobicContact CG2-CG2 3.62Å; I83-L105 WeakPolarHBondContact O-CD1 3.5Å; I83-L129 HydrophobicContact CB-CD2 4.42Å; I83-L129 HydrophobicContact CD1-CD2 4.19Å; I83-L129 HydrophobicContact CG2-CD2 4.37Å; I83-L132 HydrophobicContact CD1-CB 3.76Å; I83-P134 HydrophobicContact CG1-CG 4.41Å
84	A	87.3	Confident	71.4	Confident	46 Å²	46	71.8 Å²	71.8	38%	0.38	40%	0.399	S	S	.	.			trans	-101.1	164.4	175.9	0	0	0	0	0	111.7	G86 D87 V102	A84-G86 PolarHBondContact O-N 3.25Å; A84-D87 PolarHBondContact N-OD2 2.59Å; A84-D87 WeakPolarHBondContact O-CB 3.31Å; A84-D87 PolarHBondContact O-N 3.35Å; A84-V102 WeakPolarHBondContact O-CB 3.46Å
85	V	89.9	Confident	71.9	Confident	91 Å²	91	74.1 Å²	74.1	55%	0.552	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	131.1	167.6	177.2	0	0	0	0	108.5	E103 L105	V85-E103 VanDerWaalsContact CG1-O 3.29Å; V85-E103 WeakPolarHBondContact CG1-O 3.41Å; V85-L105 HydrophobicContact CG2-CD1 4.34Å; V85-L105 HydrophobicContact CG2-CG 4.09Å
86	G	87.8	Confident	72.6	Confident	24 Å²	24	74 Å²	74	25%	0.247	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	100.8	-18.5	-176	0	0	0	0	0	114.2	A84 R101 V102	A84-G86 PolarHBondContact O-N 3.25Å; G86-R101 WeakPolarHBondContact O-CG 2.84Å; G86-R101 PolarHBondContact O-NE 3.45Å; G86-V102 PolarHBondContact N-O 2.96Å
87	D	88.2	Confident	73.6	Confident	43 Å²	43	71 Å²	71	23%	0.23	39%	0.387	C	S	.	.			trans	-66.8	144.2	-179.3	-71.2	-3.7	0	0	0	112	I83 A84 R101 V102	I83-D87 WeakPolarHBondContact CA-OD2 3.09Å; A84-D87 PolarHBondContact N-OD2 2.59Å; A84-D87 WeakPolarHBondContact O-CB 3.31Å; A84-D87 PolarHBondContact O-N 3.35Å; D87-R101 WeakPolarHBondContact O-CA 3.26Å; D87-V102 PolarHBondContact O-N 2.8Å
88	V	88.4	Confident	75	Confident	11 Å²	11	69 Å²	69	7%	0.067	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	125.2	171.1	-173.7	0	0	0	0	109.8	Y8 L16 L99 L135	Y8-V88 HydrophobicContact CD1-CB 3.98Å; Y8-V88 HydrophobicContact CD1-CG1 3.87Å; Y8-V88 HydrophobicContact CD1-CG2 4.04Å; Y8-V88 HydrophobicContact CE1-CB 3.65Å; Y8-V88 HydrophobicContact CE1-CG1 4.09Å; Y8-V88 HydrophobicContact CE1-CG2 3.49Å; Y8-V88 VanDerWaalsContact CE1-CG2 3.49Å; Y8-V88 HydrophobicContact CE2-CG2 4.38Å; L16-V88 HydrophobicContact CD2-CB 4.37Å; L16-V88 HydrophobicContact CD2-CG1 3.43Å; L16-V88 VanDerWaalsContact CD2-CG1 3.43Å; L16-V88 HydrophobicContact CD2-CG2 4Å; V88-L99 HydrophobicContact CG1-CB 4.46Å; V88-L135 HydrophobicContact CG1-CD1 3.86Å; V88-L135 PolarHBondContact O-N 3.44Å
89	V	87.8	Confident	76.6	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	150.6	-175.5	-63.4	0	0	0	0	111.3	I83 A100 V102 V118 L132 Y133	I83-V89 HydrophobicContact CD1-CG1 4.49Å; I83-V89 HydrophobicContact CG2-CG1 4.15Å; V89-A100 HydrophobicContact CG2-CB 4.41Å; V89-A100 VanDerWaalsContact CG2-O 3.3Å; V89-A100 WeakPolarHBondContact CG2-O 3.47Å; V89-A100 PolarHBondContact N-O 3.37Å; V89-A100 PolarHBondContact O-N 3.25Å; V89-V102 HydrophobicContact CG1-CG2 3.75Å; V89-V102 HydrophobicContact CG2-CG2 3.92Å; V89-V118 HydrophobicContact CG2-CG1 3.89Å; V89-L132 HydrophobicContact CB-CB 4.25Å; V89-L132 HydrophobicContact CB-CD2 4.42Å; V89-L132 HydrophobicContact CG1-CB 4.4Å; V89-L132 HydrophobicContact CG2-CB 4.47Å; V89-L132 HydrophobicContact CG2-CD1 4.32Å; V89-L132 HydrophobicContact CG2-CD2 3.88Å; V89-L132 HydrophobicContact CG2-CG 4.45Å; V89-Y133 CarbonylContact C-O 3.59Å; V89-Y133 WeakPolarHBondContact CA-O 3.25Å
90	H	85	Confident	78.1	Confident	7 Å²	7	55 Å²	55	3%	0.032	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	134.2	166.8	-63.4	106.9	0	0	0	111.5	P5 W97 L99 Y133 L135	P5-H90 WeakPolarHBondContact CB-NE2 3.31Å; P5-H90 VanDerWaalsContact CD-NE2 3.29Å; P5-H90 WeakPolarHBondContact CD-NE2 3.37Å; P5-H90 WeakPolarHBondContact CG-NE2 3.46Å; H90-W97 HydrophobicContact CB-CE3 4.42Å; H90-L99 WeakPolarHBondContact CD2-CD2 3.37Å; H90-Y133 PolarHBondContact N-O 2.93Å; H90-Y133 PolarHBondContact O-N 2.83Å; H90-L135 WeakPolarHBondContact CE1-CD2 3.3Å; H90-L135 WeakPolarHBondContact CE1-CG 3.47Å
91	N	77.4	Confident	79.6	Confident	6 Å²	6	56.4 Å²	56.4	3%	0.032	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	130.1	171.6	-170.8	0.6	0	0	0	110	T93 P98 L125 R127	N91-T93 PolarHBondContact O-N 3.22Å; N91-P98 HydrophobicContact CB-CG 4.16Å; N91-P98 PolarHBondContact N-O 2.8Å; N91-P98 VanDerWaalsContact N-O 3.15Å; N91-L125 WeakPolarHBondContact ND2-CD1 3.3Å; N91-R127 PolarHBondContact OD1-NE 3.24Å
