A0A077Z4Y3_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z4Y3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 120 aa.

						>A0A077Z4Y3_TRITR|A0A077Z4Y3
MASTSKRQARTRLESAPGELLVALWQWVSAKTMTDVTERPHGGANFKKGPKWCAPPEDDLSSSLSSFNIAQQGGAVTFQTNRRRQGTTNLSDGKNQFETFAILRLAMSTRTFIPDGEKVS
					

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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	33.9	Very low	53.2	Low	247 Å²	247	130.5 Å²	130.5	100%	1.217	70%	0.695	S	S	*	*				0	108.7	0	-69.7	172.8	-160.5	0	0	108.2
2	A	40	Very low	53.9	Low	106 Å²	106	133.7 Å²	133.7	88%	0.876	69%	0.69	S	S	*	*			trans	157.6	63.4	161.7	0	0	0	0	0	109.8
3	S	44.1	Very low	54.4	Low	117 Å²	117	130.3 Å²	130.3	82%	0.818	67%	0.673	S	S	*	*			trans	-139	78.3	161.6	-167.8	0	0	0	0	107.3	S5	S3-S5 PolarHBondContact O-N 3.46Å
4	T	52	Low	54.9	Low	110 Å²	110	129.9 Å²	129.9	68%	0.675	67%	0.666	S	S	*	*			trans	-63.3	114.6	161.8	32.1	0	0	0	0	106.4	K6	T4-K6 PolarHBondContact O-N 2.9Å
5	S	58.3	Low	55.5	Low	63 Å²	63	127.5 Å²	127.5	44%	0.441	67%	0.666	S	S	.	*			trans	-54.3	138.1	-173.9	73.8	0	0	0	0	110.1	S3 R7 Q8 A9	S3-S5 PolarHBondContact O-N 3.46Å; S5-R7 CarbonylContact O-C 3.59Å; S5-R7 PolarHBondContact O-N 2.88Å; S5-Q8 PolarHBondContact O-N 3.14Å; S5-Q8 PolarHBondContact OG-N 3.03Å; S5-A9 PolarHBondContact O-N 3.46Å
6	K	57.6	Low	55.8	Low	195 Å²	195	121.1 Å²	121.1	85%	0.848	64%	0.637	S	S	*	*	H	α-helix	trans	-46.2	-28.8	175.7	-171.9	176.1	-179.3	177.9	0	112.9	T4 R10	T4-K6 PolarHBondContact O-N 2.9Å; K6-R10 WeakPolarHBondContact O-CB 3.39Å; K6-R10 PolarHBondContact O-N 2.82Å
7	R	57.8	Low	55.9	Low	207 Å²	207	117.4 Å²	117.4	78%	0.781	62%	0.622	S	S	*	*	H	α-helix	trans	-64.8	-46.8	173.1	-84.2	-173.7	172.6	-164.8	-2	113.2	S5 A9 R10 T11	S5-R7 CarbonylContact O-C 3.59Å; S5-R7 PolarHBondContact O-N 2.88Å; R7-A9 VanDerWaalsContact C-N 3.33Å; R7-A9 PolarHBondContact O-N 3.41Å; R7-R10 WeakPolarHBondContact O-CB 3.45Å; R7-R10 PolarHBondContact O-N 2.8Å; R7-R10 VanDerWaalsContact O-N 3.14Å; R7-T11 PolarHBondContact O-N 3.49Å; R7-T11 PolarHBondContact O-OG1 3.22Å
8	Q	58.6	Low	56.1	Low	95 Å²	95	113.3 Å²	113.3	44%	0.444	61%	0.613	S	S	.	*	H	α-helix	trans	-66.3	-37.4	-179.5	-166.1	176.9	20	0	0	111.8	S5 R10 R12	S5-Q8 PolarHBondContact O-N 3.14Å; S5-Q8 PolarHBondContact OG-N 3.03Å; Q8-R10 VanDerWaalsContact C-N 3.35Å; Q8-R12 WeakPolarHBondContact O-CG 3.43Å; Q8-R12 PolarHBondContact O-N 3.39Å
9	A	57.7	Low	56.3	Low	48 Å²	48	115.4 Å²	115.4	40%	0.397	62%	0.618	S	S	.	*	H	α-helix	trans	-62.6	-43.6	171.6	0	0	0	0	0	111.1	S5 R7 R12 L13	S5-A9 PolarHBondContact O-N 3.46Å; R7-A9 VanDerWaalsContact C-N 3.33Å; R7-A9 PolarHBondContact O-N 3.41Å; A9-R12 PolarHBondContact O-N 2.89Å; A9-L13 WeakPolarHBondContact O-CB 3.35Å; A9-L13 WeakPolarHBondContact O-CD1 3.36Å; A9-L13 PolarHBondContact O-N 3.33Å
10	R	61	Low	56.6	Low	159 Å²	159	112.3 Å²	112.3	60%	0.6	60%	0.601	S	S	*	*	H	α-helix	trans	-62.5	-43.4	177.1	-175.1	175.2	177.7	158.5	4.5	113.1	K6 R7 Q8 R12 L13 E14	K6-R10 WeakPolarHBondContact O-CB 3.39Å; K6-R10 PolarHBondContact O-N 2.82Å; R7-R10 WeakPolarHBondContact O-CB 3.45Å; R7-R10 PolarHBondContact O-N 2.8Å; R7-R10 VanDerWaalsContact O-N 3.14Å; Q8-R10 VanDerWaalsContact C-N 3.35Å; R10-R12 VanDerWaalsContact C-N 3.31Å; R10-R12 PolarHBondContact O-N 3.18Å; R10-L13 VanDerWaalsContact O-CB 3.3Å; R10-L13 WeakPolarHBondContact O-CB 3.45Å; R10-L13 PolarHBondContact O-N 2.8Å; R10-E14 HydrophobicContact CG-CG 4.49Å; R10-E14 WeakPolarHBondContact CG-OE1 3.3Å; R10-E14 IonicContact CZ-OE1 3.77Å; R10-E14 IonicContact NE-OE1 2.9Å; R10-E14 PolarHBondContact NE-OE1 3.22Å; R10-E14 IonicContact NH2-OE1 3.75Å; R10-E14 WeakPolarHBondContact O-CG 3.43Å; R10-E14 PolarHBondContact O-N 3.05Å
11	T	64.3	Low	56.9	Low	89 Å²	89	111.1 Å²	111.1	55%	0.546	59%	0.594	S	S	.	*	H	α-helix	trans	-63.4	-37.8	177.4	-51	0	0	0	0	111.9	R7 E14 S15	R7-T11 PolarHBondContact O-N 3.49Å; R7-T11 PolarHBondContact O-OG1 3.22Å; T11-E14 PolarHBondContact O-N 2.97Å; T11-S15 PolarHBondContact O-N 3.33Å; T11-S15 PolarHBondContact O-OG 3.42Å
12	R	60.9	Low	58.2	Low	168 Å²	168	103.1 Å²	103.1	63%	0.634	56%	0.559	S	S	*	*	H	α-helix	trans	-68.8	-36	174.9	-71.2	-177.7	177.5	-161.1	-1.4	112.8	Q8 A9 R10 S15 A16	Q8-R12 WeakPolarHBondContact O-CG 3.43Å; Q8-R12 PolarHBondContact O-N 3.39Å; A9-R12 PolarHBondContact O-N 2.89Å; R10-R12 VanDerWaalsContact C-N 3.31Å; R10-R12 PolarHBondContact O-N 3.18Å; R12-S15 PolarHBondContact O-OG 3.05Å; R12-A16 PolarHBondContact O-N 3.23Å
13	L	61.3	Low	59.2	Low	90 Å²	90	100.7 Å²	100.7	47%	0.471	54%	0.539	S	S	.	.	H	α-helix	trans	-62	-43.7	172.1	-95	147.9	0	0	0	111.6	A9 R10 L20	A9-L13 WeakPolarHBondContact O-CB 3.35Å; A9-L13 WeakPolarHBondContact O-CD1 3.36Å; A9-L13 PolarHBondContact O-N 3.33Å; R10-L13 VanDerWaalsContact O-CB 3.3Å; R10-L13 WeakPolarHBondContact O-CB 3.45Å; R10-L13 PolarHBondContact O-N 2.8Å; L13-L20 HydrophobicContact CB-CD2 4.4Å; L13-L20 HydrophobicContact CD1-CD2 4.41Å; L13-L20 HydrophobicContact CD2-CD2 3.04Å; L13-L20 HydrophobicContact CG-CD2 3.37Å
