A0A077ZG72_TRITR Loading...

CBFD NFYB HMF domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZG72, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 157 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	62.5	Low	87.5	Confident	127 Å²	127	74.1 Å²	74.1	63%	0.626	42%	0.417	S	S	*	.				0	116.5	0	-67.6	-76.6	-91.3	0	0	107.1	L3 E27 A30 K31	M1-L3 VanDerWaalsContact C-N 3.31Å; M1-E27 HydrophobicContact CE-CB 4.47Å; M1-E27 WeakPolarHBondContact CE-O 3.23Å; M1-A30 HydrophobicContact CE-CB 3.44Å; M1-A30 VanDerWaalsContact CE-CB 3.44Å; M1-K31 HydrophobicContact CE-CB 4.17Å; M1-K31 HydrophobicContact SD-CB 4.16Å; M1-K31 HydrophobicContact SD-CD 4.16Å
2	A	81.6	Confident	87.8	Confident	83 Å²	83	71.6 Å²	71.6	69%	0.686	40%	0.4	S	S	*	.			trans	-73.5	-25.5	-178.1	0	0	0	0	0	112.8	E34	A2-E34 PolarHBondContact N-OE2 2.9Å
3	L	89.5	Confident	87.8	Confident	50 Å²	50	70.5 Å²	70.5	26%	0.262	40%	0.401	S	S	.	.	S	Bend	trans	-100.4	131.5	-176.2	-61.9	173	0	0	0	111.6	M1 T5 V8 A30 T33	M1-L3 VanDerWaalsContact C-N 3.31Å; L3-T5 PolarHBondContact O-N 3.41Å; L3-V8 HydrophobicContact CB-CG2 4.35Å; L3-A30 HydrophobicContact CB-CB 4.43Å; L3-T33 HydrophobicContact CD1-CG2 3.4Å
4	P	92.2	Very high	87.6	Confident	70 Å²	70	74.3 Å²	74.3	46%	0.455	42%	0.415	S	S	.	.			trans	-69	124.6	178.1	24.2	-29.8	0	0	0	111.2	S6 T7 V8	P4-S6 PolarHBondContact O-N 3.27Å; P4-T7 PolarHBondContact O-N 3.29Å; P4-T7 VanDerWaalsContact O-N 3.12Å; P4-V8 PolarHBondContact O-N 2.7Å; P4-V8 VanDerWaalsContact O-N 3.15Å
5	T	91.8	Very high	87.1	Confident	61 Å²	61	75.5 Å²	75.5	37%	0.374	44%	0.438	S	S	.	.	H	α-helix	trans	-62.2	-29.4	-178.2	52.4	0	0	0	0	112.8	L3 V8 K9 E27	L3-T5 PolarHBondContact O-N 3.41Å; T5-V8 PolarHBondContact O-N 3.17Å; T5-K9 VanDerWaalsContact O-CB 3.25Å; T5-K9 WeakPolarHBondContact O-CB 3.36Å; T5-K9 PolarHBondContact O-N 3.46Å; T5-E27 HydrophobicContact CG2-CG 3.9Å
6	S	90.8	Very high	86.2	Confident	86 Å²	86	74.2 Å²	74.2	60%	0.601	44%	0.435	S	S	*	.	H	α-helix	trans	-62.5	-44.1	173.9	53.7	0	0	0	0	112.4	P4 R10	P4-S6 PolarHBondContact O-N 3.27Å; S6-R10 WeakPolarHBondContact O-CB 3.22Å; S6-R10 PolarHBondContact O-N 3.23Å
7	T	91.1	Very high	85	Confident	46 Å²	46	78.4 Å²	78.4	28%	0.282	46%	0.455	S	S	.	.	H	α-helix	trans	-66.6	-44.2	176.1	-61.6	0	0	0	0	111.1	P4 R10 I11	P4-T7 PolarHBondContact O-N 3.29Å; P4-T7 VanDerWaalsContact O-N 3.12Å; T7-R10 PolarHBondContact O-N 2.96Å; T7-I11 HydrophobicContact CG2-CD1 3.9Å; T7-I11 WeakPolarHBondContact O-CG1 3.48Å; T7-I11 PolarHBondContact O-N 3.13Å
8	V	92.5	Very high	83.8	Confident	15 Å²	15	80.7 Å²	80.7	9%	0.091	47%	0.473	C	S	.	.	H	α-helix	trans	-60.8	-47.2	177.5	175.7	0	0	0	0	110.5	L3 P4 T5 R10 I11 M12 M29 A30	L3-V8 HydrophobicContact CB-CG2 4.35Å; P4-V8 PolarHBondContact O-N 2.7Å; P4-V8 VanDerWaalsContact O-N 3.15Å; T5-V8 PolarHBondContact O-N 3.17Å; V8-R10 VanDerWaalsContact C-N 3.33Å; V8-R10 PolarHBondContact O-N 2.88Å; V8-I11 PolarHBondContact O-N 3.16Å; V8-M12 HydrophobicContact CG1-CG 4.34Å; V8-M12 HydrophobicContact CG1-SD 3.93Å; V8-M12 VanDerWaalsContact O-CG 3.29Å; V8-M12 WeakPolarHBondContact O-CG 3.26Å; V8-M12 PolarHBondContact O-N 3.21Å; V8-M29 HydrophobicContact CG1-CB 3.79Å; V8-M29 HydrophobicContact CG1-CG 3.73Å; V8-A30 HydrophobicContact CG2-CB 3.99Å
9	K	91	Very high	83.1	Confident	95 Å²	95	83.5 Å²	83.5	41%	0.413	49%	0.485	S	S	.	.	H	α-helix	trans	-58.1	-44.2	176.3	-172.8	173.7	-178.8	172	0	112	T5 M12 S13 V21 A26	T5-K9 VanDerWaalsContact O-CB 3.25Å; T5-K9 WeakPolarHBondContact O-CB 3.36Å; T5-K9 PolarHBondContact O-N 3.46Å; K9-M12 PolarHBondContact O-N 2.86Å; K9-S13 WeakPolarHBondContact O-CB 3.46Å; K9-S13 PolarHBondContact O-N 3.09Å; K9-S13 PolarHBondContact O-OG 3.05Å; K9-S13 VanDerWaalsContact O-OG 3.14Å; K9-V21 VanDerWaalsContact CE-O 3.27Å; K9-V21 WeakPolarHBondContact CE-O 3.32Å; K9-V21 HydrophobicContact CG-CB 4.08Å; K9-V21 HydrophobicContact CG-CG1 4.16Å; K9-V21 PolarHBondContact NZ-O 3.37Å; K9-A26 HydrophobicContact CB-CB 4.12Å
10	R	89.3	Confident	83.2	Confident	100 Å²	100	91.9 Å²	91.9	38%	0.377	51%	0.508	S	S	.	.	H	α-helix	trans	-59	-47.9	176.4	178.6	175.1	59	163.9	0.3	111.8	S6 T7 V8 S13 M14 L88	S6-R10 WeakPolarHBondContact O-CB 3.22Å; S6-R10 PolarHBondContact O-N 3.23Å; T7-R10 PolarHBondContact O-N 2.96Å; V8-R10 VanDerWaalsContact C-N 3.33Å; V8-R10 PolarHBondContact O-N 2.88Å; R10-S13 PolarHBondContact O-N 3.05Å; R10-M14 WeakPolarHBondContact O-CG 3.11Å; R10-M14 PolarHBondContact O-N 3.34Å; R10-L88 PolarHBondContact NH1-O 3.49Å; R10-L88 PolarHBondContact NH2-O 3.4Å
11	I	90.1	Very high	83.5	Confident	82 Å²	82	88.3 Å²	88.3	42%	0.421	49%	0.489	S	S	.	.	H	α-helix	trans	-62.8	-44.1	178.1	-66.4	166.1	0	0	0	110.7	T7 V8 S13 M14 A15 L88	T7-I11 HydrophobicContact CG2-CD1 3.9Å; T7-I11 WeakPolarHBondContact O-CG1 3.48Å; T7-I11 PolarHBondContact O-N 3.13Å; V8-I11 PolarHBondContact O-N 3.16Å; I11-S13 VanDerWaalsContact C-N 3.31Å; I11-S13 PolarHBondContact O-N 3.31Å; I11-M14 WeakPolarHBondContact O-CB 3.44Å; I11-M14 PolarHBondContact O-N 3.1Å; I11-A15 PolarHBondContact O-N 2.9Å; I11-L88 HydrophobicContact CD1-CD1 4.49Å; I11-L88 HydrophobicContact CG1-CD1 4.39Å
12	M	90.9	Very high	84.9	Confident	44 Å²	44	85.4 Å²	85.4	22%	0.217	48%	0.481	C	S	.	.	H	α-helix	trans	-60.8	-40.5	178	-70.8	176.9	75.5	0	0	112.2	V8 K9 M14 A15 S16 V21 A25 M29	V8-M12 HydrophobicContact CG1-CG 4.34Å; V8-M12 HydrophobicContact CG1-SD 3.93Å; V8-M12 VanDerWaalsContact O-CG 3.29Å; V8-M12 WeakPolarHBondContact O-CG 3.26Å; V8-M12 PolarHBondContact O-N 3.21Å; K9-M12 PolarHBondContact O-N 2.86Å; M12-M14 PolarHBondContact O-N 2.96Å; M12-A15 PolarHBondContact O-N 3.48Å; M12-S16 PolarHBondContact O-N 3.46Å; M12-S16 VanDerWaalsContact O-N 3.13Å; M12-S16 PolarHBondContact O-OG 3.43Å; M12-V21 HydrophobicContact CB-CG1 4.28Å; M12-V21 HydrophobicContact CB-CG2 3.9Å; M12-V21 HydrophobicContact CE-CG1 3.76Å; M12-V21 HydrophobicContact SD-CG1 3.83Å; M12-A25 HydrophobicContact CE-CB 4.25Å; M12-M29 HydrophobicContact CE-CB 4.35Å; M12-M29 HydrophobicContact CG-CG 4.37Å; M12-M29 HydrophobicContact SD-CB 3.76Å; M12-M29 HydrophobicContact SD-CG 3.93Å
13	S	88.2	Confident	85.4	Confident	58 Å²	58	88.8 Å²	88.8	41%	0.406	48%	0.48	S	S	.	.	H	α-helix	trans	-69.1	-15.2	176.3	-65.5	0	0	0	0	114.1	K9 R10 I11	K9-S13 WeakPolarHBondContact O-CB 3.46Å; K9-S13 PolarHBondContact O-N 3.09Å; K9-S13 PolarHBondContact O-OG 3.05Å; K9-S13 VanDerWaalsContact O-OG 3.14Å; R10-S13 PolarHBondContact O-N 3.05Å; I11-S13 VanDerWaalsContact C-N 3.31Å; I11-S13 PolarHBondContact O-N 3.31Å
14	M	85.5	Confident	85.7	Confident	123 Å²	123	93.6 Å²	93.6	61%	0.606	50%	0.501	S	S	*	.	H	α-helix	trans	-81.4	-34.2	172.1	-66.7	174.5	68.9	0	0	112.2	R10 I11 M12 L88	R10-M14 WeakPolarHBondContact O-CG 3.11Å; R10-M14 PolarHBondContact O-N 3.34Å; I11-M14 WeakPolarHBondContact O-CB 3.44Å; I11-M14 PolarHBondContact O-N 3.1Å; M12-M14 PolarHBondContact O-N 2.96Å; M14-L88 HydrophobicContact SD-CD2 4.19Å