92	Q	69.3	Low	81.1	Confident	67 Å²	67	52 Å²	52	31%	0.313	27%	0.272	S	S	.	.			trans	-66.8	11.4	-161.9	-153.9	179.8	20.4	0	0	117	R94 R131 Y133	Q92-R94 PolarHBondContact O-N 3.45Å; Q92-R131 HydrophobicContact CB-CB 4.45Å; Q92-R131 VanDerWaalsContact OE1-CG 3.29Å; Q92-Y133 HydrophobicContact CG-CE2 4.15Å; Q92-Y133 PolarHBondContact NE2-OH 3.49Å
93	T	66.1	Low	81.7	Confident	61 Å²	61	53.6 Å²	53.6	37%	0.374	27%	0.268	S	S	.	.			trans	-67.1	100.3	175.3	52.4	0	0	0	0	108.7	N91 L95 F96 W97 P98	N91-T93 PolarHBondContact O-N 3.22Å; T93-L95 PolarHBondContact O-N 2.93Å; T93-F96 PolarHBondContact O-N 2.95Å; T93-F96 VanDerWaalsContact O-N 3.08Å; T93-W97 PolarHBondContact O-N 3.49Å; T93-W97 VanDerWaalsContact O-N 3.14Å; T93-P98 WeakPolarHBondContact OG1-CD 3.37Å
94	R	62	Low	82.1	Confident	204 Å²	204	58.7 Å²	58.7	77%	0.77	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-21.6	-169.5	-69.6	179.8	178.1	-101.9	2.8	114.6	Q92 W97	Q92-R94 PolarHBondContact O-N 3.45Å; R94-W97 PolarHBondContact O-NE1 3.28Å
95	L	66.6	Low	82.4	Confident	136 Å²	136	58.9 Å²	58.9	71%	0.712	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-37.7	-176.4	-64.1	175.5	0	0	0	113.3	T93	T93-L95 PolarHBondContact O-N 2.93Å
96	F	68.8	Low	82.5	Confident	164 Å²	164	57.2 Å²	57.2	72%	0.719	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.7	-21	-166.1	-61.4	-71.5	0	0	0	114.1	T93 P98	T93-F96 PolarHBondContact O-N 2.95Å; T93-F96 VanDerWaalsContact O-N 3.08Å; F96-P98 VanDerWaalsContact C-CD 3.46Å; F96-P98 VanDerWaalsContact C-N 3.3Å
97	W	75.9	Confident	82.7	Confident	54 Å²	54	59.7 Å²	59.7	21%	0.205	28%	0.28	C	S	.	.			trans	44.2	48.7	-177.1	-57.7	99.1	0	0	0	114	P5 H90 T93 R94 L99	P5-W97 HydrophobicContact CG-CB 4.1Å; H90-W97 HydrophobicContact CB-CE3 4.42Å; T93-W97 PolarHBondContact O-N 3.49Å; T93-W97 VanDerWaalsContact O-N 3.14Å; R94-W97 PolarHBondContact O-NE1 3.28Å; W97-L99 PolarHBondContact O-N 2.88Å
98	P	80.7	Confident	82.7	Confident	38 Å²	38	58.9 Å²	58.9	25%	0.247	28%	0.282	C	S	.	.			trans	-62.4	132.9	-177.9	25.3	-28.7	0	0	0	109.3	N91 T93 F96 T120	N91-P98 HydrophobicContact CB-CG 4.16Å; N91-P98 PolarHBondContact N-O 2.8Å; N91-P98 VanDerWaalsContact N-O 3.15Å; T93-P98 WeakPolarHBondContact OG1-CD 3.37Å; F96-P98 VanDerWaalsContact C-CD 3.46Å; F96-P98 VanDerWaalsContact C-N 3.3Å; P98-T120 HydrophobicContact CB-CG2 4.24Å
99	L	88.3	Confident	82.8	Confident	8 Å²	8	68.5 Å²	68.5	4%	0.042	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	142.7	173.4	-61.4	-169.5	0	0	0	109.5	P5 L16 P18 V88 H90 W97 L135	P5-L99 HydrophobicContact CB-CD2 4.15Å; P5-L99 HydrophobicContact CG-CD2 3.89Å; L16-L99 HydrophobicContact CB-CB 3.73Å; L16-L99 HydrophobicContact CB-CD1 4.11Å; L16-L99 HydrophobicContact CD2-CB 3.89Å; L16-L99 HydrophobicContact CG-CB 4.48Å; P18-L99 HydrophobicContact CB-CD1 3.84Å; P18-L99 HydrophobicContact CB-CG 4.16Å; V88-L99 HydrophobicContact CG1-CB 4.46Å; H90-L99 WeakPolarHBondContact CD2-CD2 3.37Å; W97-L99 PolarHBondContact O-N 2.88Å; L99-L135 HydrophobicContact CD1-CD1 4.16Å; L99-L135 HydrophobicContact CD2-CD1 3.47Å; L99-L135 VanDerWaalsContact CD2-CD1 3.47Å; L99-L135 HydrophobicContact CG-CD1 4.44Å
100	A	89.1	Confident	82.9	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	149.6	175.2	0	0	0	0	0	110.2	V89 V118 R119	V89-A100 HydrophobicContact CG2-CB 4.41Å; V89-A100 VanDerWaalsContact CG2-O 3.3Å; V89-A100 WeakPolarHBondContact CG2-O 3.47Å; V89-A100 PolarHBondContact N-O 3.37Å; V89-A100 PolarHBondContact O-N 3.25Å; A100-V118 HydrophobicContact CB-CB 3.73Å; A100-V118 HydrophobicContact CB-CG2 3.96Å; A100-R119 CarbonylContact C-O 3.57Å; A100-R119 WeakPolarHBondContact CA-O 3.4Å; A100-R119 WeakPolarHBondContact CB-O 3.42Å
101	R	90.4	Very high	83	Confident	76 Å²	76	74.9 Å²	74.9	29%	0.287	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	136	175.3	-167.8	170.2	-176.7	179.7	-5.8	110	G86 D87 E103 V118 R119	G86-R101 WeakPolarHBondContact O-CG 2.84Å; G86-R101 PolarHBondContact O-NE 3.45Å; D87-R101 WeakPolarHBondContact O-CA 3.26Å; R101-E103 PolarHBondContact O-N 3.43Å; R101-V118 CarbonylContact O-C 3.58Å; R101-V118 WeakPolarHBondContact O-CA 3.45Å; R101-R119 PolarHBondContact N-O 3.25Å; R101-R119 PolarHBondContact O-N 3.01Å