14	E	61.5	Low	60.1	Low	124 Å²	124	99 Å²	99	58%	0.579	52%	0.521	S	S	*	.	H	α-helix	trans	-72.6	-32.5	-178.4	-73	169.5	-175	0	0	112.5	R10 T11	R10-E14 HydrophobicContact CG-CG 4.49Å; R10-E14 WeakPolarHBondContact CG-OE1 3.3Å; R10-E14 IonicContact CZ-OE1 3.77Å; R10-E14 IonicContact NE-OE1 2.9Å; R10-E14 PolarHBondContact NE-OE1 3.22Å; R10-E14 IonicContact NH2-OE1 3.75Å; R10-E14 WeakPolarHBondContact O-CG 3.43Å; R10-E14 PolarHBondContact O-N 3.05Å; T11-E14 PolarHBondContact O-N 2.97Å
15	S	63.5	Low	60.8	Low	94 Å²	94	102 Å²	102	66%	0.657	52%	0.519	S	S	*	.	H	α-helix	trans	-80.3	-23.5	-178	62.2	0	0	0	0	114.9	T11 R12	T11-S15 PolarHBondContact O-N 3.33Å; T11-S15 PolarHBondContact O-OG 3.42Å; R12-S15 PolarHBondContact O-OG 3.05Å
16	A	60.9	Low	61.2	Low	25 Å²	25	104.4 Å²	104.4	21%	0.207	52%	0.524	C	S	.	.			trans	-147.9	64.2	-173.2	0	0	0	0	0	112.5	R12 G18 E19 L20	R12-A16 PolarHBondContact O-N 3.23Å; A16-G18 VanDerWaalsContact C-N 3.25Å; A16-G18 PolarHBondContact O-N 3.39Å; A16-E19 HydrophobicContact CB-CB 4.2Å; A16-E19 PolarHBondContact O-N 2.92Å; A16-L20 PolarHBondContact O-N 2.74Å; A16-L20 VanDerWaalsContact O-N 3.1Å
17	P	57	Low	61.6	Low	58 Å²	58	102.2 Å²	102.2	38%	0.377	51%	0.51	S	S	.	.	H	α-helix	trans	-60.8	-34.5	-176.5	23.5	-33	0	0	0	112.4	L21	P17-L21 WeakPolarHBondContact O-CB 3.14Å; P17-L21 WeakPolarHBondContact O-CD1 3.21Å; P17-L21 WeakPolarHBondContact O-CG 3.22Å; P17-L21 PolarHBondContact O-N 3.22Å
18	G	59.5	Low	61.8	Low	45 Å²	45	95 Å²	95	46%	0.464	49%	0.489	S	S	.	.	H	α-helix	trans	-69.3	-50.7	177.4	0	0	0	0	0	113.5	A16 L20 L21 V22	A16-G18 VanDerWaalsContact C-N 3.25Å; A16-G18 PolarHBondContact O-N 3.39Å; G18-L20 VanDerWaalsContact C-N 3.34Å; G18-L20 PolarHBondContact O-N 3.49Å; G18-L21 PolarHBondContact O-N 2.9Å; G18-V22 WeakPolarHBondContact O-CG2 3.23Å; G18-V22 PolarHBondContact O-N 3.38Å
19	E	59.7	Low	61.6	Low	152 Å²	152	91.8 Å²	91.8	71%	0.71	48%	0.477	S	S	*	.	H	α-helix	trans	-66.7	-36.1	-177.5	-64.6	-176.1	174.1	0	0	112.3	A16 V22 A23	A16-E19 HydrophobicContact CB-CB 4.2Å; A16-E19 PolarHBondContact O-N 2.92Å; E19-V22 PolarHBondContact O-N 3.4Å; E19-A23 WeakPolarHBondContact O-CB 3.28Å; E19-A23 PolarHBondContact O-N 2.77Å
20	L	62.8	Low	61.6	Low	54 Å²	54	92.3 Å²	92.3	28%	0.283	48%	0.482	S	S	.	.	H	α-helix	trans	-68.9	-38.9	176.5	-165.9	93.1	0	0	0	111.8	L13 A16 G18 V22 A23 L24	L13-L20 HydrophobicContact CB-CD2 4.4Å; L13-L20 HydrophobicContact CD1-CD2 4.41Å; L13-L20 HydrophobicContact CD2-CD2 3.04Å; L13-L20 HydrophobicContact CG-CD2 3.37Å; A16-L20 PolarHBondContact O-N 2.74Å; A16-L20 VanDerWaalsContact O-N 3.1Å; G18-L20 VanDerWaalsContact C-N 3.34Å; G18-L20 PolarHBondContact O-N 3.49Å; L20-V22 VanDerWaalsContact C-N 3.32Å; L20-A23 PolarHBondContact O-N 3.25Å; L20-L24 HydrophobicContact CD2-CD1 3.92Å; L20-L24 HydrophobicContact CG-CD1 3.98Å; L20-L24 VanDerWaalsContact O-CB 3.27Å; L20-L24 WeakPolarHBondContact O-CB 3.45Å; L20-L24 WeakPolarHBondContact O-CG 3.21Å; L20-L24 PolarHBondContact O-N 2.66Å
21	L	61.7	Low	61.2	Low	87 Å²	87	91 Å²	91	46%	0.455	48%	0.48	S	S	.	.	H	α-helix	trans	-62.8	-41.2	173.5	-75.4	170.7	0	0	0	111	P17 G18 W25 F100	P17-L21 WeakPolarHBondContact O-CB 3.14Å; P17-L21 WeakPolarHBondContact O-CD1 3.21Å; P17-L21 WeakPolarHBondContact O-CG 3.22Å; P17-L21 PolarHBondContact O-N 3.22Å; G18-L21 PolarHBondContact O-N 2.9Å; L21-W25 VanDerWaalsContact O-CB 3.24Å; L21-W25 WeakPolarHBondContact O-CB 3.41Å; L21-W25 PolarHBondContact O-N 3.05Å; L21-F100 HydrophobicContact CD2-CD2 3.9Å; L21-F100 HydrophobicContact CD2-CE2 4.12Å
22	V	61.4	Low	60.6	Low	80 Å²	80	91.6 Å²	91.6	49%	0.485	48%	0.484	S	S	.	.	H	α-helix	trans	-64.3	-45.7	174.2	173.4	0	0	0	0	111.3	G18 E19 L20 L24 W25 Q26	G18-V22 WeakPolarHBondContact O-CG2 3.23Å; G18-V22 PolarHBondContact O-N 3.38Å; E19-V22 PolarHBondContact O-N 3.4Å; L20-V22 VanDerWaalsContact C-N 3.32Å; V22-L24 PolarHBondContact O-N 3.11Å; V22-W25 PolarHBondContact O-N 2.83Å; V22-Q26 HydrophobicContact CG1-CG 4.48Å; V22-Q26 WeakPolarHBondContact O-CB 3.3Å; V22-Q26 WeakPolarHBondContact O-CG 3.4Å; V22-Q26 PolarHBondContact O-N 2.76Å
23	A	61.7	Low	59.8	Low	55 Å²	55	91 Å²	91	46%	0.455	49%	0.491	S	S	.	.	H	α-helix	trans	-64.8	-39.9	178.7	0	0	0	0	0	112.3	E19 L20 W27	E19-A23 WeakPolarHBondContact O-CB 3.28Å; E19-A23 PolarHBondContact O-N 2.77Å; L20-A23 PolarHBondContact O-N 3.25Å; A23-W27 WeakPolarHBondContact O-CB 3.15Å; A23-W27 PolarHBondContact O-N 3.48Å
24	L	62.7	Low	59.1	Low	81 Å²	81	91.7 Å²	91.7	42%	0.424	50%	0.498	S	S	.	.	H	α-helix	trans	-66.8	-41.7	174.1	-84.3	159.7	0	0	0	111.5	L20 V22 W27 V28	L20-L24 HydrophobicContact CD2-CD1 3.92Å; L20-L24 HydrophobicContact CG-CD1 3.98Å; L20-L24 VanDerWaalsContact O-CB 3.27Å; L20-L24 WeakPolarHBondContact O-CB 3.45Å; L20-L24 WeakPolarHBondContact O-CG 3.21Å; L20-L24 PolarHBondContact O-N 2.66Å; V22-L24 PolarHBondContact O-N 3.11Å; L24-W27 PolarHBondContact O-N 2.81Å; L24-V28 VanDerWaalsContact O-CG2 3.32Å; L24-V28 WeakPolarHBondContact O-CG2 3.34Å; L24-V28 PolarHBondContact O-N 3.44Å