15	A	79.4	Confident	85.7	Confident	92 Å²	92	91.9 Å²	91.9	76%	0.76	49%	0.493	S	S	*	.	H	α-helix	trans	-83.8	-25.2	-177.9	0	0	0	0	0	113	I11 M12	I11-A15 PolarHBondContact O-N 2.9Å; M12-A15 PolarHBondContact O-N 3.48Å
16	S	72.2	Confident	85.8	Confident	55 Å²	55	89.1 Å²	89.1	39%	0.385	48%	0.477	S	S	.	.	S	Bend	trans	-106.9	121.7	179.7	-51.8	0	0	0	0	109	M12	M12-S16 PolarHBondContact O-N 3.46Å; M12-S16 VanDerWaalsContact O-N 3.13Å; M12-S16 PolarHBondContact O-OG 3.43Å
17	D	67.4	Low	86	Confident	146 Å²	146	88.7 Å²	88.7	78%	0.781	47%	0.465	S	S	*	.	S	Bend	trans	-42	149.8	160.1	-153.9	25.9	0	0	0	109.2	L19	D17-L19 PolarHBondContact O-N 3.42Å
18	P	62	Low	86.3	Confident	119 Å²	119	89.3 Å²	89.3	77%	0.773	48%	0.475	S	S	*	.	S	Bend	trans	-65.3	50.8	-141.8	29.3	-38.4	0	0	0	117.1
19	L	70.7	Confident	86.4	Confident	135 Å²	135	92.2 Å²	92.2	71%	0.707	49%	0.489	S	S	*	.			trans	-76.4	129.2	172.4	-66.8	177.3	0	0	0	107.9	D17 V21	D17-L19 PolarHBondContact O-N 3.42Å; L19-V21 PolarHBondContact O-N 2.93Å
20	R	85.2	Confident	86.6	Confident	251 Å²	251	87.8 Å²	87.8	95%	0.947	47%	0.469	S	S	*	.			trans	-61.8	110.4	174	-70.2	-178.8	169.1	-161.5	-2.6	108.8	S22	R20-S22 PolarHBondContact O-N 3.1Å
21	V	89	Confident	86.9	Confident	17 Å²	17	87.3 Å²	87.3	10%	0.103	47%	0.47	C	S	.	.			trans	-69.2	118.8	171.3	179.5	0	0	0	0	108.7	K9 M12 L19 A25 A26	K9-V21 VanDerWaalsContact CE-O 3.27Å; K9-V21 WeakPolarHBondContact CE-O 3.32Å; K9-V21 HydrophobicContact CG-CB 4.08Å; K9-V21 HydrophobicContact CG-CG1 4.16Å; K9-V21 PolarHBondContact NZ-O 3.37Å; M12-V21 HydrophobicContact CB-CG1 4.28Å; M12-V21 HydrophobicContact CB-CG2 3.9Å; M12-V21 HydrophobicContact CE-CG1 3.76Å; M12-V21 HydrophobicContact SD-CG1 3.83Å; L19-V21 PolarHBondContact O-N 2.93Å; V21-A25 HydrophobicContact CG1-CB 4.32Å; V21-A26 HydrophobicContact CG1-CB 4.31Å
22	S	92.1	Very high	87.2	Confident	65 Å²	65	85.5 Å²	85.5	46%	0.455	47%	0.467	S	S	.	.			trans	-66.3	155.8	176.4	74.5	0	0	0	0	110.9	R20 E24 A25 A26	R20-S22 PolarHBondContact O-N 3.1Å; S22-E24 VanDerWaalsContact C-N 3.32Å; S22-E24 PolarHBondContact O-N 3.47Å; S22-A25 PolarHBondContact O-N 2.98Å; S22-A25 VanDerWaalsContact OG-CB 3.25Å; S22-A25 WeakPolarHBondContact OG-CB 3.4Å; S22-A25 PolarHBondContact OG-N 3.29Å; S22-A25 VanDerWaalsContact OG-N 3.1Å; S22-A26 PolarHBondContact O-N 3.17Å; S22-A26 VanDerWaalsContact O-N 3.15Å
23	K	92.7	Very high	87.5	Confident	154 Å²	154	85.6 Å²	85.6	67%	0.67	47%	0.471	S	S	*	.	H	α-helix	trans	-61.5	-43.6	177.2	179.6	179.2	167.7	-175.1	0	111.1	A25 A26 E27	K23-A25 PolarHBondContact O-N 3.19Å; K23-A26 PolarHBondContact O-N 3.05Å; K23-E27 WeakPolarHBondContact CE-OE1 3.47Å; K23-E27 IonicContact NZ-OE1 3.83Å; K23-E27 WeakPolarHBondContact O-CG 3.31Å; K23-E27 PolarHBondContact O-N 2.74Å
24	E	94.9	Very high	87.8	Confident	151 Å²	151	84.4 Å²	84.4	71%	0.706	46%	0.458	S	S	*	.	H	α-helix	trans	-59.8	-43.5	177.4	-175.4	-179.7	-172.2	0	0	111.8	S22 A26 E27 A28	S22-E24 VanDerWaalsContact C-N 3.32Å; S22-E24 PolarHBondContact O-N 3.47Å; E24-A26 VanDerWaalsContact C-N 3.34Å; E24-A26 PolarHBondContact O-N 2.95Å; E24-E27 PolarHBondContact O-N 2.88Å; E24-A28 WeakPolarHBondContact O-CB 3.41Å; E24-A28 PolarHBondContact O-N 2.74Å
25	A	93.4	Very high	88.3	Confident	35 Å²	35	82.9 Å²	82.9	29%	0.289	45%	0.453	S	S	.	.	H	α-helix	trans	-62.5	-41.1	176.6	0	0	0	0	0	112	M12 V21 S22 K23 M29	M12-A25 HydrophobicContact CE-CB 4.25Å; V21-A25 HydrophobicContact CG1-CB 4.32Å; S22-A25 PolarHBondContact O-N 2.98Å; S22-A25 VanDerWaalsContact OG-CB 3.25Å; S22-A25 WeakPolarHBondContact OG-CB 3.4Å; S22-A25 PolarHBondContact OG-N 3.29Å; S22-A25 VanDerWaalsContact OG-N 3.1Å; K23-A25 PolarHBondContact O-N 3.19Å; A25-M29 VanDerWaalsContact O-CB 3.27Å; A25-M29 WeakPolarHBondContact O-CB 3.44Å; A25-M29 PolarHBondContact O-N 3.3Å
26	A	93.4	Very high	89.1	Confident	3 Å²	3	81.6 Å²	81.6	3%	0.025	43%	0.43	C	S	.	.	H	α-helix	trans	-66.6	-37.1	176.3	0	0	0	0	0	112.5	K9 V21 S22 K23 E24 A30	K9-A26 HydrophobicContact CB-CB 4.12Å; V21-A26 HydrophobicContact CG1-CB 4.31Å; S22-A26 PolarHBondContact O-N 3.17Å; S22-A26 VanDerWaalsContact O-N 3.15Å; K23-A26 PolarHBondContact O-N 3.05Å; E24-A26 VanDerWaalsContact C-N 3.34Å; E24-A26 PolarHBondContact O-N 2.95Å; A26-A30 WeakPolarHBondContact O-CB 3.45Å; A26-A30 PolarHBondContact O-N 3.15Å
27	E	95.4	Very high	90.2	Very high	76 Å²	76	82.9 Å²	82.9	36%	0.355	43%	0.431	S	S	.	.	H	α-helix	trans	-69.3	-46.5	175.3	-74.5	174	174.2	0	0	111.9	M1 T5 K23 E24 M29 A30 K31	M1-E27 HydrophobicContact CE-CB 4.47Å; M1-E27 WeakPolarHBondContact CE-O 3.23Å; T5-E27 HydrophobicContact CG2-CG 3.9Å; K23-E27 WeakPolarHBondContact CE-OE1 3.47Å; K23-E27 IonicContact NZ-OE1 3.83Å; K23-E27 WeakPolarHBondContact O-CG 3.31Å; K23-E27 PolarHBondContact O-N 2.74Å; E24-E27 PolarHBondContact O-N 2.88Å; E27-M29 VanDerWaalsContact C-N 3.27Å; E27-M29 PolarHBondContact O-N 3.23Å; E27-A30 PolarHBondContact O-N 2.91Å; E27-K31 PolarHBondContact O-N 3.46Å
28	A	96.1	Very high	91.5	Very high	60 Å²	60	81.4 Å²	81.4	50%	0.496	42%	0.42	S	S	.	.	H	α-helix	trans	-58.1	-43.3	174.6	0	0	0	0	0	110.9	E24 K31 A32	E24-A28 WeakPolarHBondContact O-CB 3.41Å; E24-A28 PolarHBondContact O-N 2.74Å; A28-K31 PolarHBondContact O-N 2.6Å; A28-A32 WeakPolarHBondContact O-CB 3.38Å; A28-A32 PolarHBondContact O-N 3.39Å
29	M	95.2	Very high	93.1	Very high	76 Å²	76	79.3 Å²	79.3	37%	0.374	40%	0.402	S	S	.	.	H	α-helix	trans	-66.8	-43.3	178.1	-172.6	80.4	-66.5	0	0	112.3	V8 M12 A25 E27 K31 A32 T33	V8-M29 HydrophobicContact CG1-CB 3.79Å; V8-M29 HydrophobicContact CG1-CG 3.73Å; M12-M29 HydrophobicContact CE-CB 4.35Å; M12-M29 HydrophobicContact CG-CG 4.37Å; M12-M29 HydrophobicContact SD-CB 3.76Å; M12-M29 HydrophobicContact SD-CG 3.93Å; A25-M29 VanDerWaalsContact O-CB 3.27Å; A25-M29 WeakPolarHBondContact O-CB 3.44Å; A25-M29 PolarHBondContact O-N 3.3Å; E27-M29 VanDerWaalsContact C-N 3.27Å; E27-M29 PolarHBondContact O-N 3.23Å; M29-K31 PolarHBondContact O-N 3.42Å; M29-A32 HydrophobicContact CE-CB 3.52Å; M29-A32 PolarHBondContact O-N 2.89Å; M29-T33 WeakPolarHBondContact O-CB 3.26Å; M29-T33 PolarHBondContact O-N 2.99Å; M29-T33 PolarHBondContact O-OG1 3.35Å
30	A	95.7	Very high	94.3	Very high	1 Å²	1	73.8 Å²	73.8	1%	0.008	37%	0.373	C	S	.	.	H	α-helix	trans	-58.3	-38.6	174.7	0	0	0	0	0	111.8	M1 L3 V8 A26 E27 E34	M1-A30 HydrophobicContact CE-CB 3.44Å; M1-A30 VanDerWaalsContact CE-CB 3.44Å; L3-A30 HydrophobicContact CB-CB 4.43Å; V8-A30 HydrophobicContact CG2-CB 3.99Å; A26-A30 WeakPolarHBondContact O-CB 3.45Å; A26-A30 PolarHBondContact O-N 3.15Å; E27-A30 PolarHBondContact O-N 2.91Å; A30-E34 PolarHBondContact O-N 3.46Å; A30-E34 VanDerWaalsContact O-N 3.12Å
31	K	96.3	Very high	94.7	Very high	91 Å²	91	65.1 Å²	65.1	40%	0.396	35%	0.348	S	S	.	.	H	α-helix	trans	-71.6	-42.7	176.9	-173.6	62.3	-174.5	173.9	0	112.3	M1 E27 A28 M29 T33 E34 L35	M1-K31 HydrophobicContact CE-CB 4.17Å; M1-K31 HydrophobicContact SD-CB 4.16Å; M1-K31 HydrophobicContact SD-CD 4.16Å; E27-K31 PolarHBondContact O-N 3.46Å; A28-K31 PolarHBondContact O-N 2.6Å; M29-K31 PolarHBondContact O-N 3.42Å; K31-T33 VanDerWaalsContact C-N 3.32Å; K31-T33 PolarHBondContact O-N 3.47Å; K31-E34 IonicContact NZ-OE1 3.68Å; K31-E34 PolarHBondContact NZ-OE1 3.48Å; K31-E34 WeakPolarHBondContact O-CB 3.47Å; K31-E34 PolarHBondContact O-N 3.15Å; K31-L35 WeakPolarHBondContact O-CG 3.25Å; K31-L35 PolarHBondContact O-N 2.81Å