102	V	91.2	Very high	83.5	Confident	2 Å²	2	78.5 Å²	78.5	1%	0.012	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	120.2	177.7	179.1	0	0	0	0	109.2	I83 A84 G86 D87 V89 L105 A116 V118	I83-V102 HydrophobicContact CG2-CB 4.49Å; I83-V102 HydrophobicContact CG2-CG1 4.43Å; I83-V102 HydrophobicContact CG2-CG2 3.62Å; A84-V102 WeakPolarHBondContact O-CB 3.46Å; G86-V102 PolarHBondContact N-O 2.96Å; D87-V102 PolarHBondContact O-N 2.8Å; V89-V102 HydrophobicContact CG1-CG2 3.75Å; V89-V102 HydrophobicContact CG2-CG2 3.92Å; V102-L105 HydrophobicContact CG1-CD2 3.83Å; V102-L105 HydrophobicContact CG1-CG 4.29Å; V102-A116 HydrophobicContact CG1-CB 4.16Å; V102-V118 HydrophobicContact CG2-CG1 4.19Å
103	E	91.7	Very high	84.4	Confident	74 Å²	74	77.3 Å²	77.3	35%	0.346	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	-40.1	-177.3	-173.7	177.3	166.3	0	0	112.1	V85 R101 M117 Q124	V85-E103 VanDerWaalsContact CG1-O 3.29Å; V85-E103 WeakPolarHBondContact CG1-O 3.41Å; R101-E103 PolarHBondContact O-N 3.43Å; E103-M117 HydrophobicContact CB-CE 4.46Å; E103-M117 HydrophobicContact CB-CG 4.49Å; E103-M117 HydrophobicContact CG-CE 4.15Å; E103-M117 PolarHBondContact N-O 3.11Å; E103-Q124 PolarHBondContact OE1-NE2 3.44Å; E103-Q124 PolarHBondContact OE2-NE2 3Å
104	R	93	Very high	85.5	Confident	120 Å²	120	80.8 Å²	80.8	45%	0.453	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	151.1	173.6	60.3	172.2	-171.1	-133.8	3.5	111.3	A116 M117	R104-A116 CarbonylContact O-C 3.55Å; R104-A116 WeakPolarHBondContact O-CA 3.42Å; R104-M117 HydrophobicContact CB-CB 4.44Å; R104-M117 HydrophobicContact CG-CB 3.25Å; R104-M117 HydrophobicContact CG-CE 3.78Å; R104-M117 HydrophobicContact CG-CG 4.23Å; R104-M117 HydrophobicContact CG-SD 4.38Å; R104-M117 PolarHBondContact NH1-SD 3.4Å; R104-M117 PolarHBondContact NH2-SD 2.95Å; R104-M117 PolarHBondContact O-N 2.87Å
105	L	93.2	Very high	87	Confident	50 Å²	50	74.2 Å²	74.2	26%	0.262	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	131.4	170.6	-63.3	175.1	0	0	0	108.8	I83 V85 V102 P113 A116 L129	I83-L105 WeakPolarHBondContact O-CD1 3.5Å; V85-L105 HydrophobicContact CG2-CD1 4.34Å; V85-L105 HydrophobicContact CG2-CG 4.09Å; V102-L105 HydrophobicContact CG1-CD2 3.83Å; V102-L105 HydrophobicContact CG1-CG 4.29Å; L105-P113 HydrophobicContact CB-CB 4.08Å; L105-A116 HydrophobicContact CD2-CB 3.87Å; L105-L129 HydrophobicContact CD2-CD2 3.91Å
106	I	92	Very high	88.2	Confident	56 Å²	56	67.8 Å²	67.8	29%	0.287	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	113.9	-178.6	-58.9	172.2	0	0	0	108	R114 I115 M126	I106-R114 PolarHBondContact O-N 3.48Å; I106-R114 VanDerWaalsContact O-N 3.13Å; I106-I115 HydrophobicContact CB-CB 4.24Å; I106-I115 HydrophobicContact CD1-CG2 4.28Å; I106-I115 PolarHBondContact N-O 3.28Å; I106-I115 PolarHBondContact O-N 2.91Å; I106-M126 HydrophobicContact CD1-SD 3.54Å; I106-M126 VanDerWaalsContact CD1-SD 3.54Å
107	P	91.6	Very high	89.4	Confident	76 Å²	76	60.4 Å²	60.4	49%	0.494	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	149.5	175.9	30.1	-33.5	0	0	0	111.8	G111 E112	P107-G111 WeakPolarHBondContact CB-O 3.26Å; P107-E112 CarbonylContact C-O 3.59Å; P107-E112 WeakPolarHBondContact CA-O 3.4Å
108	G	88.4	Confident	90.2	Very high	26 Å²	26	57.9 Å²	57.9	27%	0.268	30%	0.299	S	S	.	.			trans	-77.9	-174	167.4	0	0	0	0	0	112.3	D110 G111 E112	G108-D110 PolarHBondContact O-N 3.23Å; G108-G111 PolarHBondContact O-N 2.9Å; G108-G111 VanDerWaalsContact O-N 3.07Å; G108-E112 PolarHBondContact N-O 3.42Å
109	Q	89.4	Confident	90.6	Very high	213 Å²	213	61.3 Å²	61.3	100%	0.995	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-23.8	174.3	-68.3	-179	-13.2	0	0	113.1	G111	Q109-G111 VanDerWaalsContact C-N 3.34Å
110	D	89.9	Confident	90.6	Very high	87 Å²	87	61.8 Å²	61.8	47%	0.465	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	2.6	177.7	56	-24.1	0	0	0	113.9	G108 E112 R114	G108-D110 PolarHBondContact O-N 3.23Å; D110-E112 PolarHBondContact O-N 3.12Å; D110-R114 VanDerWaalsContact CG-NH2 3.26Å; D110-R114 IonicContact OD1-CZ 3.4Å; D110-R114 IonicContact OD1-NE 2.9Å; D110-R114 PolarHBondContact OD1-NE 3.37Å; D110-R114 IonicContact OD1-NH2 3.32Å; D110-R114 PolarHBondContact OD1-NH2 3.45Å; D110-R114 IonicContact OD2-CZ 3.11Å; D110-R114 IonicContact OD2-NE 3.54Å; D110-R114 IonicContact OD2-NH2 2.69Å; D110-R114 PolarHBondContact OD2-NH2 2.91Å