25	W	67.2	Low	58.2	Low	172 Å²	172	92.9 Å²	92.9	65%	0.652	51%	0.509	S	S	*	.	H	α-helix	trans	-62.3	-46.1	174.8	179.5	84.7	0	0	0	111.3	L21 V22 W27 V28 S29	L21-W25 VanDerWaalsContact O-CB 3.24Å; L21-W25 WeakPolarHBondContact O-CB 3.41Å; L21-W25 PolarHBondContact O-N 3.05Å; V22-W25 PolarHBondContact O-N 2.83Å; W25-W27 VanDerWaalsContact C-N 3.33Å; W25-W27 PolarHBondContact O-N 2.88Å; W25-V28 PolarHBondContact O-N 3.39Å; W25-S29 WeakPolarHBondContact O-CB 3.49Å; W25-S29 PolarHBondContact O-N 3.44Å; W25-S29 PolarHBondContact O-OG 3.29Å
26	Q	66	Low	57.4	Low	115 Å²	115	95 Å²	95	54%	0.537	52%	0.517	S	S	.	.	H	α-helix	trans	-61.4	-40.3	174.8	-74.6	-170.6	-11.4	0	0	112	V22 S29 A30	V22-Q26 HydrophobicContact CG1-CG 4.48Å; V22-Q26 WeakPolarHBondContact O-CB 3.3Å; V22-Q26 WeakPolarHBondContact O-CG 3.4Å; V22-Q26 PolarHBondContact O-N 2.76Å; Q26-S29 PolarHBondContact O-N 3.25Å; Q26-A30 WeakPolarHBondContact O-CB 3.11Å; Q26-A30 PolarHBondContact O-N 3.5Å
27	W	67.5	Low	56.8	Low	148 Å²	148	99.4 Å²	99.4	56%	0.561	54%	0.542	S	S	*	.	H	α-helix	trans	-64.6	-42.9	176.6	-175.1	86.1	0	0	0	112.4	A23 L24 W25 K31	A23-W27 WeakPolarHBondContact O-CB 3.15Å; A23-W27 PolarHBondContact O-N 3.48Å; L24-W27 PolarHBondContact O-N 2.81Å; W25-W27 VanDerWaalsContact C-N 3.33Å; W25-W27 PolarHBondContact O-N 2.88Å; W27-K31 HydrophobicContact CH2-CD 3.65Å; W27-K31 HydrophobicContact CZ2-CD 3.63Å; W27-K31 HydrophobicContact CZ2-CG 4.44Å; W27-K31 HydrophobicContact CZ3-CD 4.1Å; W27-K31 WeakPolarHBondContact O-CB 3.41Å; W27-K31 PolarHBondContact O-N 3.1Å
28	V	60.5	Low	56.3	Low	56 Å²	56	105.3 Å²	105.3	34%	0.339	56%	0.564	S	S	.	*	H	α-helix	trans	-64.9	-50	175.8	172.3	0	0	0	0	110.1	L24 W25 A30 K31 T32	L24-V28 VanDerWaalsContact O-CG2 3.32Å; L24-V28 WeakPolarHBondContact O-CG2 3.34Å; L24-V28 PolarHBondContact O-N 3.44Å; W25-V28 PolarHBondContact O-N 3.39Å; V28-A30 VanDerWaalsContact C-N 3.32Å; V28-A30 PolarHBondContact O-N 3.26Å; V28-K31 PolarHBondContact O-N 2.7Å; V28-K31 VanDerWaalsContact O-N 3.09Å; V28-T32 PolarHBondContact O-N 2.89Å; V28-T32 PolarHBondContact O-OG1 3.47Å
29	S	55.8	Low	55.9	Low	27 Å²	27	114 Å²	114	19%	0.189	58%	0.583	C	S	.	*	H	α-helix	trans	-55.8	-44.9	177.7	-66.4	0	0	0	0	111.8	W25 Q26 K31 T32 M33	W25-S29 WeakPolarHBondContact O-CB 3.49Å; W25-S29 PolarHBondContact O-N 3.44Å; W25-S29 PolarHBondContact O-OG 3.29Å; Q26-S29 PolarHBondContact O-N 3.25Å; S29-K31 PolarHBondContact O-N 3.37Å; S29-T32 WeakPolarHBondContact CA-OG1 3.47Å; S29-T32 PolarHBondContact O-N 2.83Å; S29-T32 PolarHBondContact O-OG1 3Å; S29-M33 WeakPolarHBondContact O-CG 3.09Å; S29-M33 PolarHBondContact O-N 2.77Å
30	A	56.3	Low	55.7	Low	59 Å²	59	112.2 Å²	112.2	49%	0.488	59%	0.585	S	S	.	*	H	α-helix	trans	-64.8	-37.7	176.5	0	0	0	0	0	113	Q26 V28 T34	Q26-A30 WeakPolarHBondContact O-CB 3.11Å; Q26-A30 PolarHBondContact O-N 3.5Å; V28-A30 VanDerWaalsContact C-N 3.32Å; V28-A30 PolarHBondContact O-N 3.26Å; A30-T34 PolarHBondContact O-OG1 3.36Å
31	K	52.9	Low	54.8	Low	132 Å²	132	119.6 Å²	119.6	57%	0.574	62%	0.617	S	S	*	*	H	α-helix	trans	-73.8	-29.5	175.7	-93.4	-156	173.7	-170.9	0	114	W27 V28 S29 M33 T34	W27-K31 HydrophobicContact CH2-CD 3.65Å; W27-K31 HydrophobicContact CZ2-CD 3.63Å; W27-K31 HydrophobicContact CZ2-CG 4.44Å; W27-K31 HydrophobicContact CZ3-CD 4.1Å; W27-K31 WeakPolarHBondContact O-CB 3.41Å; W27-K31 PolarHBondContact O-N 3.1Å; V28-K31 PolarHBondContact O-N 2.7Å; V28-K31 VanDerWaalsContact O-N 3.09Å; S29-K31 PolarHBondContact O-N 3.37Å; K31-M33 VanDerWaalsContact C-N 3.34Å; K31-T34 PolarHBondContact O-OG1 3.22Å
32	T	51.1	Low	53.9	Low	102 Å²	102	118.4 Å²	118.4	63%	0.626	63%	0.626	S	S	*	*	H	α-helix	trans	-78	-17.6	174.4	35.8	0	0	0	0	113.6	V28 S29	V28-T32 PolarHBondContact O-N 2.89Å; V28-T32 PolarHBondContact O-OG1 3.47Å; S29-T32 WeakPolarHBondContact CA-OG1 3.47Å; S29-T32 PolarHBondContact O-N 2.83Å; S29-T32 PolarHBondContact O-OG1 3Å
33	M	45.4	Very low	53	Low	156 Å²	156	118.9 Å²	118.9	77%	0.768	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	0	179.3	-74.6	-176.4	-174.7	0	0	114.6	S29 K31	S29-M33 WeakPolarHBondContact O-CG 3.09Å; S29-M33 PolarHBondContact O-N 2.77Å; K31-M33 VanDerWaalsContact C-N 3.34Å
34	T	47.1	Very low	52.5	Low	103 Å²	103	119.5 Å²	119.5	63%	0.632	65%	0.652	S	S	*	*	S	Bend	trans	-108.3	14.2	-171.6	33.2	0	0	0	0	115.7	A30 K31	A30-T34 PolarHBondContact O-OG1 3.36Å; K31-T34 PolarHBondContact O-OG1 3.22Å
35	D	42.2	Very low	51.8	Low	150 Å²	150	123.7 Å²	123.7	80%	0.802	68%	0.675	S	S	*	*	S	Bend	trans	-129.8	44.9	177.4	-152.3	14.8	0	0	0	112.9
36	V	46.1	Very low	51.4	Low	137 Å²	137	124.7 Å²	124.7	83%	0.83	68%	0.684	S	S	*	*			trans	-127.8	56.6	162.9	-165.9	0	0	0	0	107.5
37	T	47.6	Very low	50.8	Low	119 Å²	119	129 Å²	129	73%	0.73	70%	0.701	S	S	*	*			trans	-89.4	113.9	168.2	-30.3	0	0	0	0	107.4	R39	T37-R39 PolarHBondContact O-N 2.85Å
38	E	48.1	Very low	49.8	Very low	181 Å²	181	132.1 Å²	132.1	85%	0.846	72%	0.719	S	S	*	*			trans	-16.8	108.4	173.1	-63.3	172.9	168.7	0	0	114	P40	E38-P40 WeakPolarHBondContact O-CD 3.21Å
39	R	51.2	Low	49.9	Very low	229 Å²	229	132.2 Å²	132.2	86%	0.864	73%	0.731	S	S	*	*			trans	-66.5	117.4	162.3	-82.8	-176	174.4	176.6	1.3	107.2	T37 H41	T37-R39 PolarHBondContact O-N 2.85Å; R39-H41 PolarHBondContact O-N 3.01Å; R39-H41 VanDerWaalsContact O-N 3.16Å