32	A	96.2	Very high	95	Very high	43 Å²	43	66.2 Å²	66.2	36%	0.355	36%	0.363	S	S	.	.	H	α-helix	trans	-62.4	-39.7	176.5	0	0	0	0	0	111.7	A28 M29 L35 F36	A28-A32 WeakPolarHBondContact O-CB 3.38Å; A28-A32 PolarHBondContact O-N 3.39Å; M29-A32 HydrophobicContact CE-CB 3.52Å; M29-A32 PolarHBondContact O-N 2.89Å; A32-L35 PolarHBondContact O-N 3.06Å; A32-F36 VanDerWaalsContact O-CB 3.29Å; A32-F36 WeakPolarHBondContact O-CB 3.43Å; A32-F36 PolarHBondContact O-N 2.89Å
33	T	95.8	Very high	95.1	Very high	47 Å²	47	65.5 Å²	65.5	29%	0.288	35%	0.352	S	S	.	.	H	α-helix	trans	-65.4	-38.8	174.3	-55.4	0	0	0	0	111.9	L3 M29 K31 F36 I37	L3-T33 HydrophobicContact CD1-CG2 3.4Å; M29-T33 WeakPolarHBondContact O-CB 3.26Å; M29-T33 PolarHBondContact O-N 2.99Å; M29-T33 PolarHBondContact O-OG1 3.35Å; K31-T33 VanDerWaalsContact C-N 3.32Å; K31-T33 PolarHBondContact O-N 3.47Å; T33-F36 PolarHBondContact O-N 3.02Å; T33-I37 HydrophobicContact CG2-CD1 4.08Å; T33-I37 VanDerWaalsContact O-CG1 3.31Å; T33-I37 WeakPolarHBondContact O-CG1 3.44Å; T33-I37 PolarHBondContact O-N 3.25Å
34	E	95.5	Very high	95.1	Very high	32 Å²	32	58.1 Å²	58.1	15%	0.15	32%	0.32	C	S	.	.	H	α-helix	trans	-60.5	-46.7	174.2	-171.8	-175	112.9	0	0	111.3	A2 A30 K31 I37 Q38	A2-E34 PolarHBondContact N-OE2 2.9Å; A30-E34 PolarHBondContact O-N 3.46Å; A30-E34 VanDerWaalsContact O-N 3.12Å; K31-E34 IonicContact NZ-OE1 3.68Å; K31-E34 PolarHBondContact NZ-OE1 3.48Å; K31-E34 WeakPolarHBondContact O-CB 3.47Å; K31-E34 PolarHBondContact O-N 3.15Å; E34-I37 PolarHBondContact O-N 2.93Å; E34-Q38 WeakPolarHBondContact O-CG 3.2Å; E34-Q38 PolarHBondContact O-N 3.46Å; E34-Q38 VanDerWaalsContact O-N 3.1Å
35	L	96.4	Very high	95	Very high	92 Å²	92	53.6 Å²	53.6	48%	0.482	31%	0.308	S	S	.	.	H	α-helix	trans	-64.8	-40.3	176.4	-68.9	174.6	0	0	0	112	K31 A32 I37 Q38 D39	K31-L35 WeakPolarHBondContact O-CG 3.25Å; K31-L35 PolarHBondContact O-N 2.81Å; A32-L35 PolarHBondContact O-N 3.06Å; L35-I37 PolarHBondContact O-N 3.16Å; L35-Q38 PolarHBondContact O-N 2.95Å; L35-D39 WeakPolarHBondContact O-CB 3.4Å; L35-D39 PolarHBondContact O-N 3.08Å
36	F	95.5	Very high	95	Very high	64 Å²	64	56 Å²	56	28%	0.281	33%	0.329	S	S	.	.	H	α-helix	trans	-59.9	-45.7	176.8	174.1	-98.8	0	0	0	112	A32 T33 D39 L40 Y70 F72 I73	A32-F36 VanDerWaalsContact O-CB 3.29Å; A32-F36 WeakPolarHBondContact O-CB 3.43Å; A32-F36 PolarHBondContact O-N 2.89Å; T33-F36 PolarHBondContact O-N 3.02Å; F36-D39 PolarHBondContact O-N 3.46Å; F36-L40 HydrophobicContact CE1-CD2 3.99Å; F36-L40 HydrophobicContact CZ-CD2 4.06Å; F36-L40 VanDerWaalsContact O-CB 3.28Å; F36-L40 WeakPolarHBondContact O-CB 3.41Å; F36-L40 PolarHBondContact O-N 3.1Å; F36-Y70 AromaticContact CE2-CD1 3.84Å; F36-Y70 HydrophobicContact CE2-CD1 3.84Å; F36-Y70 AromaticContact CE2-CE1 3.61Å; F36-Y70 HydrophobicContact CE2-CE1 3.61Å; F36-Y70 HydrophobicContact CZ-CD1 4.04Å; F36-Y70 HydrophobicContact CZ-CE1 4.03Å; F36-F72 HydrophobicContact CD2-CZ 4.49Å; F36-F72 HydrophobicContact CE1-CZ 4.32Å; F36-F72 AromaticContact CE2-CE1 3.9Å; F36-F72 HydrophobicContact CE2-CE1 3.9Å; F36-F72 AromaticContact CE2-CZ 3.62Å; F36-F72 HydrophobicContact CE2-CZ 3.62Å; F36-F72 HydrophobicContact CZ-CE1 4.14Å; F36-F72 AromaticContact CZ-CZ 3.54Å; F36-F72 HydrophobicContact CZ-CZ 3.54Å; F36-I73 HydrophobicContact CZ-CD1 4.06Å
37	I	95.2	Very high	94.8	Very high	82 Å²	82	60 Å²	60	42%	0.421	35%	0.347	S	S	.	.	H	α-helix	trans	-64.5	-42.7	177.7	-67.1	165.6	0	0	0	110.4	T33 E34 L35 V41	T33-I37 HydrophobicContact CG2-CD1 4.08Å; T33-I37 VanDerWaalsContact O-CG1 3.31Å; T33-I37 WeakPolarHBondContact O-CG1 3.44Å; T33-I37 PolarHBondContact O-N 3.25Å; E34-I37 PolarHBondContact O-N 2.93Å; L35-I37 PolarHBondContact O-N 3.16Å; I37-V41 HydrophobicContact CG2-CG2 4.22Å; I37-V41 VanDerWaalsContact O-CB 3.3Å; I37-V41 WeakPolarHBondContact O-CB 3.46Å; I37-V41 WeakPolarHBondContact O-CG2 3.32Å; I37-V41 PolarHBondContact O-N 3.25Å
38	Q	95.3	Very high	94.5	Very high	115 Å²	115	57.8 Å²	57.8	54%	0.537	34%	0.337	S	S	.	.	H	α-helix	trans	-62.7	-45.4	178	-72.9	175.9	7.3	0	0	112.2	E34 L35 G42	E34-Q38 WeakPolarHBondContact O-CG 3.2Å; E34-Q38 PolarHBondContact O-N 3.46Å; E34-Q38 VanDerWaalsContact O-N 3.1Å; L35-Q38 PolarHBondContact O-N 2.95Å; Q38-G42 PolarHBondContact O-N 3.09Å
39	D	95.5	Very high	94.1	Very high	75 Å²	75	57.9 Å²	57.9	40%	0.401	33%	0.332	S	S	.	.	H	α-helix	trans	-61.1	-50.8	176.8	-176.1	61.9	0	0	0	111.1	L35 F36 V41 G42 E43 K69 Y70	L35-D39 WeakPolarHBondContact O-CB 3.4Å; L35-D39 PolarHBondContact O-N 3.08Å; F36-D39 PolarHBondContact O-N 3.46Å; D39-V41 PolarHBondContact O-N 2.91Å; D39-G42 PolarHBondContact O-N 3.49Å; D39-G42 VanDerWaalsContact O-N 3.15Å; D39-E43 PolarHBondContact O-N 2.88Å; D39-K69 IonicContact OD1-NZ 3.93Å; D39-K69 IonicContact OD2-NZ 2.74Å; D39-K69 PolarHBondContact OD2-NZ 2.94Å; D39-Y70 PolarHBondContact OD2-OH 3.29Å
40	L	94.8	Very high	93.6	Very high	19 Å²	19	59.7 Å²	59.7	10%	0.099	36%	0.359	C	S	.	.	H	α-helix	trans	-59.8	-46	178.8	179.8	60.2	0	0	0	112	F36 G42 E43 V44 L60 V63 I64 Y70	F36-L40 HydrophobicContact CE1-CD2 3.99Å; F36-L40 HydrophobicContact CZ-CD2 4.06Å; F36-L40 VanDerWaalsContact O-CB 3.28Å; F36-L40 WeakPolarHBondContact O-CB 3.41Å; F36-L40 PolarHBondContact O-N 3.1Å; L40-G42 VanDerWaalsContact C-N 3.31Å; L40-G42 PolarHBondContact O-N 3.4Å; L40-E43 PolarHBondContact O-N 3.17Å; L40-V44 HydrophobicContact CD1-CG2 4.35Å; L40-V44 VanDerWaalsContact O-CG2 3.23Å; L40-V44 WeakPolarHBondContact O-CG2 3.28Å; L40-V44 PolarHBondContact O-N 2.86Å; L40-L60 HydrophobicContact CD1-CD1 3.95Å; L40-L60 HydrophobicContact CD2-CD1 3.93Å; L40-L60 HydrophobicContact CG-CD1 3.91Å; L40-V63 HydrophobicContact CD1-CG1 4.06Å; L40-I64 HydrophobicContact CD1-CG1 4.34Å; L40-Y70 HydrophobicContact CB-CE1 4.48Å; L40-Y70 HydrophobicContact CD1-CD1 4.33Å; L40-Y70 HydrophobicContact CD1-CD2 4.29Å; L40-Y70 HydrophobicContact CD1-CE1 3.87Å; L40-Y70 HydrophobicContact CD1-CE2 3.83Å
41	V	94.3	Very high	93	Very high	69 Å²	69	65.2 Å²	65.2	42%	0.418	40%	0.398	S	S	.	.	H	α-helix	trans	-64	-39	177	169	0	0	0	0	111.1	I37 D39 V44 A45 M55	I37-V41 HydrophobicContact CG2-CG2 4.22Å; I37-V41 VanDerWaalsContact O-CB 3.3Å; I37-V41 WeakPolarHBondContact O-CB 3.46Å; I37-V41 WeakPolarHBondContact O-CG2 3.32Å; I37-V41 PolarHBondContact O-N 3.25Å; D39-V41 PolarHBondContact O-N 2.91Å; V41-V44 PolarHBondContact O-N 3.06Å; V41-A45 VanDerWaalsContact O-CB 3.26Å; V41-A45 WeakPolarHBondContact O-CB 3.37Å; V41-A45 PolarHBondContact O-N 3.31Å; V41-M55 HydrophobicContact CB-CE 4.49Å; V41-M55 HydrophobicContact CG1-CE 3.98Å