111	G	87.5	Confident	90.3	Very high	55 Å²	55	65.1 Å²	65.1	57%	0.567	34%	0.338	S	S	*	.	S	Bend	trans	79.4	-9.3	-177.3	0	0	0	0	0	114.8	P107 G108 Q109	P107-G111 WeakPolarHBondContact CB-O 3.26Å; G108-G111 PolarHBondContact O-N 2.9Å; G108-G111 VanDerWaalsContact O-N 3.07Å; Q109-G111 VanDerWaalsContact C-N 3.34Å
112	E	87.8	Confident	90	Very high	81 Å²	81	67.3 Å²	67.3	38%	0.379	36%	0.36	S	S	.	.			trans	-82.1	131.9	-179.8	-175.5	64.3	-161.1	0	0	111	P107 G108 D110 R114	P107-E112 CarbonylContact C-O 3.59Å; P107-E112 WeakPolarHBondContact CA-O 3.4Å; G108-E112 PolarHBondContact N-O 3.42Å; D110-E112 PolarHBondContact O-N 3.12Å; E112-R114 PolarHBondContact O-N 3.42Å
113	P	89.2	Confident	89.8	Confident	42 Å²	42	70.5 Å²	70.5	27%	0.273	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	125.6	175.4	28.1	-36.4	0	0	0	111	L105 L129	L105-P113 HydrophobicContact CB-CB 4.08Å; P113-L129 HydrophobicContact CB-CD1 4.11Å; P113-L129 HydrophobicContact CG-CD1 4.41Å; P113-L129 WeakPolarHBondContact O-CD1 3.15Å
114	R	89.7	Confident	89.8	Confident	134 Å²	134	71.8 Å²	71.8	51%	0.506	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	-26.2	178.4	-66.9	-178.7	-175.5	-167.7	-2	113.1	I106 D110 E112 P128 L129	I106-R114 PolarHBondContact O-N 3.48Å; I106-R114 VanDerWaalsContact O-N 3.13Å; D110-R114 VanDerWaalsContact CG-NH2 3.26Å; D110-R114 IonicContact OD1-CZ 3.4Å; D110-R114 IonicContact OD1-NE 2.9Å; D110-R114 PolarHBondContact OD1-NE 3.37Å; D110-R114 IonicContact OD1-NH2 3.32Å; D110-R114 PolarHBondContact OD1-NH2 3.45Å; D110-R114 IonicContact OD2-CZ 3.11Å; D110-R114 IonicContact OD2-NE 3.54Å; D110-R114 IonicContact OD2-NH2 2.69Å; D110-R114 PolarHBondContact OD2-NH2 2.91Å; E112-R114 PolarHBondContact O-N 3.42Å; R114-P128 CarbonylContact O-C 3.6Å; R114-P128 WeakPolarHBondContact O-CA 3.37Å; R114-L129 PolarHBondContact O-N 3.4Å
115	I	92	Very high	89.7	Confident	67 Å²	67	68.5 Å²	68.5	34%	0.344	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	137.8	-178.9	-58.9	172.5	0	0	0	107.9	I106 M126	I106-I115 HydrophobicContact CB-CB 4.24Å; I106-I115 HydrophobicContact CD1-CG2 4.28Å; I106-I115 PolarHBondContact N-O 3.28Å; I106-I115 PolarHBondContact O-N 2.91Å; I115-M126 HydrophobicContact CG2-CB 4.14Å; I115-M126 HydrophobicContact CG2-SD 4.05Å
116	A	92.9	Very high	89.6	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	142.1	167.9	0	0	0	0	0	110.1	V102 R104 L105 V118 R127 L129 L132	V102-A116 HydrophobicContact CG1-CB 4.16Å; R104-A116 CarbonylContact O-C 3.55Å; R104-A116 WeakPolarHBondContact O-CA 3.42Å; L105-A116 HydrophobicContact CD2-CB 3.87Å; A116-V118 HydrophobicContact CB-CG1 4.14Å; A116-R127 PolarHBondContact N-O 2.9Å; A116-R127 PolarHBondContact O-N 3.48Å; A116-L129 HydrophobicContact CB-CD2 3.69Å; A116-L132 HydrophobicContact CB-CD1 3.6Å
117	M	93.7	Very high	89.6	Confident	10 Å²	10	70.7 Å²	70.7	5%	0.049	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	123.2	156.5	-170.6	145.8	77.6	0	0	108.2	E103 R104 Q124 M126	E103-M117 HydrophobicContact CB-CE 4.46Å; E103-M117 HydrophobicContact CB-CG 4.49Å; E103-M117 HydrophobicContact CG-CE 4.15Å; E103-M117 PolarHBondContact N-O 3.11Å; R104-M117 HydrophobicContact CB-CB 4.44Å; R104-M117 HydrophobicContact CG-CB 3.25Å; R104-M117 HydrophobicContact CG-CE 3.78Å; R104-M117 HydrophobicContact CG-CG 4.23Å; R104-M117 HydrophobicContact CG-SD 4.38Å; R104-M117 PolarHBondContact NH1-SD 3.4Å; R104-M117 PolarHBondContact NH2-SD 2.95Å; R104-M117 PolarHBondContact O-N 2.87Å; M117-Q124 HydrophobicContact SD-CB 4.43Å; M117-M126 HydrophobicContact CB-CE 3.3Å; M117-M126 HydrophobicContact CB-SD 4.38Å; M117-M126 HydrophobicContact CG-CE 3.21Å; M117-M126 HydrophobicContact SD-CE 3.29Å; M117-M126 WeakPolarHBondContact SD-CE 3.37Å
