A0A077ZIX3_TRITR Loading...

NIDO domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZIX3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 108 aa.

						>A0A077ZIX3_TRITR|A0A077ZIX3
MKLGIGQPLGPAAYGYTKGYRKAQAGYVEDDEFLDKITDEIQKGINGANGFRAFHCLVVTWERMAYGGSPKIVDLENYESAKRWVRNNEACDPLTYELFLWKIIRLVK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	32	Very low	44.6	Very low	226 Å²	226	97.3 Å²	97.3	100%	1.113	55%	0.554	S	S	*	*				0	111.4	0	-94.1	170	166.3	0	0	106.4	L3	M1-L3 PolarHBondContact O-N 3.27Å
2	K	43.5	Very low	44.5	Very low	192 Å²	192	90.9 Å²	90.9	84%	0.835	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-66.9	120.8	176.2	-83.6	-179.3	173.8	176.7	0	108.7
3	L	41.3	Very low	44.4	Very low	84 Å²	84	88.6 Å²	88.6	44%	0.44	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-67.8	130.9	175.4	-78.6	139.1	0	0	0	109.7	M1 Q7 L9	M1-L3 PolarHBondContact O-N 3.27Å; L3-Q7 HydrophobicContact CD2-CB 4.5Å; L3-L9 HydrophobicContact CB-CD2 3.93Å; L3-L9 HydrophobicContact CD1-CD2 3.3Å; L3-L9 HydrophobicContact CD2-CD2 4.03Å; L3-L9 HydrophobicContact CG-CD2 3.9Å
4	G	39.8	Very low	44.1	Very low	32 Å²	32	93.1 Å²	93.1	33%	0.33	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-71.3	152.8	-177.5	0	0	0	0	0	112.4	G6 Q7	G4-G6 PolarHBondContact O-N 3.22Å; G4-Q7 PolarHBondContact O-N 2.93Å; G4-Q7 VanDerWaalsContact O-N 3.16Å
5	I	49.5	Very low	43.8	Very low	144 Å²	144	91.4 Å²	91.4	74%	0.738	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	126.8	173.1	-63.6	172.5	0	0	0	108.8	A23	I5-A23 VanDerWaalsContact CG2-O 3.24Å; I5-A23 WeakPolarHBondContact CG2-O 3.31Å
6	G	46.5	Very low	43.8	Very low	23 Å²	23	87.3 Å²	87.3	24%	0.237	51%	0.51	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	-1	-179.4	0	0	0	0	0	116.6	G4 K22	G4-G6 PolarHBondContact O-N 3.22Å; G6-K22 PolarHBondContact N-O 3.41Å
7	Q	47.2	Very low	44.1	Very low	96 Å²	96	89.8 Å²	89.8	45%	0.449	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-77.1	132.8	171.4	-69.7	179.3	-17.6	0	0	110.2	L3 G4 L9	L3-Q7 HydrophobicContact CD2-CB 4.5Å; G4-Q7 PolarHBondContact O-N 2.93Å; G4-Q7 VanDerWaalsContact O-N 3.16Å; Q7-L9 PolarHBondContact O-N 2.97Å; Q7-L9 VanDerWaalsContact O-N 3.17Å
8	P	48.4	Very low	44.4	Very low	99 Å²	99	93.4 Å²	93.4	64%	0.643	54%	0.535	S	S	*	.	B	Isolated β-bridge	trans	-63.3	120.3	174	26.4	-31.7	0	0	0	107.7	G10	P8-G10 PolarHBondContact O-N 2.78Å
9	L	47.5	Very low	44.8	Very low	12 Å²	12	90.6 Å²	90.6	6%	0.063	53%	0.528	C	S	.	.	P	Polyproline II helix	trans	-73	130.5	169.6	-67.1	167.2	0	0	0	106.4	L3 Q7 G19 Y20 K22	L3-L9 HydrophobicContact CB-CD2 3.93Å; L3-L9 HydrophobicContact CD1-CD2 3.3Å; L3-L9 HydrophobicContact CD2-CD2 4.03Å; L3-L9 HydrophobicContact CG-CD2 3.9Å; Q7-L9 PolarHBondContact O-N 2.97Å; Q7-L9 VanDerWaalsContact O-N 3.17Å; L9-G19 WeakPolarHBondContact O-CA 3.46Å; L9-Y20 HydrophobicContact CB-CD2 4.15Å; L9-Y20 HydrophobicContact CB-CE1 3.97Å; L9-Y20 HydrophobicContact CB-CE2 3.61Å; L9-Y20 VanDerWaalsContact CB-CZ 3.47Å; L9-Y20 HydrophobicContact CD1-CD2 3.79Å; L9-Y20 HydrophobicContact CD1-CE2 3.18Å; L9-Y20 HydrophobicContact CG-CE2 4.02Å; L9-Y20 PolarHBondContact N-O 2.93Å; L9-K22 HydrophobicContact CD1-CB 4.39Å; L9-K22 HydrophobicContact CD1-CD 3.51Å; L9-K22 HydrophobicContact CD1-CG 3.53Å; L9-K22 HydrophobicContact CG-CD 4.46Å