42	G	94.7	Very high	92.4	Very high	40 Å²	40	65.1 Å²	65.1	41%	0.412	40%	0.395	S	S	.	.	H	α-helix	trans	-60.8	-45.2	175.2	0	0	0	0	0	112.6	Q38 D39 L40 A45 A46	Q38-G42 PolarHBondContact O-N 3.09Å; D39-G42 PolarHBondContact O-N 3.49Å; D39-G42 VanDerWaalsContact O-N 3.15Å; L40-G42 VanDerWaalsContact C-N 3.31Å; L40-G42 PolarHBondContact O-N 3.4Å; G42-A45 PolarHBondContact O-N 2.95Å; G42-A46 WeakPolarHBondContact O-CB 3.19Å; G42-A46 PolarHBondContact O-N 3.3Å
43	E	94.3	Very high	91.8	Very high	50 Å²	50	74.9 Å²	74.9	23%	0.234	42%	0.423	C	S	.	.	H	α-helix	trans	-66.1	-43	177	-70.8	-160.2	174.4	0	0	112.8	D39 L40 A45 A46 Q47 V63 N67 K69 Y70	D39-E43 PolarHBondContact O-N 2.88Å; L40-E43 PolarHBondContact O-N 3.17Å; E43-A45 VanDerWaalsContact C-N 3.32Å; E43-A45 PolarHBondContact O-N 3.4Å; E43-A46 PolarHBondContact O-N 2.82Å; E43-Q47 PolarHBondContact O-N 3.34Å; E43-Q47 VanDerWaalsContact O-N 3.16Å; E43-V63 HydrophobicContact CB-CG1 4.09Å; E43-N67 PolarHBondContact OE2-ND2 3.12Å; E43-K69 VanDerWaalsContact CD-NZ 3.3Å; E43-K69 WeakPolarHBondContact OE1-CE 3.46Å; E43-K69 IonicContact OE1-NZ 2.74Å; E43-K69 PolarHBondContact OE1-NZ 3.38Å; E43-K69 WeakPolarHBondContact OE2-CE 2.87Å; E43-K69 IonicContact OE2-NZ 3.87Å; E43-Y70 WeakPolarHBondContact OE2-CE2 3.43Å; E43-Y70 PolarHBondContact OE2-OH 3.09Å
44	V	93.8	Very high	91.5	Very high	0 Å²	0	77.4 Å²	77.4	0%	0	44%	0.438	C	S	.	.	H	α-helix	trans	-63.1	-42.8	176	-179	0	0	0	0	110.5	L40 V41 A46 Q47 M48 M55 H59 L60 V63	L40-V44 HydrophobicContact CD1-CG2 4.35Å; L40-V44 VanDerWaalsContact O-CG2 3.23Å; L40-V44 WeakPolarHBondContact O-CG2 3.28Å; L40-V44 PolarHBondContact O-N 2.86Å; V41-V44 PolarHBondContact O-N 3.06Å; V44-A46 VanDerWaalsContact C-N 3.3Å; V44-A46 PolarHBondContact O-N 3.36Å; V44-Q47 PolarHBondContact O-N 3Å; V44-M48 HydrophobicContact CG1-SD 4.45Å; V44-M48 VanDerWaalsContact O-CG 3.31Å; V44-M48 WeakPolarHBondContact O-CG 3.3Å; V44-M48 PolarHBondContact O-N 3.12Å; V44-M48 VanDerWaalsContact O-N 3.13Å; V44-M55 HydrophobicContact CB-CE 3.63Å; V44-M55 HydrophobicContact CB-SD 4.03Å; V44-M55 HydrophobicContact CG1-CE 3.53Å; V44-M55 HydrophobicContact CG1-CG 3.67Å; V44-M55 HydrophobicContact CG1-SD 3.57Å; V44-M55 VanDerWaalsContact CG1-SD 3.57Å; V44-H59 HydrophobicContact CG1-CB 3.6Å; V44-L60 HydrophobicContact CG2-CD1 3.75Å; V44-V63 HydrophobicContact CB-CG2 4.15Å; V44-V63 HydrophobicContact CG2-CB 3.87Å; V44-V63 HydrophobicContact CG2-CG1 4.2Å; V44-V63 HydrophobicContact CG2-CG2 3.6Å
45	A	93	Very high	91.3	Very high	55 Å²	55	79.3 Å²	79.3	46%	0.455	45%	0.448	S	S	.	.	H	α-helix	trans	-62.3	-36.5	176.3	0	0	0	0	0	112.4	V41 G42 E43 Q47 M48	V41-A45 VanDerWaalsContact O-CB 3.26Å; V41-A45 WeakPolarHBondContact O-CB 3.37Å; V41-A45 PolarHBondContact O-N 3.31Å; G42-A45 PolarHBondContact O-N 2.95Å; E43-A45 VanDerWaalsContact C-N 3.32Å; E43-A45 PolarHBondContact O-N 3.4Å; A45-Q47 VanDerWaalsContact C-N 3.31Å; A45-Q47 PolarHBondContact O-N 3.22Å; A45-M48 PolarHBondContact O-N 3.47Å
46	A	92.3	Very high	91	Very high	87 Å²	87	79.6 Å²	79.6	72%	0.719	45%	0.445	S	S	*	.	H	α-helix	trans	-67.7	-28.6	177	0	0	0	0	0	113.4	G42 E43 V44	G42-A46 WeakPolarHBondContact O-CB 3.19Å; G42-A46 PolarHBondContact O-N 3.3Å; E43-A46 PolarHBondContact O-N 2.82Å; V44-A46 VanDerWaalsContact C-N 3.3Å; V44-A46 PolarHBondContact O-N 3.36Å
47	Q	89.3	Confident	90.7	Very high	87 Å²	87	81.1 Å²	81.1	41%	0.407	46%	0.456	S	S	.	.	H	α-helix	trans	-90.2	-7	176.2	-64.4	-170.2	17.7	0	0	113.7	E43 V44 A45 N62 V63	E43-Q47 PolarHBondContact O-N 3.34Å; E43-Q47 VanDerWaalsContact O-N 3.16Å; V44-Q47 PolarHBondContact O-N 3Å; A45-Q47 VanDerWaalsContact C-N 3.31Å; A45-Q47 PolarHBondContact O-N 3.22Å; Q47-N62 PolarHBondContact OE1-ND2 3.39Å; Q47-V63 HydrophobicContact CB-CG2 4.45Å; Q47-V63 HydrophobicContact CG-CG2 4.25Å
48	M	89.6	Confident	90.4	Very high	29 Å²	29	81.9 Å²	81.9	14%	0.143	46%	0.457	C	S	.	.	S	Bend	trans	-75.4	144.5	179.6	-83.1	178.8	58.1	0	0	112	V44 A45 A50 R52 T54 M55 H59	V44-M48 HydrophobicContact CG1-SD 4.45Å; V44-M48 VanDerWaalsContact O-CG 3.31Å; V44-M48 WeakPolarHBondContact O-CG 3.3Å; V44-M48 PolarHBondContact O-N 3.12Å; V44-M48 VanDerWaalsContact O-N 3.13Å; A45-M48 PolarHBondContact O-N 3.47Å; M48-A50 PolarHBondContact O-N 2.86Å; M48-R52 HydrophobicContact CE-CB 4.26Å; M48-R52 HydrophobicContact CE-CG 4.09Å; M48-R52 WeakPolarHBondContact CE-O 3.29Å; M48-T54 VanDerWaalsContact CE-C 3.47Å; M48-T54 VanDerWaalsContact CE-O 3.25Å; M48-T54 WeakPolarHBondContact CE-O 3.38Å; M48-M55 HydrophobicContact SD-CB 3.84Å; M48-M55 HydrophobicContact SD-CE 4.45Å; M48-M55 HydrophobicContact SD-CG 4.04Å; M48-H59 HydrophobicContact CG-CB 4.22Å; M48-H59 WeakPolarHBondContact CG-ND1 3.01Å
49	P	87.7	Confident	90.2	Very high	61 Å²	61	77.5 Å²	77.5	40%	0.396	44%	0.437	S	S	.	.			trans	-63.8	135.2	173.9	25.6	-31.5	0	0	0	109.9	S51 R52	P49-S51 PolarHBondContact O-N 2.85Å; P49-R52 HydrophobicContact CG-CB 3.87Å; P49-R52 PolarHBondContact O-N 3.25Å
50	A	83.9	Confident	90	Very high	114 Å²	114	75.8 Å²	75.8	94%	0.942	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-22.1	-176.7	0	0	0	0	0	114.4	M48 R52	M48-A50 PolarHBondContact O-N 2.86Å; A50-R52 VanDerWaalsContact C-N 3.28Å; A50-R52 PolarHBondContact O-N 3.43Å
51	S	83.2	Confident	89.9	Confident	117 Å²	117	77.9 Å²	77.9	82%	0.818	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-13	176.3	58.6	0	0	0	0	113.9	P49	P49-S51 PolarHBondContact O-N 2.85Å
52	R	83.4	Confident	89.7	Confident	89 Å²	89	78.6 Å²	78.6	34%	0.336	44%	0.438	S	S	.	.			trans	-112.2	123.4	-172.2	-166.6	178.8	-75.7	-166.4	-0.4	110.9	M48 P49 A50 T54 E58 H59	M48-R52 HydrophobicContact CE-CB 4.26Å; M48-R52 HydrophobicContact CE-CG 4.09Å; M48-R52 WeakPolarHBondContact CE-O 3.29Å; P49-R52 HydrophobicContact CG-CB 3.87Å; P49-R52 PolarHBondContact O-N 3.25Å; A50-R52 VanDerWaalsContact C-N 3.28Å; A50-R52 PolarHBondContact O-N 3.43Å; R52-T54 WeakPolarHBondContact CD-O 3.42Å; R52-T54 WeakPolarHBondContact CG-O 3.47Å; R52-E58 IonicContact CZ-OE1 2.82Å; R52-E58 IonicContact NH1-OE1 2.6Å; R52-E58 PolarHBondContact NH1-OE1 3.41Å; R52-H59 VanDerWaalsContact CD-CE1 3.41Å; R52-H59 WeakPolarHBondContact CD-CE1 3.36Å; R52-H59 PolarHBondContact NH1-CE1 2.98Å; R52-H59 PolarHBondContact NH1-NE2 3.27Å
53	R	84.6	Confident	89.7	Confident	249 Å²	249	76.7 Å²	76.7	94%	0.94	42%	0.419	S	S	*	.			trans	-96.1	-10.6	175.9	-65.2	-177.4	-179.1	161.2	-0.1	114.1
54	T	90.3	Very high	89.6	Confident	99 Å²	99	74.8 Å²	74.8	61%	0.607	41%	0.41	S	S	*	.	S	Bend	trans	-107.5	118.4	-176.2	-50.9	0	0	0	0	110.3	M48 R52	M48-T54 VanDerWaalsContact CE-C 3.47Å; M48-T54 VanDerWaalsContact CE-O 3.25Å; M48-T54 WeakPolarHBondContact CE-O 3.38Å; R52-T54 WeakPolarHBondContact CD-O 3.42Å; R52-T54 WeakPolarHBondContact CG-O 3.47Å
55	M	90	Very high	89.4	Confident	72 Å²	72	80.8 Å²	80.8	36%	0.355	44%	0.442	S	S	.	.			trans	-71.1	135.5	172	-171.6	-178.8	-65.9	0	0	109.7	V41 V44 M48	V41-M55 HydrophobicContact CB-CE 4.49Å; V41-M55 HydrophobicContact CG1-CE 3.98Å; V44-M55 HydrophobicContact CB-CE 3.63Å; V44-M55 HydrophobicContact CB-SD 4.03Å; V44-M55 HydrophobicContact CG1-CE 3.53Å; V44-M55 HydrophobicContact CG1-CG 3.67Å; V44-M55 HydrophobicContact CG1-SD 3.57Å; V44-M55 VanDerWaalsContact CG1-SD 3.57Å; M48-M55 HydrophobicContact SD-CB 3.84Å; M48-M55 HydrophobicContact SD-CE 4.45Å; M48-M55 HydrophobicContact SD-CG 4.04Å