118	V	91.8	Very high	89.5	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	135.7	175.8	-59.3	0	0	0	0	109.5	V89 A100 R101 V102 A116 Q124 L125 R127 L132	V89-V118 HydrophobicContact CG2-CG1 3.89Å; A100-V118 HydrophobicContact CB-CB 3.73Å; A100-V118 HydrophobicContact CB-CG2 3.96Å; R101-V118 CarbonylContact O-C 3.58Å; R101-V118 WeakPolarHBondContact O-CA 3.45Å; V102-V118 HydrophobicContact CG2-CG1 4.19Å; A116-V118 HydrophobicContact CB-CG1 4.14Å; V118-Q124 CarbonylContact O-C 3.58Å; V118-Q124 WeakPolarHBondContact O-CA 3.44Å; V118-L125 HydrophobicContact CG2-CB 4.07Å; V118-L125 WeakPolarHBondContact CG2-O 3.34Å; V118-L125 PolarHBondContact N-O 3.26Å; V118-L125 PolarHBondContact O-N 2.64Å; V118-R127 HydrophobicContact CG2-CB 4.49Å; V118-R127 HydrophobicContact CG2-CG 4.02Å; V118-L132 HydrophobicContact CG1-CD1 3.64Å; V118-L132 HydrophobicContact CG1-CD2 4.08Å
119	R	90.3	Very high	89.5	Confident	111 Å²	111	68.7 Å²	68.7	42%	0.419	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	117.4	175.2	-176.2	170.1	177.6	172.6	-1.4	109.1	A100 R101 Q124	A100-R119 CarbonylContact C-O 3.57Å; A100-R119 WeakPolarHBondContact CA-O 3.4Å; A100-R119 WeakPolarHBondContact CB-O 3.42Å; R101-R119 PolarHBondContact N-O 3.25Å; R101-R119 PolarHBondContact O-N 3.01Å; R119-Q124 HydrophobicContact CB-CG 4.36Å; R119-Q124 HydrophobicContact CG-CG 4.35Å
120	T	87.4	Confident	89.3	Confident	17 Å²	17	65.9 Å²	65.9	10%	0.104	35%	0.351	C	S	.	.			trans	-90.6	169.4	167.7	-46.6	0	0	0	0	108.1	P98 T122 T123	P98-T120 HydrophobicContact CB-CG2 4.24Å; T120-T122 PolarHBondContact O-N 2.76Å; T120-T122 VanDerWaalsContact O-N 3.11Å; T120-T123 WeakPolarHBondContact CB-O 3.2Å; T120-T123 PolarHBondContact N-O 2.73Å
121	A	82.8	Confident	89	Confident	71 Å²	71	68.4 Å²	68.4	59%	0.587	35%	0.354	S	S	*	.	S	Bend	trans	-50.6	-35.1	174.7	0	0	0	0	0	113.4
122	T	84.2	Confident	88.9	Confident	122 Å²	122	66 Å²	66	75%	0.748	33%	0.328	S	S	*	.	S	Bend	trans	-105.5	-31.3	-174.3	55	0	0	0	0	114.7	T120	T120-T122 PolarHBondContact O-N 2.76Å; T120-T122 VanDerWaalsContact O-N 3.11Å
123	T	88.2	Confident	88.7	Confident	69 Å²	69	66.9 Å²	66.9	42%	0.423	33%	0.328	S	S	.	.			trans	-147.8	155.6	-166.9	56.5	0	0	0	0	112.8	T120	T120-T123 WeakPolarHBondContact CB-O 3.2Å; T120-T123 PolarHBondContact N-O 2.73Å
124	Q	91	Very high	88.5	Confident	101 Å²	101	67.8 Å²	67.8	47%	0.472	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	137	165.3	-74.3	174.2	-18.8	0	0	109.9	E103 M117 V118 R119	E103-Q124 PolarHBondContact OE1-NE2 3.44Å; E103-Q124 PolarHBondContact OE2-NE2 3Å; M117-Q124 HydrophobicContact SD-CB 4.43Å; V118-Q124 CarbonylContact O-C 3.58Å; V118-Q124 WeakPolarHBondContact O-CA 3.44Å; R119-Q124 HydrophobicContact CB-CG 4.36Å; R119-Q124 HydrophobicContact CG-CG 4.35Å
125	L	90.7	Very high	88.1	Confident	51 Å²	51	62.9 Å²	62.9	27%	0.267	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	141.2	-177.9	-62.3	172.5	0	0	0	110.5	N91 V118	N91-L125 WeakPolarHBondContact ND2-CD1 3.3Å; V118-L125 HydrophobicContact CG2-CB 4.07Å; V118-L125 WeakPolarHBondContact CG2-O 3.34Å; V118-L125 PolarHBondContact N-O 3.26Å; V118-L125 PolarHBondContact O-N 2.64Å
126	M	92.2	Very high	87.3	Confident	78 Å²	78	65.1 Å²	65.1	38%	0.384	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	126.4	164.7	-66.8	-61.5	106.2	0	0	109.5	I106 I115 M117	I106-M126 HydrophobicContact CD1-SD 3.54Å; I106-M126 VanDerWaalsContact CD1-SD 3.54Å; I115-M126 HydrophobicContact CG2-CB 4.14Å; I115-M126 HydrophobicContact CG2-SD 4.05Å; M117-M126 HydrophobicContact CB-CE 3.3Å; M117-M126 HydrophobicContact CB-SD 4.38Å; M117-M126 HydrophobicContact CG-CE 3.21Å; M117-M126 HydrophobicContact SD-CE 3.29Å; M117-M126 WeakPolarHBondContact SD-CE 3.37Å
127	R	91.2	Very high	86.1	Confident	73 Å²	73	69.8 Å²	69.8	28%	0.275	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	132.5	176.6	-70	-62.9	-173.5	-128.5	4.6	111.2	N91 A116 V118 L129 L132	N91-R127 PolarHBondContact OD1-NE 3.24Å; A116-R127 PolarHBondContact N-O 2.9Å; A116-R127 PolarHBondContact O-N 3.48Å; V118-R127 HydrophobicContact CG2-CB 4.49Å; V118-R127 HydrophobicContact CG2-CG 4.02Å; R127-L129 PolarHBondContact O-N 3.45Å; R127-L132 HydrophobicContact CB-CD1 4.13Å; R127-L132 HydrophobicContact CB-CD2 3.77Å; R127-L132 HydrophobicContact CB-CG 3.99Å; R127-L132 HydrophobicContact CG-CD2 4.19Å
128	P	90.1	Very high	84.7	Confident	52 Å²	52	71.5 Å²	71.5	34%	0.338	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	138.3	167.7	-21.6	32.5	0	0	0	110	R114 Q130 R131	R114-P128 CarbonylContact O-C 3.6Å; R114-P128 WeakPolarHBondContact O-CA 3.37Å; P128-Q130 PolarHBondContact O-N 3.38Å; P128-Q130 VanDerWaalsContact O-N 3.12Å; P128-R131 PolarHBondContact O-N 2.85Å