40	P	54.1	Low	50.1	Low	114 Å²	114	136.2 Å²	136.2	74%	0.74	76%	0.756	S	S	*	*			trans	-63.4	121.7	172.4	25	-30.8	0	0	0	108.5	E38 G42	E38-P40 WeakPolarHBondContact O-CD 3.21Å; P40-G42 PolarHBondContact O-N 2.95Å
41	H	44.8	Very low	50	Low	209 Å²	209	143.3 Å²	143.3	97%	0.968	78%	0.776	S	S	*	*			trans	-64.6	84.8	164.8	-79.5	-71	0	0	0	108.3	R39	R39-H41 PolarHBondContact O-N 3.01Å; R39-H41 VanDerWaalsContact O-N 3.16Å
42	G	42.3	Very low	49.9	Very low	62 Å²	62	147.9 Å²	147.9	64%	0.639	79%	0.79	S	S	*	*			trans	-164.1	122.9	-176.9	0	0	0	0	0	110.4	P40	P40-G42 PolarHBondContact O-N 2.95Å
43	G	41.9	Very low	49.9	Very low	89 Å²	89	148.8 Å²	148.8	92%	0.918	80%	0.799	S	S	*	*			trans	-59.6	136.1	-165.7	0	0	0	0	0	114.7
44	A	52.4	Low	50.1	Low	68 Å²	68	145.3 Å²	145.3	56%	0.562	80%	0.795	S	S	*	*			trans	-155.2	128.2	157.8	0	0	0	0	0	109.2	F46	A44-F46 HydrophobicContact CB-CD2 4.44Å; A44-F46 HydrophobicContact CB-CE2 3.89Å; A44-F46 HydrophobicContact CB-CZ 4.35Å; A44-F46 WeakPolarHBondContact O-CD2 3.23Å; A44-F46 PolarHBondContact O-N 2.83Å
45	N	46.8	Very low	50.2	Low	170 Å²	170	144.6 Å²	144.6	91%	0.909	79%	0.792	S	S	*	*			trans	-60.3	94.5	175.7	-78.6	-57.9	0	0	0	111.3	K47	N45-K47 PolarHBondContact O-N 3.49Å
46	F	58.6	Low	50.7	Low	193 Å²	193	142.3 Å²	142.3	85%	0.846	79%	0.785	S	S	*	*			trans	-84.7	102.7	170.6	-72.2	-79.5	0	0	0	110.3	A44 K48	A44-F46 HydrophobicContact CB-CD2 4.44Å; A44-F46 HydrophobicContact CB-CE2 3.89Å; A44-F46 HydrophobicContact CB-CZ 4.35Å; A44-F46 WeakPolarHBondContact O-CD2 3.23Å; A44-F46 PolarHBondContact O-N 2.83Å; F46-K48 PolarHBondContact O-N 2.81Å
47	K	53.4	Low	50.7	Low	204 Å²	204	144.1 Å²	144.1	89%	0.887	79%	0.785	S	S	*	*			trans	-55.9	130.4	169.8	-74.2	177	175.5	176.2	0	110.1	N45 G49	N45-K47 PolarHBondContact O-N 3.49Å; K47-G49 PolarHBondContact O-N 3.37Å
48	K	47.8	Very low	50.8	Low	215 Å²	215	145.6 Å²	145.6	94%	0.935	79%	0.788	S	S	*	*			trans	-16.5	98.7	173.5	-67.5	178.9	176.3	180	0	115.9	F46	F46-K48 PolarHBondContact O-N 2.81Å
49	G	62.3	Low	50.8	Low	58 Å²	58	142.2 Å²	142.2	60%	0.598	78%	0.776	S	S	*	*			trans	-90.6	166.1	150.6	0	0	0	0	0	110.9	K47 K51	K47-G49 PolarHBondContact O-N 3.37Å; G49-K51 PolarHBondContact O-N 2.86Å
50	P	59.9	Low	50.2	Low	110 Å²	110	136.2 Å²	136.2	71%	0.714	76%	0.761	S	S	*	*			trans	-56.1	132.5	178.9	22.9	-31.3	0	0	0	110.2	W52	P50-W52 VanDerWaalsContact C-N 3.26Å; P50-W52 PolarHBondContact O-N 3.36Å
51	K	54.1	Low	49.6	Very low	208 Å²	208	135.8 Å²	135.8	90%	0.904	76%	0.76	S	S	*	*			trans	-67.2	83.1	-177.1	-149	-177.7	-169.1	-174.7	0	108.9	G49 C53	G49-K51 PolarHBondContact O-N 2.86Å; K51-C53 PolarHBondContact O-N 3.29Å
52	W	50.2	Low	49.4	Very low	229 Å²	229	128.4 Å²	128.4	87%	0.867	73%	0.732	S	S	*	*			trans	-71.4	115.9	166.8	-81	43.5	0	0	0	106.6	P50 A54	P50-W52 VanDerWaalsContact C-N 3.26Å; P50-W52 PolarHBondContact O-N 3.36Å; W52-A54 PolarHBondContact O-N 2.99Å
53	C	52.8	Low	49.5	Very low	121 Å²	121	130.1 Å²	130.1	82%	0.818	73%	0.734	S	S	*	*			trans	-64.3	102.6	170.4	-63.1	0	0	0	0	107.5	K51	K51-C53 PolarHBondContact O-N 3.29Å
54	A	48.9	Very low	49.6	Very low	83 Å²	83	132.3 Å²	132.3	69%	0.686	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-61.5	121.8	165.6	0	0	0	0	0	106.8	W52	W52-A54 PolarHBondContact O-N 2.99Å
55	P	49.1	Very low	49.4	Very low	87 Å²	87	133.5 Å²	133.5	57%	0.565	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-58.9	142	174.1	25.5	-31.3	0	0	0	108.1	E57	P55-E57 PolarHBondContact O-N 2.81Å; P55-E57 VanDerWaalsContact O-N 3.16Å
56	P	51.5	Low	49.6	Very low	103 Å²	103	126.8 Å²	126.8	67%	0.669	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-51.1	125.8	178	21	-31.6	0	0	0	109.4	D58	P56-D58 PolarHBondContact O-N 2.86Å
57	E	47.7	Very low	49.4	Very low	174 Å²	174	122 Å²	122	81%	0.813	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	0.6	-175.4	-68.1	-172.8	161.1	0	0	113	P55	P55-E57 PolarHBondContact O-N 2.81Å; P55-E57 VanDerWaalsContact O-N 3.16Å
58	D	48.9	Very low	49.7	Very low	150 Å²	150	117 Å²	117	80%	0.802	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.1	12.1	-167.8	-78.9	-40.7	0	0	0	115.9	P56	P56-D58 PolarHBondContact O-N 2.86Å
59	D	48.1	Very low	50.2	Low	110 Å²	110	110.6 Å²	110.6	59%	0.588	63%	0.632	S	S	*	*	S	Bend	trans	-139.5	24	179.7	-119	-19.2	0	0	0	115.6	S62	D59-S62 PolarHBondContact O-OG 3Å; D59-S62 PolarHBondContact OD1-OG 3.17Å
60	L	38.5	Very low	50.1	Low	104 Å²	104	110.4 Å²	110.4	55%	0.545	62%	0.624	S	S	.	*	H	α-helix	trans	-94.4	-27.6	178.9	-71.5	168.1	0	0	0	113.3	L64	L60-L64 WeakPolarHBondContact O-CD1 3.34Å
61	S	42.6	Very low	50.3	Low	105 Å²	105	112.1 Å²	112.1	73%	0.734	62%	0.623	S	S	*	*	H	α-helix	trans	-82.5	-25.9	-179.8	73.3	0	0	0	0	113.1
62	S	40.9	Very low	50.5	Low	53 Å²	53	110.2 Å²	110.2	37%	0.371	62%	0.617	S	S	.	*	H	α-helix	trans	-72.3	-40.5	-178.7	50.6	0	0	0	0	112.3	D59 S65	D59-S62 PolarHBondContact O-OG 3Å; D59-S62 PolarHBondContact OD1-OG 3.17Å; S62-S65 PolarHBondContact O-OG 3.24Å
63	S	43.1	Very low	51	Low	99 Å²	99	103.6 Å²	103.6	69%	0.692	62%	0.62	S	S	*	*	H	α-helix	trans	-86.5	-16.5	-177.1	-75.6	0	0	0	0	115.4