56	K	90.6	Very high	89.4	Confident	99 Å²	99	81.9 Å²	81.9	43%	0.43	44%	0.443	S	S	.	.			trans	-118.2	160.8	175.6	-68.2	-169.5	-171.6	177.8	0	109.4	E58 H59 L60	K56-E58 HydrophobicContact CB-CG 3.91Å; K56-E58 HydrophobicContact CD-CG 4.49Å; K56-E58 WeakPolarHBondContact CD-OE1 3.31Å; K56-E58 IonicContact NZ-OE1 2.81Å; K56-E58 PolarHBondContact O-N 2.82Å; K56-H59 PolarHBondContact N-ND1 3.38Å; K56-H59 VanDerWaalsContact N-ND1 3.15Å; K56-H59 PolarHBondContact O-N 2.92Å; K56-L60 PolarHBondContact O-N 2.97Å
57	L	89.2	Confident	89.4	Confident	95 Å²	95	79.8 Å²	79.8	50%	0.497	42%	0.42	S	S	.	.	H	α-helix	trans	-53.8	-40.4	176.7	-175.1	62.4	0	0	0	112	H59 L60 E61	L57-H59 PolarHBondContact O-N 2.91Å; L57-H59 VanDerWaalsContact O-N 3.17Å; L57-L60 HydrophobicContact CD1-CD2 4.39Å; L57-L60 WeakPolarHBondContact O-CB 3.41Å; L57-L60 PolarHBondContact O-N 2.94Å; L57-E61 HydrophobicContact CD1-CG 4.39Å; L57-E61 HydrophobicContact CG-CG 4.2Å; L57-E61 WeakPolarHBondContact O-CG 3.09Å; L57-E61 PolarHBondContact O-N 3.26Å
58	E	89.3	Confident	89.5	Confident	98 Å²	98	81.2 Å²	81.2	46%	0.458	44%	0.437	S	S	.	.	H	α-helix	trans	-55.3	-34.9	177.6	69.4	-171.1	178.3	0	0	113.4	R52 K56 N62	R52-E58 IonicContact CZ-OE1 2.82Å; R52-E58 IonicContact NH1-OE1 2.6Å; R52-E58 PolarHBondContact NH1-OE1 3.41Å; K56-E58 HydrophobicContact CB-CG 3.91Å; K56-E58 HydrophobicContact CD-CG 4.49Å; K56-E58 WeakPolarHBondContact CD-OE1 3.31Å; K56-E58 IonicContact NZ-OE1 2.81Å; K56-E58 PolarHBondContact O-N 2.82Å; E58-N62 WeakPolarHBondContact O-CB 3.27Å; E58-N62 PolarHBondContact O-N 3.23Å; E58-N62 VanDerWaalsContact O-N 3.1Å
59	H	91.4	Very high	89.7	Confident	24 Å²	24	84.4 Å²	84.4	11%	0.111	45%	0.45	C	S	.	.	H	α-helix	trans	-75.2	-37.1	178.6	-45.4	145.8	0	0	0	111.4	V44 M48 R52 K56 L57 N62 V63	V44-H59 HydrophobicContact CG1-CB 3.6Å; M48-H59 HydrophobicContact CG-CB 4.22Å; M48-H59 WeakPolarHBondContact CG-ND1 3.01Å; R52-H59 VanDerWaalsContact CD-CE1 3.41Å; R52-H59 WeakPolarHBondContact CD-CE1 3.36Å; R52-H59 PolarHBondContact NH1-CE1 2.98Å; R52-H59 PolarHBondContact NH1-NE2 3.27Å; K56-H59 PolarHBondContact N-ND1 3.38Å; K56-H59 VanDerWaalsContact N-ND1 3.15Å; K56-H59 PolarHBondContact O-N 2.92Å; L57-H59 PolarHBondContact O-N 2.91Å; L57-H59 VanDerWaalsContact O-N 3.17Å; H59-N62 PolarHBondContact O-N 3.22Å; H59-V63 PolarHBondContact O-N 2.9Å
60	L	91.4	Very high	90	Very high	39 Å²	39	81.5 Å²	81.5	20%	0.204	43%	0.431	C	S	.	.	H	α-helix	trans	-66.4	-45.2	177.2	-176.9	66.5	0	0	0	110.6	L40 V44 K56 L57 N62 V63 I64 L77	L40-L60 HydrophobicContact CD1-CD1 3.95Å; L40-L60 HydrophobicContact CD2-CD1 3.93Å; L40-L60 HydrophobicContact CG-CD1 3.91Å; V44-L60 HydrophobicContact CG2-CD1 3.75Å; K56-L60 PolarHBondContact O-N 2.97Å; L57-L60 HydrophobicContact CD1-CD2 4.39Å; L57-L60 WeakPolarHBondContact O-CB 3.41Å; L57-L60 PolarHBondContact O-N 2.94Å; L60-N62 VanDerWaalsContact C-N 3.31Å; L60-N62 PolarHBondContact O-N 3.25Å; L60-V63 PolarHBondContact O-N 3.23Å; L60-I64 HydrophobicContact CD1-CD1 3.96Å; L60-I64 HydrophobicContact CD2-CD1 4.48Å; L60-I64 HydrophobicContact CG-CD1 3.8Å; L60-I64 WeakPolarHBondContact O-CG1 3.33Å; L60-I64 PolarHBondContact O-N 3.39Å; L60-L77 HydrophobicContact CD2-CD1 4.25Å; L60-L77 HydrophobicContact CD2-CD2 4.02Å; L60-L77 HydrophobicContact CG-CD1 4.24Å
61	E	91.6	Very high	90.3	Very high	63 Å²	63	79.6 Å²	79.6	29%	0.294	42%	0.415	S	S	.	.	H	α-helix	trans	-59	-42.1	174.4	-71.3	176.1	158.2	0	0	111.5	L57 V63 I64 N65 L77	L57-E61 HydrophobicContact CD1-CG 4.39Å; L57-E61 HydrophobicContact CG-CG 4.2Å; L57-E61 WeakPolarHBondContact O-CG 3.09Å; L57-E61 PolarHBondContact O-N 3.26Å; E61-V63 PolarHBondContact O-N 3.3Å; E61-I64 PolarHBondContact O-N 2.81Å; E61-N65 VanDerWaalsContact O-CB 3.26Å; E61-N65 WeakPolarHBondContact O-CB 3.48Å; E61-N65 PolarHBondContact O-N 3.1Å; E61-N65 PolarHBondContact O-ND2 2.97Å; E61-L77 HydrophobicContact CG-CD1 3.94Å
62	N	91.2	Very high	90.6	Very high	84 Å²	84	81 Å²	81	45%	0.449	41%	0.407	S	S	.	.	H	α-helix	trans	-60.4	-45.8	177.6	-169.7	62.7	0	0	0	112	Q47 E58 H59 L60 T66	Q47-N62 PolarHBondContact OE1-ND2 3.39Å; E58-N62 WeakPolarHBondContact O-CB 3.27Å; E58-N62 PolarHBondContact O-N 3.23Å; E58-N62 VanDerWaalsContact O-N 3.1Å; H59-N62 PolarHBondContact O-N 3.22Å; L60-N62 VanDerWaalsContact C-N 3.31Å; L60-N62 PolarHBondContact O-N 3.25Å; N62-T66 WeakPolarHBondContact O-CB 3.14Å; N62-T66 WeakPolarHBondContact O-CG2 3.29Å; N62-T66 PolarHBondContact O-N 3.46Å; N62-T66 VanDerWaalsContact O-N 3.1Å; N62-T66 PolarHBondContact O-OG1 3.15Å
63	V	93.1	Very high	91	Very high	0 Å²	0	78.2 Å²	78.2	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-63.4	-46.2	177.1	170.8	0	0	0	0	111.4	L40 E43 V44 Q47 H59 L60 E61 N65 T66 N67 Y70	L40-V63 HydrophobicContact CD1-CG1 4.06Å; E43-V63 HydrophobicContact CB-CG1 4.09Å; V44-V63 HydrophobicContact CB-CG2 4.15Å; V44-V63 HydrophobicContact CG2-CB 3.87Å; V44-V63 HydrophobicContact CG2-CG1 4.2Å; V44-V63 HydrophobicContact CG2-CG2 3.6Å; Q47-V63 HydrophobicContact CB-CG2 4.45Å; Q47-V63 HydrophobicContact CG-CG2 4.25Å; H59-V63 PolarHBondContact O-N 2.9Å; L60-V63 PolarHBondContact O-N 3.23Å; E61-V63 PolarHBondContact O-N 3.3Å; V63-N65 PolarHBondContact O-N 3.37Å; V63-T66 PolarHBondContact O-N 3.21Å; V63-T66 PolarHBondContact O-OG1 3.43Å; V63-N67 WeakPolarHBondContact O-CB 3.36Å; V63-N67 PolarHBondContact O-N 3.45Å; V63-Y70 HydrophobicContact CG1-CD2 3.97Å; V63-Y70 HydrophobicContact CG1-CE2 3.53Å
64	I	92.8	Very high	90.4	Very high	10 Å²	10	68.3 Å²	68.3	5%	0.051	37%	0.374	C	S	.	.	H	α-helix	trans	-66.5	-38.5	-177.3	-72.8	164	0	0	0	111.8	L40 L60 E61 Y70 I73 L77	L40-I64 HydrophobicContact CD1-CG1 4.34Å; L60-I64 HydrophobicContact CD1-CD1 3.96Å; L60-I64 HydrophobicContact CD2-CD1 4.48Å; L60-I64 HydrophobicContact CG-CD1 3.8Å; L60-I64 WeakPolarHBondContact O-CG1 3.33Å; L60-I64 PolarHBondContact O-N 3.39Å; E61-I64 PolarHBondContact O-N 2.81Å; I64-Y70 HydrophobicContact CG1-CD2 4.28Å; I64-Y70 HydrophobicContact CG1-CG 4.18Å; I64-I73 HydrophobicContact CD1-CD1 3.76Å; I64-I73 HydrophobicContact CD1-CG2 4.34Å; I64-I73 HydrophobicContact CG1-CD1 4.07Å; I64-I73 HydrophobicContact CG2-CB 4.31Å; I64-I73 HydrophobicContact CG2-CG2 4.47Å; I64-L77 HydrophobicContact CD1-CD1 3.36Å; I64-L77 HydrophobicContact CD1-CD2 4.44Å; I64-L77 HydrophobicContact CD1-CG 4.12Å
65	N	90.3	Very high	89.9	Confident	125 Å²	125	68.4 Å²	68.4	67%	0.668	37%	0.37	S	S	*	.	H	α-helix	trans	-76	-23.4	179.6	-68.9	-38.4	0	0	0	113.4	E61 V63	E61-N65 VanDerWaalsContact O-CB 3.26Å; E61-N65 WeakPolarHBondContact O-CB 3.48Å; E61-N65 PolarHBondContact O-N 3.1Å; E61-N65 PolarHBondContact O-ND2 2.97Å; V63-N65 PolarHBondContact O-N 3.37Å