129	L	88	Confident	82.9	Confident	9 Å²	9	77.9 Å²	77.9	5%	0.047	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-56.4	-32.8	-179.3	-67.6	-176.2	0	0	0	112.4	P80 I83 L105 P113 R114 A116 R127 R131 L132	P80-L129 HydrophobicContact CB-CB 4.34Å; P80-L129 HydrophobicContact CG-CB 3.55Å; I83-L129 HydrophobicContact CB-CD2 4.42Å; I83-L129 HydrophobicContact CD1-CD2 4.19Å; I83-L129 HydrophobicContact CG2-CD2 4.37Å; L105-L129 HydrophobicContact CD2-CD2 3.91Å; P113-L129 HydrophobicContact CB-CD1 4.11Å; P113-L129 HydrophobicContact CG-CD1 4.41Å; P113-L129 WeakPolarHBondContact O-CD1 3.15Å; R114-L129 PolarHBondContact O-N 3.4Å; A116-L129 HydrophobicContact CB-CD2 3.69Å; R127-L129 PolarHBondContact O-N 3.45Å; L129-R131 PolarHBondContact O-N 3.36Å; L129-R131 VanDerWaalsContact O-N 3.08Å; L129-L132 HydrophobicContact CD2-CD1 4.29Å; L129-L132 PolarHBondContact O-N 3.43Å
130	Q	83.9	Confident	81.3	Confident	154 Å²	154	77.3 Å²	77.3	72%	0.72	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-60.5	-18.9	177.3	-64.6	177	-13.8	0	0	113.8	P128	P128-Q130 PolarHBondContact O-N 3.38Å; P128-Q130 VanDerWaalsContact O-N 3.12Å
131	R	83.8	Confident	79.8	Confident	139 Å²	139	80.2 Å²	80.2	53%	0.525	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-102.5	3.5	178.3	-60.9	-166.6	176.4	175.6	-1.4	112.9	Q92 P128 L129	Q92-R131 HydrophobicContact CB-CB 4.45Å; Q92-R131 VanDerWaalsContact OE1-CG 3.29Å; P128-R131 PolarHBondContact O-N 2.85Å; L129-R131 PolarHBondContact O-N 3.36Å; L129-R131 VanDerWaalsContact O-N 3.08Å
132	L	85.7	Confident	78.4	Confident	4 Å²	4	82.8 Å²	82.8	2%	0.021	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	136.8	177.9	-63.4	179.3	0	0	0	109.7	I83 V89 A116 V118 R127 L129	I83-L132 HydrophobicContact CD1-CB 3.76Å; V89-L132 HydrophobicContact CB-CB 4.25Å; V89-L132 HydrophobicContact CB-CD2 4.42Å; V89-L132 HydrophobicContact CG1-CB 4.4Å; V89-L132 HydrophobicContact CG2-CB 4.47Å; V89-L132 HydrophobicContact CG2-CD1 4.32Å; V89-L132 HydrophobicContact CG2-CD2 3.88Å; V89-L132 HydrophobicContact CG2-CG 4.45Å; A116-L132 HydrophobicContact CB-CD1 3.6Å; V118-L132 HydrophobicContact CG1-CD1 3.64Å; V118-L132 HydrophobicContact CG1-CD2 4.08Å; R127-L132 HydrophobicContact CB-CD1 4.13Å; R127-L132 HydrophobicContact CB-CD2 3.77Å; R127-L132 HydrophobicContact CB-CG 3.99Å; R127-L132 HydrophobicContact CG-CD2 4.19Å; L129-L132 HydrophobicContact CD2-CD1 4.29Å; L129-L132 PolarHBondContact O-N 3.43Å
133	Y	84.4	Confident	77.1	Confident	100 Å²	100	79.4 Å²	79.4	39%	0.392	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	111.3	-179.8	-60.7	-91.6	0	0	0	108.5	V89 H90 Q92	V89-Y133 CarbonylContact C-O 3.59Å; V89-Y133 WeakPolarHBondContact CA-O 3.25Å; H90-Y133 PolarHBondContact N-O 2.93Å; H90-Y133 PolarHBondContact O-N 2.83Å; Q92-Y133 HydrophobicContact CG-CE2 4.15Å; Q92-Y133 PolarHBondContact NE2-OH 3.49Å
134	P	84.7	Confident	75.5	Confident	61 Å²	61	79.6 Å²	79.6	40%	0.396	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	140.9	177.4	26.7	-33	0	0	0	110.1	I83	I83-P134 HydrophobicContact CG1-CG 4.41Å
135	L	81.8	Confident	74	Confident	31 Å²	31	81.8 Å²	81.8	16%	0.162	43%	0.426	C	S	.	.	S	Bend	trans	-81.7	-40.9	177.1	-99.4	170.5	0	0	0	112.1	L6 Y8 V88 H90 L99	L6-L135 WeakPolarHBondContact O-CD2 3.35Å; Y8-L135 HydrophobicContact CD1-CD1 4.11Å; V88-L135 HydrophobicContact CG1-CD1 3.86Å; V88-L135 PolarHBondContact O-N 3.44Å; H90-L135 WeakPolarHBondContact CE1-CD2 3.3Å; H90-L135 WeakPolarHBondContact CE1-CG 3.47Å; L99-L135 HydrophobicContact CD1-CD1 4.16Å; L99-L135 HydrophobicContact CD2-CD1 3.47Å; L99-L135 VanDerWaalsContact CD2-CD1 3.47Å; L99-L135 HydrophobicContact CG-CD1 4.44Å
136	E	75.1	Confident	72.1	Confident	115 Å²	115	85.7 Å²	85.7	54%	0.537	44%	0.441	S	S	.	.	S	Bend	trans	-98.9	149.6	-179.1	-57.5	-168.2	160.4	0	0	110.6	Y8	Y8-E136 HydrophobicContact CE1-CG 4.27Å; Y8-E136 WeakPolarHBondContact CE1-OE1 3.44Å; Y8-E136 PolarHBondContact OH-OE1 3.42Å