10	G	47.6	Very low	45.4	Very low	50 Å²	50	88.5 Å²	88.5	52%	0.515	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-49.8	164.2	-176.1	0	0	0	0	0	112.5	P8 A12	P8-G10 PolarHBondContact O-N 2.78Å; G10-A12 PolarHBondContact O-N 3.43Å
11	P	46.9	Very low	45.9	Very low	112 Å²	112	91.1 Å²	91.1	73%	0.727	51%	0.512	S	S	*	.	S	Bend	trans	-55.6	96.6	-170.9	24.1	-34.3	0	0	0	110.2	A13	P11-A13 PolarHBondContact O-N 3.5Å
12	A	44	Very low	46.9	Very low	21 Å²	21	82 Å²	82	17%	0.174	47%	0.467	C	S	.	.			trans	-81.7	125.6	-171.7	0	0	0	0	0	109.6	G10 Y14 Y20	G10-A12 PolarHBondContact O-N 3.43Å; A12-Y14 PolarHBondContact O-N 3.05Å; A12-Y20 HydrophobicContact CB-CD1 4.41Å; A12-Y20 HydrophobicContact CB-CE1 3.31Å; A12-Y20 WeakPolarHBondContact CB-OH 3.48Å
13	A	43.3	Very low	47.6	Very low	61 Å²	61	73.8 Å²	73.8	50%	0.504	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.1	-26.7	147.8	0	0	0	0	0	122.3	P11 Y78 K82	P11-A13 PolarHBondContact O-N 3.5Å; A13-Y78 HydrophobicContact CB-CE1 3.64Å; A13-K82 VanDerWaalsContact CB-NZ 3.34Å
14	Y	39.4	Very low	48.3	Very low	152 Å²	152	76.4 Å²	76.4	60%	0.596	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.2	10.6	-176.9	-75.8	-71.3	0	0	0	112.4	A12 Y16 Y78	A12-Y14 PolarHBondContact O-N 3.05Å; Y14-Y16 VanDerWaalsContact CB-CD2 3.48Å; Y14-Y16 HydrophobicContact CD2-CE2 4.15Å; Y14-Y16 AromaticContact CG-CE2 3.94Å; Y14-Y16 HydrophobicContact CG-CE2 3.94Å; Y14-Y78 WeakPolarHBondContact CE2-OH 3.44Å
15	G	40.3	Very low	49.1	Very low	67 Å²	67	79.2 Å²	79.2	69%	0.691	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	22.3	175.9	0	0	0	0	0	114.7
16	Y	44	Very low	49.2	Very low	26 Å²	26	74.9 Å²	74.9	10%	0.102	46%	0.456	C	S	.	.			trans	-68.7	130.5	174.7	-66.3	-83.1	0	0	0	110.9	Y14 E32 F33 K36	Y14-Y16 VanDerWaalsContact CB-CD2 3.48Å; Y14-Y16 HydrophobicContact CD2-CE2 4.15Å; Y14-Y16 AromaticContact CG-CE2 3.94Å; Y14-Y16 HydrophobicContact CG-CE2 3.94Å; Y16-E32 HydrophobicContact CD1-CB 4.04Å; Y16-E32 HydrophobicContact CD1-CG 3.87Å; Y16-E32 VanDerWaalsContact CD1-OE1 3.22Å; Y16-E32 WeakPolarHBondContact CD1-OE1 3.41Å; Y16-E32 HydrophobicContact CE1-CB 4.34Å; Y16-E32 HydrophobicContact CE1-CG 4.18Å; Y16-F33 WeakPolarHBondContact OH-CD2 3.13Å; Y16-K36 HydrophobicContact CE1-CD 3.64Å
17	T	47.8	Very low	49.7	Very low	130 Å²	130	78.8 Å²	78.8	80%	0.798	46%	0.464	S	S	*	.	S	Bend	trans	-83.5	-28.1	179.5	62.2	0	0	0	0	111.8
18	K	51	Low	50.5	Low	155 Å²	155	76.6 Å²	76.6	67%	0.674	46%	0.457	S	S	*	.	S	Bend	trans	-100.8	125.6	174.4	-75.2	-177.7	176.2	178.1	0	109.5	E32	K18-E32 PolarHBondContact N-OE2 3.27Å
19	G	52	Low	51.3	Low	39 Å²	39	75.9 Å²	75.9	40%	0.402	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-64.9	140.4	174.1	0	0	0	0	0	110.8	L9	L9-G19 WeakPolarHBondContact O-CA 3.46Å