66	T	92	Very high	89.6	Confident	78 Å²	78	67.4 Å²	67.4	48%	0.479	37%	0.373	S	S	.	.	H	α-helix	trans	-91.2	-27.7	-179.4	51.5	0	0	0	0	113.2	N62 V63	N62-T66 WeakPolarHBondContact O-CB 3.14Å; N62-T66 WeakPolarHBondContact O-CG2 3.29Å; N62-T66 PolarHBondContact O-N 3.46Å; N62-T66 VanDerWaalsContact O-N 3.1Å; N62-T66 PolarHBondContact O-OG1 3.15Å; V63-T66 PolarHBondContact O-N 3.21Å; V63-T66 PolarHBondContact O-OG1 3.43Å
67	N	92.3	Very high	89.1	Confident	44 Å²	44	64.9 Å²	64.9	24%	0.235	36%	0.364	C	S	.	.			trans	-105.7	116.1	-175.2	-73.5	-36.2	0	0	0	112	E43 V63 K69 Y70	E43-N67 PolarHBondContact OE2-ND2 3.12Å; V63-N67 WeakPolarHBondContact O-CB 3.36Å; V63-N67 PolarHBondContact O-N 3.45Å; N67-K69 HydrophobicContact CB-CG 4.22Å; N67-K69 PolarHBondContact O-N 3.24Å; N67-K69 VanDerWaalsContact O-N 3.09Å; N67-Y70 HydrophobicContact CB-CD2 3.66Å; N67-Y70 HydrophobicContact CB-CE2 3.95Å; N67-Y70 PolarHBondContact O-N 3.15Å
68	P	92.6	Very high	88.7	Confident	116 Å²	116	67.4 Å²	67.4	75%	0.753	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-64.2	-21.5	-176	25.3	-34.4	0	0	0	113.6	Y70 A71	P68-Y70 PolarHBondContact O-N 3.25Å; P68-Y70 VanDerWaalsContact O-N 3.16Å; P68-A71 WeakPolarHBondContact O-CB 3.49Å; P68-A71 PolarHBondContact O-N 3.23Å
69	K	93.1	Very high	88.1	Confident	96 Å²	96	66.8 Å²	66.8	42%	0.417	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-61.4	-20.7	175	63	166.9	171.6	170.5	0	113.5	D39 E43 N67 F72	D39-K69 IonicContact OD1-NZ 3.93Å; D39-K69 IonicContact OD2-NZ 2.74Å; D39-K69 PolarHBondContact OD2-NZ 2.94Å; E43-K69 VanDerWaalsContact CD-NZ 3.3Å; E43-K69 WeakPolarHBondContact OE1-CE 3.46Å; E43-K69 IonicContact OE1-NZ 2.74Å; E43-K69 PolarHBondContact OE1-NZ 3.38Å; E43-K69 WeakPolarHBondContact OE2-CE 2.87Å; E43-K69 IonicContact OE2-NZ 3.87Å; N67-K69 HydrophobicContact CB-CG 4.22Å; N67-K69 PolarHBondContact O-N 3.24Å; N67-K69 VanDerWaalsContact O-N 3.09Å; K69-F72 WeakPolarHBondContact O-CD1 3.25Å; K69-F72 WeakPolarHBondContact O-CE1 3.33Å
70	Y	93.7	Very high	87	Confident	1 Å²	1	72.2 Å²	72.2	0%	0.004	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-99	7.7	178.1	-57	-52.2	0	0	0	113.3	F36 D39 L40 E43 V63 I64 N67 P68 F72 I73	F36-Y70 AromaticContact CE2-CD1 3.84Å; F36-Y70 HydrophobicContact CE2-CD1 3.84Å; F36-Y70 AromaticContact CE2-CE1 3.61Å; F36-Y70 HydrophobicContact CE2-CE1 3.61Å; F36-Y70 HydrophobicContact CZ-CD1 4.04Å; F36-Y70 HydrophobicContact CZ-CE1 4.03Å; D39-Y70 PolarHBondContact OD2-OH 3.29Å; L40-Y70 HydrophobicContact CB-CE1 4.48Å; L40-Y70 HydrophobicContact CD1-CD1 4.33Å; L40-Y70 HydrophobicContact CD1-CD2 4.29Å; L40-Y70 HydrophobicContact CD1-CE1 3.87Å; L40-Y70 HydrophobicContact CD1-CE2 3.83Å; E43-Y70 WeakPolarHBondContact OE2-CE2 3.43Å; E43-Y70 PolarHBondContact OE2-OH 3.09Å; V63-Y70 HydrophobicContact CG1-CD2 3.97Å; V63-Y70 HydrophobicContact CG1-CE2 3.53Å; I64-Y70 HydrophobicContact CG1-CD2 4.28Å; I64-Y70 HydrophobicContact CG1-CG 4.18Å; N67-Y70 HydrophobicContact CB-CD2 3.66Å; N67-Y70 HydrophobicContact CB-CE2 3.95Å; N67-Y70 PolarHBondContact O-N 3.15Å; P68-Y70 PolarHBondContact O-N 3.25Å; P68-Y70 VanDerWaalsContact O-N 3.16Å; Y70-F72 HydrophobicContact CD1-CE1 4.45Å; Y70-F72 PolarHBondContact O-N 3.25Å; Y70-F72 VanDerWaalsContact O-N 3.08Å; Y70-I73 HydrophobicContact CD1-CD1 4.46Å; Y70-I73 WeakPolarHBondContact O-CB 3.45Å; Y70-I73 PolarHBondContact O-N 2.93Å
71	A	89.6	Confident	85.8	Confident	73 Å²	73	74.4 Å²	74.4	60%	0.603	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-57.5	-26.8	178.9	0	0	0	0	0	113.2	P68 I73 G74	P68-A71 WeakPolarHBondContact O-CB 3.49Å; P68-A71 PolarHBondContact O-N 3.23Å; A71-I73 PolarHBondContact O-N 3.43Å; A71-G74 PolarHBondContact O-N 2.58Å
72	F	90.7	Very high	84.3	Confident	148 Å²	148	72.9 Å²	72.9	65%	0.649	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-66.8	-20.4	176.5	78.3	-89.6	0	0	0	113.7	F36 K69 Y70 G74	F36-F72 HydrophobicContact CD2-CZ 4.49Å; F36-F72 HydrophobicContact CE1-CZ 4.32Å; F36-F72 AromaticContact CE2-CE1 3.9Å; F36-F72 HydrophobicContact CE2-CE1 3.9Å; F36-F72 AromaticContact CE2-CZ 3.62Å; F36-F72 HydrophobicContact CE2-CZ 3.62Å; F36-F72 HydrophobicContact CZ-CE1 4.14Å; F36-F72 AromaticContact CZ-CZ 3.54Å; F36-F72 HydrophobicContact CZ-CZ 3.54Å; K69-F72 WeakPolarHBondContact O-CD1 3.25Å; K69-F72 WeakPolarHBondContact O-CE1 3.33Å; Y70-F72 HydrophobicContact CD1-CE1 4.45Å; Y70-F72 PolarHBondContact O-N 3.25Å; Y70-F72 VanDerWaalsContact O-N 3.08Å; F72-G74 VanDerWaalsContact C-N 3.32Å
73	I	90.4	Very high	82.8	Confident	29 Å²	29	76.8 Å²	76.8	15%	0.149	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-72.1	-33.3	172.7	-62.5	176.5	0	0	0	109.6	F36 I64 Y70 A71 D75 A76 L77	F36-I73 HydrophobicContact CZ-CD1 4.06Å; I64-I73 HydrophobicContact CD1-CD1 3.76Å; I64-I73 HydrophobicContact CD1-CG2 4.34Å; I64-I73 HydrophobicContact CG1-CD1 4.07Å; I64-I73 HydrophobicContact CG2-CB 4.31Å; I64-I73 HydrophobicContact CG2-CG2 4.47Å; Y70-I73 HydrophobicContact CD1-CD1 4.46Å; Y70-I73 WeakPolarHBondContact O-CB 3.45Å; Y70-I73 PolarHBondContact O-N 2.93Å; A71-I73 PolarHBondContact O-N 3.43Å; I73-D75 PolarHBondContact O-N 3.28Å; I73-A76 HydrophobicContact CG2-CB 4.17Å; I73-A76 WeakPolarHBondContact O-CB 3.44Å; I73-A76 PolarHBondContact O-N 3.13Å; I73-L77 HydrophobicContact CG2-CD2 4.44Å; I73-L77 HydrophobicContact CG2-CG 4.02Å
74	G	73.6	Confident	81.3	Confident	42 Å²	42	84.2 Å²	84.2	43%	0.433	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	-133.3	176.7	0	0	0	0	0	112.8	A71 F72 A76	A71-G74 PolarHBondContact O-N 2.58Å; F72-G74 VanDerWaalsContact C-N 3.32Å; G74-A76 PolarHBondContact O-N 3.39Å
75	D	79.5	Confident	79.5	Confident	100 Å²	100	88.6 Å²	88.6	54%	0.535	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	5.6	177.1	-72.3	-40.9	0	0	0	113.9	I73 L77 K78 T79	I73-D75 PolarHBondContact O-N 3.28Å; D75-L77 PolarHBondContact O-N 3.33Å; D75-L77 VanDerWaalsContact O-N 3.09Å; D75-K78 PolarHBondContact O-N 3.4Å; D75-K78 IonicContact OD1-NZ 3.98Å; D75-K78 PolarHBondContact OD1-NZ 3.26Å; D75-T79 PolarHBondContact O-N 3.07Å; D75-T79 PolarHBondContact O-OG1 3.26Å
76	A	82.8	Confident	77.6	Confident	51 Å²	51	87.4 Å²	87.4	42%	0.421	47%	0.473	S	S	.	.	H	α-helix	trans	-56.4	-33	-177.1	0	0	0	0	0	112.3	I73 G74 K78 T79 F80	I73-A76 HydrophobicContact CG2-CB 4.17Å; I73-A76 WeakPolarHBondContact O-CB 3.44Å; I73-A76 PolarHBondContact O-N 3.13Å; G74-A76 PolarHBondContact O-N 3.39Å; A76-K78 PolarHBondContact O-N 3.35Å; A76-T79 PolarHBondContact O-N 3.08Å; A76-F80 WeakPolarHBondContact O-CB 3.25Å; A76-F80 PolarHBondContact O-N 3.2Å
77	L	81.2	Confident	75.5	Confident	46 Å²	46	88.6 Å²	88.6	24%	0.241	48%	0.483	C	S	.	.	H	α-helix	trans	-63.3	-27.7	175.5	-70.4	-171.5	0	0	0	114.3	L60 E61 I64 I73 D75	L60-L77 HydrophobicContact CD2-CD1 4.25Å; L60-L77 HydrophobicContact CD2-CD2 4.02Å; L60-L77 HydrophobicContact CG-CD1 4.24Å; E61-L77 HydrophobicContact CG-CD1 3.94Å; I64-L77 HydrophobicContact CD1-CD1 3.36Å; I64-L77 HydrophobicContact CD1-CD2 4.44Å; I64-L77 HydrophobicContact CD1-CG 4.12Å; I73-L77 HydrophobicContact CG2-CD2 4.44Å; I73-L77 HydrophobicContact CG2-CG 4.02Å; D75-L77 PolarHBondContact O-N 3.33Å; D75-L77 VanDerWaalsContact O-N 3.09Å