64	L	44.5	Very low	51.6	Low	135 Å²	135	99.4 Å²	99.4	71%	0.707	60%	0.597	S	S	*	*	S	Bend	trans	-90	-9.2	176.9	-80.5	166.4	0	0	0	113.7	L60 S66	L60-L64 WeakPolarHBondContact O-CD1 3.34Å; L64-S66 PolarHBondContact O-N 2.73Å
65	S	47	Very low	52.1	Low	93 Å²	93	96.2 Å²	96.2	65%	0.65	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	8.3	-169	62.9	0	0	0	0	116.8	S62	S62-S65 PolarHBondContact O-OG 3.24Å
66	S	51.3	Low	52.8	Low	28 Å²	28	93 Å²	93	20%	0.196	55%	0.55	C	S	.	.	T	Hydrogen-bonded Turn	trans	-155	39.6	-165.6	-176.6	0	0	0	0	112.9	L64 N81	L64-S66 PolarHBondContact O-N 2.73Å; S66-N81 WeakPolarHBondContact CB-ND2 3.24Å; S66-N81 WeakPolarHBondContact CB-OD1 3.3Å; S66-N81 PolarHBondContact O-N 3.4Å; S66-N81 PolarHBondContact OG-OD1 3.15Å
67	F	54	Low	53.5	Low	93 Å²	93	90.1 Å²	90.1	41%	0.408	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	100.6	166.6	-174.8	-114.5	0	0	0	108.3	I69 F78 T80	F67-I69 HydrophobicContact CD1-CD1 4.13Å; F67-I69 HydrophobicContact CD1-CG1 4Å; F67-I69 HydrophobicContact CE1-CD1 3.13Å; F67-I69 HydrophobicContact CE1-CG1 3.32Å; F67-I69 HydrophobicContact CE2-CG1 4.35Å; F67-I69 HydrophobicContact CZ-CD1 3.48Å; F67-I69 VanDerWaalsContact CZ-CD1 3.48Å; F67-I69 HydrophobicContact CZ-CG1 3.51Å; F67-F78 HydrophobicContact CE2-CB 4.23Å; F67-F78 HydrophobicContact CZ-CB 4.45Å; F67-T80 HydrophobicContact CD2-CG2 3.95Å; F67-T80 HydrophobicContact CE2-CG2 4.11Å
68	N	61.2	Low	54.4	Low	100 Å²	100	84.1 Å²	84.1	54%	0.535	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	115.7	175.8	-72.2	-39.7	0	0	0	108.3	F78 Q79	N68-F78 CarbonylContact O-C 3.58Å; N68-F78 WeakPolarHBondContact O-CA 3.32Å; N68-Q79 HydrophobicContact CB-CB 4.38Å; N68-Q79 PolarHBondContact N-O 3.38Å; N68-Q79 VanDerWaalsContact N-O 3.11Å; N68-Q79 PolarHBondContact O-N 3.37Å
69	I	56.8	Low	55.2	Low	80 Å²	80	81.8 Å²	81.8	41%	0.41	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	125.9	162.8	-63.9	177.5	0	0	0	107.3	F67 V76 T77 F78 L103	F67-I69 HydrophobicContact CD1-CD1 4.13Å; F67-I69 HydrophobicContact CD1-CG1 4Å; F67-I69 HydrophobicContact CE1-CD1 3.13Å; F67-I69 HydrophobicContact CE1-CG1 3.32Å; F67-I69 HydrophobicContact CE2-CG1 4.35Å; F67-I69 HydrophobicContact CZ-CD1 3.48Å; F67-I69 VanDerWaalsContact CZ-CD1 3.48Å; F67-I69 HydrophobicContact CZ-CG1 3.51Å; I69-V76 HydrophobicContact CG2-CG1 3.76Å; I69-T77 VanDerWaalsContact CA-O 3.3Å; I69-T77 WeakPolarHBondContact CA-O 3.43Å; I69-F78 HydrophobicContact CG1-CB 4.43Å; I69-L103 HydrophobicContact CD1-CD1 3.63Å
70	A	61.5	Low	55.8	Low	53 Å²	53	78.5 Å²	78.5	44%	0.438	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	135.6	167.5	0	0	0	0	0	109.7	T77	A70-T77 PolarHBondContact N-O 3.01Å; A70-T77 PolarHBondContact O-N 3.21Å; A70-T77 PolarHBondContact O-OG1 2.99Å
71	Q	63.2	Low	56.6	Low	146 Å²	146	78.5 Å²	78.5	68%	0.682	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	124	171.9	-174.8	-179.8	-2.5	0	0	108.3	A75	Q71-A75 WeakPolarHBondContact CA-O 3.41Å
72	Q	59.5	Low	57.3	Low	169 Å²	169	84.2 Å²	84.2	79%	0.79	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.9	121.8	175.2	-169.3	177.7	5.8	0	0	109	G74 A75	Q72-G74 VanDerWaalsContact C-N 3.35Å; Q72-G74 PolarHBondContact O-N 2.89Å; Q72-A75 PolarHBondContact N-O 2.87Å; Q72-A75 PolarHBondContact O-N 3.01Å
73	G	60.8	Low	58	Low	89 Å²	89	93.6 Å²	93.6	92%	0.918	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	37.3	169.8	0	0	0	0	0	115.9	A75	G73-A75 VanDerWaalsContact C-N 3.3Å; G73-A75 PolarHBondContact O-N 3.02Å
74	G	64.2	Low	58.8	Low	33 Å²	33	98 Å²	98	34%	0.34	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	2	-178.6	0	0	0	0	0	114.6	Q72 L90	Q72-G74 VanDerWaalsContact C-N 3.35Å; Q72-G74 PolarHBondContact O-N 2.89Å; G74-L90 WeakPolarHBondContact O-CA 3.27Å; G74-L90 WeakPolarHBondContact O-CB 3.36Å; G74-L90 WeakPolarHBondContact O-CG 3.36Å; G74-L90 PolarHBondContact O-N 3.3Å
75	A	59	Low	59.8	Low	16 Å²	16	98.3 Å²	98.3	13%	0.132	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	143.8	169.6	0	0	0	0	0	111	Q71 Q72 G73 T87 T88 N89	Q71-A75 WeakPolarHBondContact CA-O 3.41Å; Q72-A75 PolarHBondContact N-O 2.87Å; Q72-A75 PolarHBondContact O-N 3.01Å; G73-A75 VanDerWaalsContact C-N 3.3Å; G73-A75 PolarHBondContact O-N 3.02Å; A75-T87 HydrophobicContact CB-CG2 4.2Å; A75-T88 CarbonylContact C-O 3.52Å; A75-T88 VanDerWaalsContact CA-O 3.3Å; A75-T88 WeakPolarHBondContact CA-O 3.43Å; A75-N89 WeakPolarHBondContact CB-OD1 3.33Å
76	V	64.4	Low	60.7	Low	21 Å²	21	94.7 Å²	94.7	13%	0.127	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	120.9	169.3	178.1	0	0	0	0	107.5	I69 T87 T88 L90	I69-V76 HydrophobicContact CG2-CG1 3.76Å; V76-T87 WeakPolarHBondContact O-CA 3.25Å; V76-T88 HydrophobicContact CB-CG2 3.79Å; V76-T88 PolarHBondContact N-O 3.43Å; V76-T88 PolarHBondContact O-N 2.89Å; V76-L90 HydrophobicContact CG2-CD1 3.59Å; V76-L90 HydrophobicContact CG2-CD2 3.84Å; V76-L90 HydrophobicContact CG2-CG 3.78Å