137	I	67.7	Low	70.3	Confident	98 Å²	98	85.8 Å²	85.8	50%	0.503	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-86.5	117.7	171.4	-57.6	163.6	0	0	0	105.4	S139 E141 L143	I137-S139 PolarHBondContact O-N 3.31Å; I137-E141 HydrophobicContact CG2-CB 3.89Å; I137-L143 HydrophobicContact CD1-CD1 4.44Å; I137-L143 HydrophobicContact CD1-CD2 4.32Å
138	S	62.7	Low	68.7	Low	45 Å²	45	90.7 Å²	90.7	32%	0.315	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-59	139.7	173.6	56.1	0	0	0	0	109.5	S140 E141	S138-S140 PolarHBondContact O-N 2.9Å; S138-E141 PolarHBondContact O-N 3.47Å
139	S	55.5	Low	67.2	Low	134 Å²	134	94 Å²	94	94%	0.937	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-11	-173.8	48.5	0	0	0	0	114.3	I137	I137-S139 PolarHBondContact O-N 3.31Å
140	S	55.5	Low	65.8	Low	99 Å²	99	97.8 Å²	97.8	69%	0.692	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-13.8	176	60.3	0	0	0	0	114.5	S138 T142	S138-S140 PolarHBondContact O-N 2.9Å; S140-T142 PolarHBondContact O-N 2.96Å; S140-T142 VanDerWaalsContact O-N 3.14Å
141	E	57	Low	64.5	Low	78 Å²	78	94.2 Å²	94.2	36%	0.364	52%	0.515	S	S	.	.			trans	-80.9	99.1	176.1	-161.3	172.4	-170.9	0	0	110.3	I137 S138 L143	I137-E141 HydrophobicContact CG2-CB 3.89Å; S138-E141 PolarHBondContact O-N 3.47Å; E141-L143 PolarHBondContact O-N 3.44Å
142	T	52.2	Low	63.2	Low	126 Å²	126	96.6 Å²	96.6	77%	0.773	53%	0.529	S	S	*	.			trans	-62.4	101.4	171.1	45.1	0	0	0	0	109.5	S140	S140-T142 PolarHBondContact O-N 2.96Å; S140-T142 VanDerWaalsContact O-N 3.14Å
143	L	57.2	Low	61.6	Low	51 Å²	51	101.6 Å²	101.6	27%	0.267	56%	0.562	S	S	.	*			trans	-61.4	131.9	174.4	-68.2	176.1	0	0	0	109.3	I137 E141 W145 K146	I137-L143 HydrophobicContact CD1-CD1 4.44Å; I137-L143 HydrophobicContact CD1-CD2 4.32Å; E141-L143 PolarHBondContact O-N 3.44Å; L143-W145 VanDerWaalsContact CB-CD1 3.48Å; L143-W145 HydrophobicContact CB-CG 4.49Å; L143-W145 VanDerWaalsContact CD1-NE1 3.32Å; L143-W145 PolarHBondContact O-N 3.18Å; L143-K146 PolarHBondContact O-N 3.35Å
144	P	54.8	Low	60.1	Low	72 Å²	72	102.3 Å²	102.3	47%	0.468	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.3	-8.9	-174.7	22.8	-33.1	0	0	0	114.5	S147	P144-S147 PolarHBondContact O-OG 3.27Å
145	W	59.1	Low	58.5	Low	148 Å²	148	110.7 Å²	110.7	56%	0.561	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-28.2	173.2	76.9	-92	0	0	0	112.8	L143 S147 K148 I149	L143-W145 VanDerWaalsContact CB-CD1 3.48Å; L143-W145 HydrophobicContact CB-CG 4.49Å; L143-W145 VanDerWaalsContact CD1-NE1 3.32Å; L143-W145 PolarHBondContact O-N 3.18Å; W145-S147 VanDerWaalsContact C-N 3.32Å; W145-S147 PolarHBondContact O-N 2.94Å; W145-K148 PolarHBondContact O-N 2.98Å; W145-I149 HydrophobicContact CE3-CD1 3.56Å; W145-I149 HydrophobicContact CZ3-CD1 3.42Å; W145-I149 VanDerWaalsContact CZ3-CD1 3.42Å
146	K	52.4	Low	57	Low	133 Å²	133	117.5 Å²	117.5	58%	0.578	64%	0.636	S	S	*	*	H	α-helix	trans	-66.3	-35.3	176.5	-79.7	-173.1	173.1	-173.3	0	111.6	L143 K148 I149	L143-K146 PolarHBondContact O-N 3.35Å; K146-K148 VanDerWaalsContact C-N 3.28Å; K146-K148 PolarHBondContact O-N 3Å; K146-I149 PolarHBondContact O-N 3.38Å
147	S	54.6	Low	55.6	Low	79 Å²	79	116.3 Å²	116.3	55%	0.552	64%	0.64	S	S	*	*	H	α-helix	trans	-68.2	-22.9	177.4	44.6	0	0	0	0	113.8	P144 W145	P144-S147 PolarHBondContact O-OG 3.27Å; W145-S147 VanDerWaalsContact C-N 3.32Å; W145-S147 PolarHBondContact O-N 2.94Å
148	K	55.6	Low	54.7	Low	177 Å²	177	118.8 Å²	118.8	77%	0.77	66%	0.655	S	S	*	*	H	α-helix	trans	-78.7	-20.3	177.5	-71.3	-173.2	177.2	-173.2	0	114	W145 K146	W145-K148 PolarHBondContact O-N 2.98Å; K146-K148 VanDerWaalsContact C-N 3.28Å; K146-K148 PolarHBondContact O-N 3Å
149	I	59.9	Low	54.1	Low	121 Å²	121	124.9 Å²	124.9	62%	0.621	68%	0.678	S	S	*	*	H	α-helix	trans	-88.3	-29.1	-178.6	-61.6	173.5	0	0	0	111.2	W145 K146	W145-I149 HydrophobicContact CE3-CD1 3.56Å; W145-I149 HydrophobicContact CZ3-CD1 3.42Å; W145-I149 VanDerWaalsContact CZ3-CD1 3.42Å; K146-I149 PolarHBondContact O-N 3.38Å
150	A	58.5	Low	53.8	Low	88 Å²	88	123.4 Å²	123.4	73%	0.727	67%	0.668	S	S	*	*	H	α-helix	trans	-78.7	-18.8	-179.4	0	0	0	0	0	114.1	K152	A150-K152 VanDerWaalsContact C-N 3.28Å; A150-K152 PolarHBondContact O-N 3.03Å
151	A	57	Low	53.2	Low	80 Å²	80	130.3 Å²	130.3	66%	0.661	68%	0.679	S	S	*	*			trans	-85.5	62.4	178.8	0	0	0	0	0	111.8	P153	A151-P153 WeakPolarHBondContact O-CD 3.34Å