78	K	79.4	Confident	73.7	Confident	148 Å²	148	88.5 Å²	88.5	64%	0.643	48%	0.483	S	S	*	.	H	α-helix	trans	-88.7	-31.3	-179.3	-59.9	174.1	-169.1	151.9	0	111.9	D75 A76	D75-K78 PolarHBondContact O-N 3.4Å; D75-K78 IonicContact OD1-NZ 3.98Å; D75-K78 PolarHBondContact OD1-NZ 3.26Å; A76-K78 PolarHBondContact O-N 3.35Å
79	T	77	Confident	71.7	Confident	86 Å²	86	87.5 Å²	87.5	53%	0.528	47%	0.474	S	S	.	.	H	α-helix	trans	-88.7	-18.5	-178.7	-36.7	0	0	0	0	111.9	D75 A76 P81 C82	D75-T79 PolarHBondContact O-N 3.07Å; D75-T79 PolarHBondContact O-OG1 3.26Å; A76-T79 PolarHBondContact O-N 3.08Å; T79-P81 CarbonylContact O-C 3.25Å; T79-P81 VanDerWaalsContact O-C 3.25Å; T79-C82 WeakPolarHBondContact CG2-SG 3.27Å; T79-C82 PolarHBondContact O-N 3.02Å; T79-C82 PolarHBondContact O-SG 3.14Å
80	F	68.5	Low	69.6	Low	138 Å²	138	88.2 Å²	88.2	61%	0.605	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-77.8	137.8	-178	-167.2	-91.3	0	0	0	112.9	A76 F85	A76-F80 WeakPolarHBondContact O-CB 3.25Å; A76-F80 PolarHBondContact O-N 3.2Å; F80-F85 HydrophobicContact CE2-CB 4.35Å
81	P	67	Low	67.4	Low	84 Å²	84	92.1 Å²	92.1	55%	0.545	52%	0.516	S	S	.	.	S	Bend	cis	-77.2	125.5	-4.6	29.1	-31.5	0	0	0	112.4	T79 L86	T79-P81 CarbonylContact O-C 3.25Å; T79-P81 VanDerWaalsContact O-C 3.25Å; P81-L86 HydrophobicContact CB-CD2 4.01Å
82	C	59.1	Low	65.3	Low	31 Å²	31	96.2 Å²	96.2	21%	0.209	53%	0.526	C	S	.	.	P	Polyproline II helix	trans	-79.5	146.6	169.8	-42.3	0	0	0	0	109.3	T79 E84 F85 L86	T79-C82 WeakPolarHBondContact CG2-SG 3.27Å; T79-C82 PolarHBondContact O-N 3.02Å; T79-C82 PolarHBondContact O-SG 3.14Å; C82-E84 PolarHBondContact O-N 2.96Å; C82-E84 VanDerWaalsContact O-N 3.09Å; C82-F85 HydrophobicContact CB-CD2 3.93Å; C82-F85 HydrophobicContact CB-CE2 4.47Å; C82-F85 PolarHBondContact O-N 3.34Å; C82-L86 PolarHBondContact O-N 3.32Å
83	E	60.7	Low	63.1	Low	167 Å²	167	96.9 Å²	96.9	78%	0.78	53%	0.531	S	S	*	.	H	α-helix	trans	-52.9	-34	178.1	-64.7	-172.9	167.1	0	0	112.8	F85 L86	E83-F85 PolarHBondContact O-N 2.99Å; E83-L86 PolarHBondContact O-N 3.34Å
84	E	60.6	Low	60.7	Low	155 Å²	155	100.1 Å²	100.1	72%	0.724	56%	0.557	S	S	*	*	H	α-helix	trans	-62.7	-26.2	177.7	-62.1	179.8	-178.7	0	0	113.9	C82	C82-E84 PolarHBondContact O-N 2.96Å; C82-E84 VanDerWaalsContact O-N 3.09Å
85	F	55.1	Low	59	Low	102 Å²	102	103.1 Å²	103.1	45%	0.447	58%	0.578	S	S	.	*	H	α-helix	trans	-96.6	-12.7	179.2	-65.2	-69.9	0	0	0	113.6	F80 C82 E83 C87 L88	F80-F85 HydrophobicContact CE2-CB 4.35Å; C82-F85 HydrophobicContact CB-CD2 3.93Å; C82-F85 HydrophobicContact CB-CE2 4.47Å; C82-F85 PolarHBondContact O-N 3.34Å; E83-F85 PolarHBondContact O-N 2.99Å; F85-C87 PolarHBondContact O-N 2.99Å; F85-L88 HydrophobicContact CD1-CD1 4.08Å; F85-L88 PolarHBondContact O-N 2.8Å
86	L	50.7	Low	57	Low	100 Å²	100	103.7 Å²	103.7	52%	0.524	59%	0.585	S	S	.	*	H	α-helix	trans	-66.5	-18.8	174.2	-65.9	177.8	0	0	0	112.1	P81 C82 E83 L88 T89	P81-L86 HydrophobicContact CB-CD2 4.01Å; C82-L86 PolarHBondContact O-N 3.32Å; E83-L86 PolarHBondContact O-N 3.34Å; L86-L88 PolarHBondContact O-N 3.23Å; L86-T89 PolarHBondContact O-OG1 3.27Å; L86-T89 VanDerWaalsContact O-OG1 3.08Å
87	C	48.6	Very low	55	Low	103 Å²	103	106.9 Å²	106.9	70%	0.696	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-6.1	175.1	-58.8	0	0	0	0	114.3	F85	F85-C87 PolarHBondContact O-N 2.99Å
88	L	54.1	Low	53.4	Low	43 Å²	43	112.5 Å²	112.5	23%	0.225	62%	0.624	C	S	.	*	T	Hydrogen-bonded Turn	trans	-78.6	-23.6	179.6	-67.3	179.9	0	0	0	113.2	R10 I11 M14 F85 L86	R10-L88 PolarHBondContact NH1-O 3.49Å; R10-L88 PolarHBondContact NH2-O 3.4Å; I11-L88 HydrophobicContact CD1-CD1 4.49Å; I11-L88 HydrophobicContact CG1-CD1 4.39Å; M14-L88 HydrophobicContact SD-CD2 4.19Å; F85-L88 HydrophobicContact CD1-CD1 4.08Å; F85-L88 PolarHBondContact O-N 2.8Å; L86-L88 PolarHBondContact O-N 3.23Å
89	T	50.6	Low	51.7	Low	95 Å²	95	113.6 Å²	113.6	58%	0.583	63%	0.631	S	S	*	*	S	Bend	trans	-74.8	132.6	165.7	54	0	0	0	0	108	L86 S91	L86-T89 PolarHBondContact O-OG1 3.27Å; L86-T89 VanDerWaalsContact O-OG1 3.08Å; T89-S91 PolarHBondContact O-N 3.4Å
90	P	48.3	Very low	50.5	Low	110 Å²	110	115.4 Å²	115.4	71%	0.714	65%	0.647	S	S	*	*			trans	-56.1	111.7	164.6	25.3	-30.3	0	0	0	105.8	I92	P90-I92 VanDerWaalsContact C-N 3.3Å; P90-I92 PolarHBondContact O-N 2.85Å
91	S	48	Very low	49.4	Very low	84 Å²	84	118.3 Å²	118.3	59%	0.587	66%	0.663	S	S	*	*			trans	-58.7	105.5	169	-163.8	0	0	0	0	104.4	T89 Q93	T89-S91 PolarHBondContact O-N 3.4Å; S91-Q93 PolarHBondContact O-N 2.86Å; S91-Q93 VanDerWaalsContact OG-CG 3.3Å; S91-Q93 WeakPolarHBondContact OG-CG 3.3Å
92	I	45.5	Very low	48.8	Very low	159 Å²	159	119.8 Å²	119.8	82%	0.815	68%	0.675	S	S	*	*			trans	-68	75.4	163.4	-57.3	174.2	0	0	0	103.7	P90 S94	P90-I92 VanDerWaalsContact C-N 3.3Å; P90-I92 PolarHBondContact O-N 2.85Å; I92-S94 PolarHBondContact O-N 2.76Å
93	Q	43.7	Very low	48.5	Very low	161 Å²	161	125.6 Å²	125.6	75%	0.752	70%	0.704	S	S	*	*			trans	-72.9	93.2	163.7	-70.4	-174	22	0	0	105	S91 A95	S91-Q93 PolarHBondContact O-N 2.86Å; S91-Q93 VanDerWaalsContact OG-CG 3.3Å; S91-Q93 WeakPolarHBondContact OG-CG 3.3Å; Q93-A95 PolarHBondContact O-N 2.85Å
94	S	40.3	Very low	48.6	Very low	98 Å²	98	125.5 Å²	125.5	69%	0.685	71%	0.707	S	S	*	*			trans	5.8	91.9	139.1	-52.5	0	0	0	0	113.8	I92 T96	I92-S94 PolarHBondContact O-N 2.76Å; S94-T96 PolarHBondContact O-N 3.02Å
95	A	38.1	Very low	48.7	Very low	105 Å²	105	123.9 Å²	123.9	87%	0.868	71%	0.707	S	S	*	*			trans	-72.3	83.7	159.5	0	0	0	0	0	107.9	Q93	Q93-A95 PolarHBondContact O-N 2.85Å
96	T	37.2	Very low	48.8	Very low	111 Å²	111	125.3 Å²	125.3	68%	0.681	72%	0.72	S	S	*	*			trans	-149	108.1	170.2	39.9	0	0	0	0	110.7	S94	S94-T96 PolarHBondContact O-N 3.02Å
97	V	41.5	Very low	49.5	Very low	118 Å²	118	128 Å²	128	72%	0.715	73%	0.733	S	S	*	*			trans	71.9	118.9	148.6	-153.6	0	0	0	0	118.3
98	E	47.6	Very low	50.1	Low	164 Å²	164	131.4 Å²	131.4	77%	0.766	74%	0.739	S	S	*	*				165	144.4	116.3	-78.3	-65.1	148.6	0	0	110.2
99	E	44.1	Very low	50.4	Low	172 Å²	172	136.9 Å²	136.9	80%	0.804	77%	0.768	S	S	*	*			trans	-69.7	145.7	-157.4	-57.4	167.1	143.5	0	0	115.5
100	S	50.8	Low	50.9	Low	123 Å²	123	140.3 Å²	140.3	86%	0.86	78%	0.78	S	S	*	*			trans	-162	111	152.9	-75.4	0	0	0	0	110.9
101	E	45.7	Very low	51.3	Low	200 Å²	200	143 Å²	143	94%	0.935	79%	0.787	S	S	*	*			trans	-62.4	125.2	179.9	-55.1	172	120.2	0	0	111.7
102	S	55.6	Low	51.6	Low	114 Å²	114	146.5 Å²	146.5	80%	0.797	80%	0.799	S	S	*	*			trans	-155.2	92.3	156.9	51.8	0	0	0	0	112.3
103	N	51.9	Low	52.2	Low	154 Å²	154	147.7 Å²	147.7	82%	0.824	80%	0.801	S	S	*	*			trans	-1.5	110	145.6	-156.5	0	0	0	0	117.1
104	I	62.8	Low	52.6	Low	165 Å²	165	149.4 Å²	149.4	85%	0.846	81%	0.81	S	S	*	*			trans	-148.1	136.6	157.6	-113.5	165.6	0	0	0	109.7
105	V	62.9	Low	52.6	Low	120 Å²	120	150 Å²	150	73%	0.727	81%	0.814	S	S	*	*			trans	-78.3	144.1	-152.7	-179.3	0	0	0	0	113.6
106	D	57.1	Low	52.9	Low	132 Å²	132	153 Å²	153	71%	0.706	81%	0.813	S	S	*	*			trans	-55.2	133.6	175.3	-96.4	-41.6	0	0	0	112.9	E108	D106-E108 PolarHBondContact O-N 3.02Å