77	T	66	Low	61.1	Low	41 Å²	41	97.6 Å²	97.6	25%	0.252	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	135	169.7	65.3	0	0	0	0	108.5	I69 A70 G86 T87	I69-T77 VanDerWaalsContact CA-O 3.3Å; I69-T77 WeakPolarHBondContact CA-O 3.43Å; A70-T77 PolarHBondContact N-O 3.01Å; A70-T77 PolarHBondContact O-N 3.21Å; A70-T77 PolarHBondContact O-OG1 2.99Å; T77-G86 CarbonylContact C-O 3.59Å; T77-G86 VanDerWaalsContact CA-O 3.3Å; T77-G86 WeakPolarHBondContact CA-O 3.43Å; T77-T87 HydrophobicContact CG2-CG2 4.3Å; T77-T87 WeakPolarHBondContact CG2-OG1 3.06Å
78	F	68	Low	61.6	Low	48 Å²	48	94.2 Å²	94.2	21%	0.211	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	133.6	172.2	59.9	-89.6	0	0	0	108.8	F67 N68 I69 Q85 G86	F67-F78 HydrophobicContact CE2-CB 4.23Å; F67-F78 HydrophobicContact CZ-CB 4.45Å; N68-F78 CarbonylContact O-C 3.58Å; N68-F78 WeakPolarHBondContact O-CA 3.32Å; I69-F78 HydrophobicContact CG1-CB 4.43Å; F78-Q85 CarbonylContact O-C 3.58Å; F78-Q85 VanDerWaalsContact O-CA 3.25Å; F78-Q85 WeakPolarHBondContact O-CA 3.35Å; F78-G86 WeakPolarHBondContact CD1-O 3.27Å; F78-G86 PolarHBondContact N-O 3.48Å; F78-G86 PolarHBondContact O-N 3Å
79	Q	64.6	Low	61.6	Low	101 Å²	101	93.3 Å²	93.3	47%	0.472	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	126.3	174.3	-177.2	-178.9	-3	0	0	108.2	N68	N68-Q79 HydrophobicContact CB-CB 4.38Å; N68-Q79 PolarHBondContact N-O 3.38Å; N68-Q79 VanDerWaalsContact N-O 3.11Å; N68-Q79 PolarHBondContact O-N 3.37Å
80	T	61	Low	61.6	Low	42 Å²	42	91.7 Å²	91.7	26%	0.258	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	151.9	172.2	60.3	0	0	0	0	110.3	F67 R82 R83 R84	F67-T80 HydrophobicContact CD2-CG2 3.95Å; F67-T80 HydrophobicContact CE2-CG2 4.11Å; T80-R82 PolarHBondContact O-N 3.24Å; T80-R83 PolarHBondContact O-N 3.08Å; T80-R84 PolarHBondContact N-O 3.25Å; T80-R84 PolarHBondContact OG1-N 3.05Å; T80-R84 PolarHBondContact OG1-O 3.24Å
81	N	55.3	Low	61.5	Low	103 Å²	103	93.7 Å²	93.7	55%	0.551	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.7	-23.4	170.9	-115.7	-12.8	0	0	0	114.3	S66 R83	S66-N81 WeakPolarHBondContact CB-ND2 3.24Å; S66-N81 WeakPolarHBondContact CB-OD1 3.3Å; S66-N81 PolarHBondContact O-N 3.4Å; S66-N81 PolarHBondContact OG-OD1 3.15Å; N81-R83 VanDerWaalsContact C-N 3.35Å; N81-R83 PolarHBondContact O-N 2.93Å
82	R	56.8	Low	61.1	Low	226 Å²	226	90.8 Å²	90.8	85%	0.853	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	34.7	-178.4	-69	-171	176.7	-175.9	-0.2	114	T80 R84	T80-R82 PolarHBondContact O-N 3.24Å; R82-R84 PolarHBondContact O-N 3.23Å; R82-R84 VanDerWaalsContact O-N 3.08Å
83	R	55.1	Low	60.8	Low	249 Å²	249	85.6 Å²	85.6	94%	0.94	46%	0.462	S	S	*	.	S	Bend	trans	57.6	20.3	175.6	-57.1	-176	-178.2	-175.7	0.7	115.3	T80 N81	T80-R83 PolarHBondContact O-N 3.08Å; N81-R83 VanDerWaalsContact C-N 3.35Å; N81-R83 PolarHBondContact O-N 2.93Å
84	R	60.4	Low	60.6	Low	192 Å²	192	90 Å²	90	73%	0.725	46%	0.456	S	S	*	.			trans	-97.2	102	170.5	-63.6	-171.3	177.6	-158.3	0.1	108.6	T80 R82	T80-R84 PolarHBondContact N-O 3.25Å; T80-R84 PolarHBondContact OG1-N 3.05Å; T80-R84 PolarHBondContact OG1-O 3.24Å; R82-R84 PolarHBondContact O-N 3.23Å; R82-R84 VanDerWaalsContact O-N 3.08Å
85	Q	66.3	Low	60.2	Low	142 Å²	142	90.5 Å²	90.5	66%	0.664	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	130.8	162.3	-174.6	177.5	5.8	0	0	107.9	F78	F78-Q85 CarbonylContact O-C 3.58Å; F78-Q85 VanDerWaalsContact O-CA 3.25Å; F78-Q85 WeakPolarHBondContact O-CA 3.35Å
86	G	65.4	Low	59.9	Low	17 Å²	17	93.6 Å²	93.6	18%	0.175	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	146.4	170.8	0	0	0	0	0	110.6	T77 F78	T77-G86 CarbonylContact C-O 3.59Å; T77-G86 VanDerWaalsContact CA-O 3.3Å; T77-G86 WeakPolarHBondContact CA-O 3.43Å; F78-G86 WeakPolarHBondContact CD1-O 3.27Å; F78-G86 PolarHBondContact N-O 3.48Å; F78-G86 PolarHBondContact O-N 3Å
87	T	60.7	Low	59.4	Low	89 Å²	89	100.2 Å²	100.2	55%	0.546	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	130.4	175	-68	0	0	0	0	107.7	A75 V76 T77	A75-T87 HydrophobicContact CB-CG2 4.2Å; V76-T87 WeakPolarHBondContact O-CA 3.25Å; T77-T87 HydrophobicContact CG2-CG2 4.3Å; T77-T87 WeakPolarHBondContact CG2-OG1 3.06Å
88	T	63.3	Low	58.9	Low	21 Å²	21	103.8 Å²	103.8	13%	0.129	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	127.2	174.9	178.9	0	0	0	0	109.7	A75 V76 T99	A75-T88 CarbonylContact C-O 3.52Å; A75-T88 VanDerWaalsContact CA-O 3.3Å; A75-T88 WeakPolarHBondContact CA-O 3.43Å; V76-T88 HydrophobicContact CB-CG2 3.79Å; V76-T88 PolarHBondContact N-O 3.43Å; V76-T88 PolarHBondContact O-N 2.89Å; T88-T99 HydrophobicContact CG2-CG2 3.76Å; T88-T99 VanDerWaalsContact CG2-OG1 3.23Å; T88-T99 WeakPolarHBondContact CG2-OG1 3.46Å; T88-T99 PolarHBondContact OG1-OG1 3.36Å; T88-T99 VanDerWaalsContact OG1-OG1 3.11Å
89	N	61.4	Low	58.4	Low	82 Å²	82	102.7 Å²	102.7	44%	0.439	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	118	174.5	-71.9	-30	0	0	0	108.9	A75 S91 D92	A75-N89 WeakPolarHBondContact CB-OD1 3.33Å; N89-S91 PolarHBondContact O-N 3.31Å; N89-D92 PolarHBondContact O-N 2.82Å