152	K	56.4	Low	52.8	Low	189 Å²	189	133.6 Å²	133.6	82%	0.822	70%	0.699	S	S	*	*			trans	-89	114.2	163.3	-128.3	178.9	-174.4	-178.7	0	107.3	A150 S154	A150-K152 VanDerWaalsContact C-N 3.28Å; A150-K152 PolarHBondContact O-N 3.03Å; K152-S154 PolarHBondContact O-N 3.35Å
153	P	51.5	Low	52.8	Low	109 Å²	109	135.3 Å²	135.3	71%	0.708	70%	0.703	S	S	*	*			trans	-68.1	116.5	177.6	25.4	-30.6	0	0	0	109.5	A151 R155	A151-P153 WeakPolarHBondContact O-CD 3.34Å; P153-R155 PolarHBondContact O-N 3.24Å
154	S	53.7	Low	52.3	Low	115 Å²	115	138.1 Å²	138.1	80%	0.804	73%	0.727	S	S	*	*			trans	-65.1	112.2	167.1	43.1	0	0	0	0	109	K152	K152-S154 PolarHBondContact O-N 3.35Å
155	R	50.8	Low	52.2	Low	236 Å²	236	141.6 Å²	141.6	89%	0.891	75%	0.747	S	S	*	*			trans	-97.9	97.8	166.8	-71.2	-176.3	-176.6	175.9	0.7	108.3	P153	P153-R155 PolarHBondContact O-N 3.24Å
156	H	49.1	Very low	51.6	Low	175 Å²	175	140.5 Å²	140.5	81%	0.81	76%	0.757	S	S	*	*			trans	-114.3	101.2	157.1	-96.6	-79	0	0	0	104.7
157	S	45.6	Very low	51	Low	89 Å²	89	140.8 Å²	140.8	62%	0.622	77%	0.765	S	S	*	*				96.1	105.3	82.6	62.4	0	0	0	0	108.9
158	D	49.4	Very low	50.8	Low	151 Å²	151	141.7 Å²	141.7	81%	0.807	77%	0.771	S	S	*	*			trans	-166.9	142.9	136.7	-106.4	-21	0	0	0	113.2
159	Q	51.3	Low	50.6	Low	172 Å²	172	141.6 Å²	141.6	80%	0.804	77%	0.773	S	S	*	*			trans	89	92.5	159.2	-64.3	170.1	22.3	0	0	119.7
160	S	47.3	Very low	49.9	Very low	103 Å²	103	147 Å²	147	72%	0.72	79%	0.786	S	S	*	*				60.4	105	117.6	-169.6	0	0	0	0	118.1
161	R	44.6	Very low	49.5	Very low	244 Å²	244	151.5 Å²	151.5	92%	0.921	79%	0.792	S	S	*	*				-169.6	129.7	119.5	-104.6	164.9	177.9	159.5	-0	111.5
162	N	48.4	Very low	49.5	Very low	147 Å²	147	155.1 Å²	155.1	79%	0.786	80%	0.8	S	S	*	*			trans	-59.3	140.3	179.4	-54.9	-25.1	0	0	0	111.6
163	N	52.3	Low	49.5	Very low	163 Å²	163	151.8 Å²	151.8	87%	0.872	80%	0.795	S	S	*	*				-167.9	126.8	124.4	-93.4	-10.6	0	0	0	110.2
164	S	46.6	Very low	49.7	Very low	109 Å²	109	151 Å²	151	76%	0.762	80%	0.798	S	S	*	*			trans	-72.5	125.7	178.7	48.4	0	0	0	0	111.9
165	V	51.3	Low	49.9	Very low	146 Å²	146	153.1 Å²	153.1	89%	0.885	80%	0.8	S	S	*	*			trans	-140.5	108.6	148.9	179.6	0	0	0	0	106.2
166	T	47.4	Very low	50.1	Low	125 Å²	125	149.6 Å²	149.6	77%	0.767	79%	0.794	S	S	*	*			trans	-85.6	154.3	170.6	45.5	0	0	0	0	110.1
167	D	40.7	Very low	50.4	Low	139 Å²	139	151 Å²	151	74%	0.743	80%	0.798	S	S	*	*	S	Bend	trans	108	123.1	140.8	-131.3	-4.6	0	0	0	119.1	Q169	D167-Q169 PolarHBondContact O-N 2.72Å
168	S	49	Very low	51.2	Low	98 Å²	98	152.5 Å²	152.5	69%	0.685	81%	0.806	S	S	*	*			trans	72.8	9.3	145.9	-39.5	0	0	0	0	123.1
169	Q	51.5	Low	51.3	Low	175 Å²	175	150.3 Å²	150.3	82%	0.818	81%	0.808	S	S	*	*			trans	-99.9	12.9	-168.8	-139.4	176.8	-42.1	0	0	118.9	D167	D167-Q169 PolarHBondContact O-N 2.72Å
170	W	45.4	Very low	51.7	Low	234 Å²	234	155 Å²	155	89%	0.886	83%	0.831	S	S	*	*	S	Bend	trans	-121.8	5.2	-177.5	-69.7	109.4	0	0	0	116.9
171	E	51.2	Low	51.9	Low	182 Å²	182	157.7 Å²	157.7	85%	0.85	84%	0.836	S	S	*	*	S	Bend	trans	-90.4	-3	-178.2	-91.1	170	160.3	0	0	115.9
172	D	55.8	Low	52.3	Low	156 Å²	156	153.1 Å²	153.1	83%	0.834	83%	0.832	S	S	*	*	S	Bend	trans	-104.1	3.8	-173.1	-91.6	-27.4	0	0	0	117
173	V	55.7	Low	52.5	Low	120 Å²	120	153.4 Å²	153.4	73%	0.727	83%	0.834	S	S	*	*	S	Bend	trans	-102.2	-3.1	-173.6	-169.3	0	0	0	0	113.8
174	A	56.3	Low	52.5	Low	93 Å²	93	152.9 Å²	152.9	77%	0.769	83%	0.832	S	S	*	*	S	Bend	trans	-92.9	-2	-173.7	0	0	0	0	0	115.9
175	N	58.4	Low	52.9	Low	158 Å²	158	155.6 Å²	155.6	85%	0.845	84%	0.836	S	S	*	*	S	Bend	trans	-115.4	27.4	-171.1	-87.4	-15.4	0	0	0	115.9
176	Q	55.4	Low	53	Low	163 Å²	163	156.3 Å²	156.3	76%	0.762	83%	0.833	S	S	*	*			trans	-124.7	88.3	175.2	-131.9	103.9	23.6	0	0	109.7
177	F	55.1	Low	53.4	Low	205 Å²	205	158.5 Å²	158.5	90%	0.899	84%	0.838	S	S	*	*			trans	-180	105.9	142.4	-91.8	-63.5	0	0	0	109.6
178	P	62.5	Low	54.4	Low	120 Å²	120	160 Å²	160	78%	0.779	85%	0.845	S	S	*	*			trans	-78.1	148.5	171.7	30.9	-30.9	0	0	0	111.3
179	A	50.5	Low	54.8	Low	104 Å²	104	165.2 Å²	165.2	86%	0.86	86%	0.858	S	S	*	*			trans	-65	139.1	171	0	0	0	0	0	111.4
180	Q	60.3	Low	55.1	Low	272 Å²	272	164.3 Å²	164.3	100%	1.271	86%	0.862	S	S	*	*			trans	-113.9	0	150.3	-73.7	-139	-40.1	0	0	108.6

Retrieved 180 of 180 residues in 84.6 ms (Link to these results)

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