107	I	65.3	Low	53.3	Low	158 Å²	158	159 Å²	159	81%	0.81	82%	0.823	S	S	*	*	G	3₁₀ helix	trans	-79	-1.9	-175	-67.9	165.1	0	0	0	112
108	E	61.2	Low	53.5	Low	173 Å²	173	158.5 Å²	158.5	81%	0.808	82%	0.823	S	S	*	*	G	3₁₀ helix	trans	-84.2	-11.7	-169.5	-54.3	-167.5	161.8	0	0	114.2	D106	D106-E108 PolarHBondContact O-N 3.02Å
109	D	60.4	Low	53.3	Low	159 Å²	159	157.4 Å²	157.4	85%	0.85	82%	0.822	S	S	*	*	G	3₁₀ helix	trans	-95.8	7.3	-176	-84.7	-16.4	0	0	0	115.1
110	M	60.3	Low	53.4	Low	166 Å²	166	158.3 Å²	158.3	82%	0.818	82%	0.824	S	S	*	*	S	Bend	trans	-111.6	5.4	-166.6	-124.6	-179	71.9	0	0	117.1
111	L	57.7	Low	53.5	Low	168 Å²	168	157.4 Å²	157.4	88%	0.88	82%	0.818	S	S	*	*			trans	-138.1	30.8	-174	-68.1	175.7	0	0	0	115.8
112	D	54	Low	53.2	Low	156 Å²	156	154 Å²	154	83%	0.834	81%	0.811	S	S	*	*			trans	-94.6	141.2	154.8	-82.6	-43.2	0	0	0	109
113	E	58.1	Low	52.7	Low	184 Å²	184	155.7 Å²	155.7	86%	0.86	81%	0.811	S	S	*	*			trans	93.6	67.2	-179.6	-48.7	-165.9	136.7	0	0	117.7
114	Q	51.6	Low	52.9	Low	198 Å²	198	157.2 Å²	157.2	93%	0.925	81%	0.813	S	S	*	*				-166.6	90.2	129.7	-105	163.9	73.1	0	0	112.9
115	S	41.2	Very low	52.3	Low	111 Å²	111	158.1 Å²	158.1	78%	0.776	82%	0.818	S	S	*	*			trans	-64	133.2	158.3	178.6	0	0	0	0	110.1
116	I	45	Very low	51.9	Low	167 Å²	167	156.5 Å²	156.5	86%	0.856	82%	0.818	S	S	*	*			trans	178.7	109.3	133.8	-80.8	146.1	0	0	0	108
117	R	45.1	Very low	51.8	Low	236 Å²	236	158.5 Å²	158.5	89%	0.891	83%	0.828	S	S	*	*			trans	-85.1	-176	164.2	-71.5	-176.5	166.8	-160.7	-2.4	109.8
118	P	45.7	Very low	51.4	Low	109 Å²	109	158.4 Å²	158.4	71%	0.708	83%	0.83	S	S	*	*			cis	-136.6	-174.1	-8.4	19.7	7.4	0	0	0	114.8
119	D	43.1	Very low	50.9	Low	141 Å²	141	156.4 Å²	156.4	75%	0.754	83%	0.825	S	S	*	*			trans	86.5	107.7	144.9	-93.8	-5.5	0	0	0	120.3
120	F	46.3	Very low	50.9	Low	191 Å²	191	154.1 Å²	154.1	84%	0.838	82%	0.821	S	S	*	*				-176	135.5	105.6	-117.2	-110.4	0	0	0	112.4
121	S	51.6	Low	50.8	Low	104 Å²	104	154 Å²	154	73%	0.727	82%	0.819	S	S	*	*			trans	84.9	101.2	145.8	-57.7	0	0	0	0	122.8
122	T	40.8	Very low	51	Low	129 Å²	129	152.7 Å²	152.7	79%	0.791	82%	0.817	S	S	*	*			trans	-79.4	160.8	151	-40.9	0	0	0	0	111
123	D	44.9	Very low	51.2	Low	149 Å²	149	151.8 Å²	151.8	80%	0.797	81%	0.812	S	S	*	*			trans	77.3	107.2	162	-83.5	-26.9	0	0	0	119.5
124	E	54.8	Low	51.4	Low	186 Å²	186	151 Å²	151	87%	0.869	81%	0.813	S	S	*	*				-175.6	121.9	103.6	-105.7	-167.7	115.4	0	0	110.9
125	L	51	Low	52.2	Low	183 Å²	183	150.3 Å²	150.3	96%	0.958	81%	0.808	S	S	*	*			trans	-87.6	112.7	164.8	-72.6	167	0	0	0	107.9
126	A	55.2	Low	53.1	Low	87 Å²	87	150.9 Å²	150.9	72%	0.719	81%	0.809	S	S	*	*			trans	-139	107.3	165.3	0	0	0	0	0	109.7
127	N	53.6	Low	54.1	Low	173 Å²	173	148.2 Å²	148.2	93%	0.925	81%	0.805	S	S	*	*			trans	-56.6	131.6	159.6	-75.7	-35.6	0	0	0	108.9
128	D	57.5	Low	54.9	Low	157 Å²	157	145.8 Å²	145.8	84%	0.84	80%	0.804	S	S	*	*			trans	-144.3	139.8	151	-161.4	28.3	0	0	0	111.6
129	D	51.4	Low	55.8	Low	131 Å²	131	148.4 Å²	148.4	70%	0.701	81%	0.812	S	S	*	*			trans	-84.3	134.6	-163.2	-167.4	8.6	0	0	0	110.1
130	S	59.6	Low	56.8	Low	110 Å²	110	146.6 Å²	146.6	77%	0.769	81%	0.81	S	S	*	*			trans	-146.6	82.8	161.9	44.5	0	0	0	0	110.5
131	Q	57.5	Low	57.6	Low	165 Å²	165	147.1 Å²	147.1	77%	0.771	81%	0.813	S	S	*	*			trans	-54.2	123.5	156.6	-156.8	179.2	29.3	0	0	110.2
132	V	62.8	Low	58.3	Low	139 Å²	139	147 Å²	147	84%	0.842	81%	0.812	S	S	*	*			trans	-139.5	112.1	157.2	-133.4	0	0	0	0	109.2
133	D	57.4	Low	59.3	Low	137 Å²	137	146.2 Å²	146.2	73%	0.733	81%	0.811	S	S	*	*			trans	-45.9	137.4	167.5	-77.8	-95.6	0	0	0	113.6
134	D	63.2	Low	60.2	Low	167 Å²	167	146.6 Å²	146.6	89%	0.893	81%	0.814	S	S	*	*			trans	-141.8	126.2	144.5	-121.1	-40.8	0	0	0	111.4
135	K	67.8	Low	60.7	Low	184 Å²	184	146.2 Å²	146.2	80%	0.8	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-70.4	150.3	-168.9	-89.6	170.9	166.4	171.9	0	113.1
136	P	60.4	Low	61.3	Low	123 Å²	123	143.8 Å²	143.8	80%	0.799	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-82.9	120.2	152.2	31.8	-25.3	0	0	0	109.8
137	S	66.2	Low	61.6	Low	112 Å²	112	143.7 Å²	143.7	78%	0.783	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-79.2	118.6	167.9	51.3	0	0	0	0	110
138	E	63	Low	62.3	Low	185 Å²	185	140.9 Å²	140.9	86%	0.864	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-71.7	126.9	165.3	-60.1	-173.6	126.1	0	0	108.9
139	D	63.5	Low	62.7	Low	163 Å²	163	144 Å²	144	87%	0.872	80%	0.799	S	S	*	*			trans	-120.3	125.6	163.9	-107.7	-28.2	0	0	0	110
140	S	65.2	Low	63.4	Low	104 Å²	104	145.4 Å²	145.4	73%	0.727	81%	0.807	S	S	*	*			trans	-84.6	133.9	-179.9	-60.7	0	0	0	0	110
141	F	62	Low	63.5	Low	202 Å²	202	143.5 Å²	143.5	89%	0.886	81%	0.805	S	S	*	*			trans	-150	101	152.6	-116.5	-93.1	0	0	0	107.4
142	S	67.1	Low	63.9	Low	101 Å²	101	142.7 Å²	142.7	71%	0.706	81%	0.805	S	S	*	*				74	102.1	92.4	-166.4	0	0	0	0	112.9
143	S	62.1	Low	63.7	Low	112 Å²	112	139.7 Å²	139.7	78%	0.783	80%	0.796	S	S	*	*			trans	-61.2	133.7	160.9	41.8	0	0	0	0	112.1
144	D	62.2	Low	64.4	Low	158 Å²	158	141.1 Å²	141.1	85%	0.845	80%	0.802	S	S	*	*				-174.4	169.8	127.6	-143.5	-17.4	0	0	0	110.2
145	E	67.1	Low	64.6	Low	177 Å²	177	138.7 Å²	138.7	83%	0.827	80%	0.798	S	S	*	*			trans	106.5	73.5	165.2	-138.4	165.6	121.9	0	0	116.2
146	T	62.3	Low	64.3	Low	133 Å²	133	135.8 Å²	135.8	82%	0.816	80%	0.798	S	S	*	*			trans	-54.1	127.1	145.6	52	0	0	0	0	111.4
147	A	62.3	Low	64.5	Low	85 Å²	85	145.5 Å²	145.5	70%	0.702	82%	0.819	S	S	*	*			trans	-136.2	98.7	158.6	0	0	0	0	0	109.3
148	S	67.6	Low	64.4	Low	113 Å²	113	147.2 Å²	147.2	79%	0.79	82%	0.821	S	S	*	*			trans	-76	121.6	160.3	64.7	0	0	0	0	108.4
149	Y	66.4	Low	64.5	Low	222 Å²	222	145.2 Å²	145.2	87%	0.871	82%	0.819	S	S	*	*			trans	-106.2	97.5	168.1	-122.8	-92.6	0	0	0	108.2	G151	Y149-G151 PolarHBondContact O-N 3.31Å
150	D	64.9	Low	64.6	Low	162 Å²	162	144.2 Å²	144.2	87%	0.866	82%	0.816	S	S	*	*			trans	-78.6	94.4	160.5	-93.3	-38.7	0	0	0	107.8	N152	D150-N152 PolarHBondContact O-N 3.06Å
151	G	63.6	Low	64.5	Low	70 Å²	70	146.5 Å²	146.5	72%	0.722	82%	0.821	S	S	*	*			trans	-85.3	88.1	174.3	0	0	0	0	0	111	Y149	Y149-G151 PolarHBondContact O-N 3.31Å
152	N	64.7	Low	64.7	Low	147 Å²	147	143.1 Å²	143.1	79%	0.786	82%	0.817	S	S	*	*			trans	-10.3	132.1	162.5	-165.4	39.1	0	0	0	118.2	D150	D150-N152 PolarHBondContact O-N 3.06Å
153	A	60.1	Low	64.5	Low	77 Å²	77	145.9 Å²	145.9	64%	0.636	82%	0.824	S	S	*	*			trans	-58.3	150.5	170.8	0	0	0	0	0	114.1
154	L	71.5	Confident	64.7	Low	166 Å²	166	148.3 Å²	148.3	87%	0.869	83%	0.827	S	S	*	*			trans	-179.5	100.1	134	-97.3	145.4	0	0	0	110.1
155	S	66.3	Low	64.9	Low	116 Å²	116	147.5 Å²	147.5	81%	0.811	83%	0.826	S	S	*	*			trans	-127	166.8	157.4	-66.2	0	0	0	0	107
156	P	63	Low	64.7	Low	124 Å²	124	145.1 Å²	145.1	81%	0.805	83%	0.825	S	S	*	*				-118.7	166.4	-88.3	22.7	-1.1	0	0	0	111.1
157	R	64.2	Low	64.9	Low	326 Å²	326	146.2 Å²	146.2	100%	1.23	83%	0.826	S	S	*	*			trans	-142.7	0	152.4	-107.4	-170.4	169.5	-163.1	-3.2	109.4

Retrieved 157 of 157 residues in 105.1 ms (Link to these results)

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