90	L	56.1	Low	58.1	Low	46 Å²	46	102.4 Å²	102.4	24%	0.241	50%	0.498	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-10.2	177.5	-59.3	171.9	0	0	0	112.9	G74 V76 D92 Q96	G74-L90 WeakPolarHBondContact O-CA 3.27Å; G74-L90 WeakPolarHBondContact O-CB 3.36Å; G74-L90 WeakPolarHBondContact O-CG 3.36Å; G74-L90 PolarHBondContact O-N 3.3Å; V76-L90 HydrophobicContact CG2-CD1 3.59Å; V76-L90 HydrophobicContact CG2-CD2 3.84Å; V76-L90 HydrophobicContact CG2-CG 3.78Å; L90-D92 PolarHBondContact O-N 2.89Å; L90-Q96 PolarHBondContact O-NE2 3.31Å
91	S	59.7	Low	58	Low	94 Å²	94	102.4 Å²	102.4	66%	0.657	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-24.7	176.2	56.5	0	0	0	0	112.7	N89 G93	N89-S91 PolarHBondContact O-N 3.31Å; S91-G93 PolarHBondContact O-N 3.03Å
92	D	56.1	Low	58.1	Low	86 Å²	86	101.4 Å²	101.4	46%	0.46	50%	0.496	S	S	.	.	S	Bend	trans	-92.2	98	176.5	-61.1	-22.8	0	0	0	107.7	N89 L90 K94 N95	N89-D92 PolarHBondContact O-N 2.82Å; L90-D92 PolarHBondContact O-N 2.89Å; D92-K94 PolarHBondContact O-N 2.84Å; D92-N95 HydrophobicContact CB-CB 4.46Å; D92-N95 PolarHBondContact O-N 3.29Å
93	G	52	Low	58.2	Low	59 Å²	59	93.7 Å²	93.7	61%	0.608	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-10.7	-179.1	0	0	0	0	0	115.3	S91	S91-G93 PolarHBondContact O-N 3.03Å
94	K	56.6	Low	58.4	Low	183 Å²	183	88.8 Å²	88.8	80%	0.796	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-31.3	170.4	-69.5	-176.2	178.3	178.5	0	113.2	D92	D92-K94 PolarHBondContact O-N 2.84Å
95	N	55.4	Low	57.9	Low	42 Å²	42	85 Å²	85	23%	0.225	45%	0.447	C	S	.	.	H	α-helix	trans	-85.5	-8.3	-176.4	-64.8	-14.9	0	0	0	112.9	D92 E98 T99	D92-N95 HydrophobicContact CB-CB 4.46Å; D92-N95 PolarHBondContact O-N 3.29Å; N95-E98 PolarHBondContact O-N 3.09Å; N95-T99 VanDerWaalsContact O-CB 3.28Å; N95-T99 WeakPolarHBondContact O-CB 3.32Å; N95-T99 PolarHBondContact O-N 2.86Å; N95-T99 PolarHBondContact O-OG1 2.88Å
96	Q	53.6	Low	57.3	Low	82 Å²	82	81 Å²	81	38%	0.383	44%	0.437	S	S	.	.	H	α-helix	trans	-69.6	-36.7	177.2	-64.7	-176	4.1	0	0	111.8	L90 F100	L90-Q96 PolarHBondContact O-NE2 3.31Å; Q96-F100 WeakPolarHBondContact O-CB 3.41Å; Q96-F100 PolarHBondContact O-N 3.11Å
97	F	54.2	Low	56.7	Low	160 Å²	160	85.5 Å²	85.5	70%	0.702	46%	0.455	S	S	*	.	H	α-helix	trans	-69.8	-38.3	174.1	-169.6	-93.9	0	0	0	111.4	F100 A101	F97-F100 PolarHBondContact O-N 2.57Å; F97-A101 WeakPolarHBondContact O-CB 3.3Å; F97-A101 PolarHBondContact O-N 3.5Å
98	E	55.4	Low	55.9	Low	115 Å²	115	83.8 Å²	83.8	54%	0.537	45%	0.447	S	S	.	.	H	α-helix	trans	-68.8	-40.5	176	-64.4	-176.9	178.4	0	0	111.9	N95 A101 I102	N95-E98 PolarHBondContact O-N 3.09Å; E98-A101 CarbonylContact O-C 3.59Å; E98-A101 PolarHBondContact O-N 3.2Å; E98-I102 WeakPolarHBondContact O-CB 3.48Å; E98-I102 WeakPolarHBondContact O-CG1 3.33Å; E98-I102 PolarHBondContact O-N 3.02Å
99	T	56.9	Low	55.1	Low	25 Å²	25	87.9 Å²	87.9	15%	0.153	47%	0.472	C	S	.	.	H	α-helix	trans	-65.2	-43.3	174.8	-54	0	0	0	0	110.6	T88 N95 I102 L103	T88-T99 HydrophobicContact CG2-CG2 3.76Å; T88-T99 VanDerWaalsContact CG2-OG1 3.23Å; T88-T99 WeakPolarHBondContact CG2-OG1 3.46Å; T88-T99 PolarHBondContact OG1-OG1 3.36Å; T88-T99 VanDerWaalsContact OG1-OG1 3.11Å; N95-T99 VanDerWaalsContact O-CB 3.28Å; N95-T99 WeakPolarHBondContact O-CB 3.32Å; N95-T99 PolarHBondContact O-N 2.86Å; N95-T99 PolarHBondContact O-OG1 2.88Å; T99-I102 PolarHBondContact O-N 3.36Å; T99-L103 VanDerWaalsContact O-CB 3.23Å; T99-L103 WeakPolarHBondContact O-CB 3.38Å; T99-L103 PolarHBondContact O-N 3.35Å
100	F	58.3	Low	54.2	Low	96 Å²	96	94.3 Å²	94.3	42%	0.421	49%	0.49	S	S	.	.	H	α-helix	trans	-64.1	-39.5	172.4	-178.8	-98.6	0	0	0	112	L21 Q96 F97 L103 R104	L21-F100 HydrophobicContact CD2-CD2 3.9Å; L21-F100 HydrophobicContact CD2-CE2 4.12Å; Q96-F100 WeakPolarHBondContact O-CB 3.41Å; Q96-F100 PolarHBondContact O-N 3.11Å; F97-F100 PolarHBondContact O-N 2.57Å; F100-L103 PolarHBondContact O-N 3.17Å; F100-R104 WeakPolarHBondContact O-CB 3.21Å; F100-R104 PolarHBondContact O-N 3.49Å
101	A	59.2	Low	53.2	Low	41 Å²	41	98.5 Å²	98.5	34%	0.339	52%	0.517	S	S	.	.	H	α-helix	trans	-67.4	-42.8	177.1	0	0	0	0	0	111.2	F97 E98 R104 L105	F97-A101 WeakPolarHBondContact O-CB 3.3Å; F97-A101 PolarHBondContact O-N 3.5Å; E98-A101 CarbonylContact O-C 3.59Å; E98-A101 PolarHBondContact O-N 3.2Å; A101-R104 CarbonylContact O-C 3.57Å; A101-R104 PolarHBondContact O-N 2.94Å; A101-L105 WeakPolarHBondContact O-CA 3.38Å; A101-L105 WeakPolarHBondContact O-CB 3.34Å; A101-L105 PolarHBondContact O-N 3.31Å
102	I	57.7	Low	52.1	Low	83 Å²	83	103.5 Å²	103.5	43%	0.426	53%	0.528	S	S	.	.	H	α-helix	trans	-65	-43.8	175.1	-69.1	163.6	0	0	0	110.4	E98 T99 L105 A106	E98-I102 WeakPolarHBondContact O-CB 3.48Å; E98-I102 WeakPolarHBondContact O-CG1 3.33Å; E98-I102 PolarHBondContact O-N 3.02Å; T99-I102 PolarHBondContact O-N 3.36Å; I102-L105 PolarHBondContact O-N 3.18Å; I102-A106 WeakPolarHBondContact O-CB 3.33Å; I102-A106 PolarHBondContact O-N 2.87Å
103	L	59.2	Low	51	Low	63 Å²	63	106.7 Å²	106.7	33%	0.33	54%	0.543	S	S	.	.	H	α-helix	trans	-62.4	-44	175.5	-161.1	87.8	0	0	0	110.9	I69 T99 F100 M107	I69-L103 HydrophobicContact CD1-CD1 3.63Å; T99-L103 VanDerWaalsContact O-CB 3.23Å; T99-L103 WeakPolarHBondContact O-CB 3.38Å; T99-L103 PolarHBondContact O-N 3.35Å; F100-L103 PolarHBondContact O-N 3.17Å; L103-M107 HydrophobicContact CG-SD 4.4Å; L103-M107 WeakPolarHBondContact O-CB 3.07Å; L103-M107 VanDerWaalsContact O-CG 3.27Å; L103-M107 WeakPolarHBondContact O-CG 3.08Å; L103-M107 PolarHBondContact O-N 3.16Å
104	R	57.5	Low	50.3	Low	146 Å²	146	108.5 Å²	108.5	55%	0.551	54%	0.544	S	S	*	.	H	α-helix	trans	-67.1	-40	176.1	-179.7	59.4	178.7	157.5	1.5	111.8	F100 A101 M107 S108	F100-R104 WeakPolarHBondContact O-CB 3.21Å; F100-R104 PolarHBondContact O-N 3.49Å; A101-R104 CarbonylContact O-C 3.57Å; A101-R104 PolarHBondContact O-N 2.94Å; R104-M107 CarbonylContact O-C 3.56Å; R104-M107 PolarHBondContact O-N 2.82Å; R104-S108 WeakPolarHBondContact O-CA 3.16Å; R104-S108 WeakPolarHBondContact O-CB 3.21Å; R104-S108 PolarHBondContact O-N 3.02Å; R104-S108 PolarHBondContact O-OG 2.74Å
105	L	51.3	Low	49.2	Very low	114 Å²	114	107.9 Å²	107.9	60%	0.597	55%	0.549	S	S	*	.	H	α-helix	trans	-67.6	-45.6	179.1	-159.2	92	0	0	0	109.9	A101 I102 M107 S108 T109	A101-L105 WeakPolarHBondContact O-CA 3.38Å; A101-L105 WeakPolarHBondContact O-CB 3.34Å; A101-L105 PolarHBondContact O-N 3.31Å; I102-L105 PolarHBondContact O-N 3.18Å; L105-M107 VanDerWaalsContact C-N 3.28Å; L105-M107 PolarHBondContact O-N 3.34Å; L105-S108 CarbonylContact O-C 3.52Å; L105-S108 PolarHBondContact O-N 3.38Å; L105-S108 VanDerWaalsContact O-N 3.17Å; L105-T109 WeakPolarHBondContact O-CG2 3.41Å; L105-T109 PolarHBondContact O-N 3.46Å; L105-T109 PolarHBondContact O-OG1 2.79Å
106	A	53.4	Low	48.4	Very low	56 Å²	56	109.4 Å²	109.4	46%	0.463	58%	0.576	S	S	.	*	H	α-helix	trans	-62.4	-34.6	175	0	0	0	0	0	112.3	I102 T109	I102-A106 WeakPolarHBondContact O-CB 3.33Å; I102-A106 PolarHBondContact O-N 2.87Å; A106-T109 PolarHBondContact O-OG1 2.97Å
107	M	52.4	Low	47.8	Very low	112 Å²	112	113.9 Å²	113.9	55%	0.552	60%	0.597	S	S	*	*	H	α-helix	trans	-83	-21.8	174.3	-72.3	174.2	40.5	0	0	113.9	L103 R104 L105	L103-M107 HydrophobicContact CG-SD 4.4Å; L103-M107 WeakPolarHBondContact O-CB 3.07Å; L103-M107 VanDerWaalsContact O-CG 3.27Å; L103-M107 WeakPolarHBondContact O-CG 3.08Å; L103-M107 PolarHBondContact O-N 3.16Å; R104-M107 CarbonylContact O-C 3.56Å; R104-M107 PolarHBondContact O-N 2.82Å; L105-M107 VanDerWaalsContact C-N 3.28Å; L105-M107 PolarHBondContact O-N 3.34Å
108	S	43.9	Very low	47.2	Very low	54 Å²	54	116.2 Å²	116.2	38%	0.378	61%	0.606	S	S	.	*	H	α-helix	trans	-100.7	-6	-177.8	77	0	0	0	0	113.9	R104 L105 R110	R104-S108 WeakPolarHBondContact O-CA 3.16Å; R104-S108 WeakPolarHBondContact O-CB 3.21Å; R104-S108 PolarHBondContact O-N 3.02Å; R104-S108 PolarHBondContact O-OG 2.74Å; L105-S108 CarbonylContact O-C 3.52Å; L105-S108 PolarHBondContact O-N 3.38Å; L105-S108 VanDerWaalsContact O-N 3.17Å; S108-R110 PolarHBondContact O-N 3.32Å
109	T	45.9	Very low	46.3	Very low	106 Å²	106	116.8 Å²	116.8	65%	0.65	62%	0.618	S	S	*	*			trans	-72.2	58.8	166	45.8	0	0	0	0	110.8	L105 A106	L105-T109 WeakPolarHBondContact O-CG2 3.41Å; L105-T109 PolarHBondContact O-N 3.46Å; L105-T109 PolarHBondContact O-OG1 2.79Å; A106-T109 PolarHBondContact O-OG1 2.97Å
110	R	42.8	Very low	45.7	Very low	218 Å²	218	124.2 Å²	124.2	82%	0.823	67%	0.67	S	S	*	*	S	Bend	trans	-85.7	124.6	138.4	-75.2	179.3	172.3	-176.9	-3.4	104.4	S108	S108-R110 PolarHBondContact O-N 3.32Å
111	T	34.6	Very low	45	Very low	133 Å²	133	125.6 Å²	125.6	82%	0.816	68%	0.683	S	S	*	*	S	Bend	trans	67.4	92.9	167.6	57.5	0	0	0	0	119
112	F	37.8	Very low	44.3	Very low	200 Å²	200	130.1 Å²	130.1	88%	0.877	70%	0.701	S	S	*	*				-171.6	80.9	128.1	-116.5	-84.8	0	0	0	108.3
113	I	33.1	Very low	43.5	Very low	153 Å²	153	132.7 Å²	132.7	79%	0.785	72%	0.716	S	S	*	*			trans	-89.1	113	158	-61.3	172	0	0	0	103.5	D115	I113-D115 PolarHBondContact O-N 2.96Å
114	P	37.8	Very low	42.6	Very low	96 Å²	96	136.8 Å²	136.8	62%	0.623	74%	0.739	S	S	*	*			trans	-63.7	109.7	166.7	25.7	-28.4	0	0	0	106.6	G116	P114-G116 PolarHBondContact O-N 3.23Å
115	D	33.4	Very low	41.7	Very low	170 Å²	170	136.2 Å²	136.2	91%	0.909	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.2	109.4	165.5	-87.4	-38.2	0	0	0	108.1	I113	I113-D115 PolarHBondContact O-N 2.96Å
116	G	38.8	Very low	41.1	Very low	75 Å²	75	137.7 Å²	137.7	77%	0.773	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	141.8	-7.7	162.6	0	0	0	0	0	120.3	P114 K118	P114-G116 PolarHBondContact O-N 3.23Å; G116-K118 PolarHBondContact O-N 3.16Å
117	E	40.1	Very low	40.2	Very low	176 Å²	176	143.5 Å²	143.5	82%	0.822	78%	0.782	S	S	*	*			trans	-89.5	95.1	-179.8	-139.4	179	-163.5	0	0	112.3	V119	E117-V119 PolarHBondContact O-N 2.84Å
118	K	41.8	Very low	39.2	Very low	208 Å²	208	145.9 Å²	145.9	90%	0.904	80%	0.8	S	S	*	*			trans	-70.1	105.2	161.9	-72.5	-172.6	178.7	-177.5	0	108.1	G116	G116-K118 PolarHBondContact O-N 3.16Å
119	V	37	Very low	38.8	Very low	128 Å²	128	153.6 Å²	153.6	78%	0.776	84%	0.835	S	S	*	*			trans	-82.6	123.2	164.9	-170.3	0	0	0	0	107.5	E117	E117-V119 PolarHBondContact O-N 2.84Å
120	S	42.8	Very low	38.2	Very low	180 Å²	180	157.9 Å²	157.9	100%	1.259	85%	0.852	S	S	*	*			trans	-56.3	0	173.5	174.2	0	0	0	0	113.2

Retrieved 120 of 120 residues in 71.7 ms (Link to these results)

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