20	Y	55.3	Low	52.4	Low	48 Å²	48	76.7 Å²	76.7	19%	0.188	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-77.4	144.5	173.6	50.6	-77.9	0	0	0	110	L9 A12 V28	L9-Y20 HydrophobicContact CB-CD2 4.15Å; L9-Y20 HydrophobicContact CB-CE1 3.97Å; L9-Y20 HydrophobicContact CB-CE2 3.61Å; L9-Y20 VanDerWaalsContact CB-CZ 3.47Å; L9-Y20 HydrophobicContact CD1-CD2 3.79Å; L9-Y20 HydrophobicContact CD1-CE2 3.18Å; L9-Y20 HydrophobicContact CG-CE2 4.02Å; L9-Y20 PolarHBondContact N-O 2.93Å; A12-Y20 HydrophobicContact CB-CD1 4.41Å; A12-Y20 HydrophobicContact CB-CE1 3.31Å; A12-Y20 WeakPolarHBondContact CB-OH 3.48Å; Y20-V28 HydrophobicContact CD2-CG1 3.43Å; Y20-V28 VanDerWaalsContact CD2-CG1 3.43Å; Y20-V28 HydrophobicContact CD2-CG2 4.44Å; Y20-V28 HydrophobicContact CE2-CG1 4.45Å; Y20-V28 HydrophobicContact CG-CG1 3.9Å
21	R	56.1	Low	53.6	Low	144 Å²	144	80.1 Å²	80.1	54%	0.543	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	117.7	-178.4	-167.4	179	-176.7	-175.6	-1.3	109.3	A23 E29	R21-A23 PolarHBondContact O-N 3.36Å; R21-E29 PolarHBondContact N-O 3.41Å; R21-E29 PolarHBondContact O-N 3.05Å
22	K	54.5	Low	54.8	Low	34 Å²	34	77.1 Å²	77.1	15%	0.148	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	102.9	165.5	-93.4	-176.4	-173.6	162.4	0	108.5	G6 L9 V28	G6-K22 PolarHBondContact N-O 3.41Å; L9-K22 HydrophobicContact CD1-CB 4.39Å; L9-K22 HydrophobicContact CD1-CD 3.51Å; L9-K22 HydrophobicContact CD1-CG 3.53Å; L9-K22 HydrophobicContact CG-CD 4.46Å; K22-V28 HydrophobicContact CG-CG2 4.22Å
23	A	58.3	Low	56.2	Low	21 Å²	21	79.2 Å²	79.2	17%	0.174	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	-43.2	175.4	0	0	0	0	0	111.1	I5 R21 Y27 E29	I5-A23 VanDerWaalsContact CG2-O 3.24Å; I5-A23 WeakPolarHBondContact CG2-O 3.31Å; R21-A23 PolarHBondContact O-N 3.36Å; A23-Y27 HydrophobicContact CB-CD1 3.72Å; A23-Y27 HydrophobicContact CB-CE1 3.91Å; A23-Y27 PolarHBondContact N-O 2.68Å; A23-E29 HydrophobicContact CB-CG 4.05Å
24	Q	54.6	Low	57.7	Low	138 Å²	138	77.6 Å²	77.6	65%	0.645	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.1	168.3	178.1	-60.8	-176.7	0.1	0	0	111.7	G26 Y27	Q24-G26 PolarHBondContact O-N 2.89Å; Q24-G26 VanDerWaalsContact O-N 3.14Å; Q24-Y27 PolarHBondContact N-O 2.88Å; Q24-Y27 PolarHBondContact O-N 3.19Å
25	A	56.3	Low	59.6	Low	91 Å²	91	74.7 Å²	74.7	75%	0.752	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	118.1	178.8	0	0	0	0	0	111	Y27	A25-Y27 VanDerWaalsContact C-N 3.27Å; A25-Y27 PolarHBondContact O-N 2.97Å
26	G	52.9	Low	61.3	Low	54 Å²	54	75 Å²	75	56%	0.557	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	4.1	-176.2	0	0	0	0	0	115.2	Q24	Q24-G26 PolarHBondContact O-N 2.89Å; Q24-G26 VanDerWaalsContact O-N 3.14Å
27	Y	55.9	Low	62.8	Low	104 Å²	104	75.3 Å²	75.3	41%	0.408	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	123.1	177.4	-179.4	-100	0	0	0	110.3	A23 Q24 A25 E29	A23-Y27 HydrophobicContact CB-CD1 3.72Å; A23-Y27 HydrophobicContact CB-CE1 3.91Å; A23-Y27 PolarHBondContact N-O 2.68Å; Q24-Y27 PolarHBondContact N-O 2.88Å; Q24-Y27 PolarHBondContact O-N 3.19Å; A25-Y27 VanDerWaalsContact C-N 3.27Å; A25-Y27 PolarHBondContact O-N 2.97Å; Y27-E29 HydrophobicContact CD1-CG 4.43Å; Y27-E29 HydrophobicContact CE1-CG 3.54Å
28	V	63.8	Low	64.3	Low	50 Å²	50	69.7 Å²	69.7	30%	0.303	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	128.6	-176.1	172.9	0	0	0	0	107.8	Y20 K22 D30 L75	Y20-V28 HydrophobicContact CD2-CG1 3.43Å; Y20-V28 VanDerWaalsContact CD2-CG1 3.43Å; Y20-V28 HydrophobicContact CD2-CG2 4.44Å; Y20-V28 HydrophobicContact CE2-CG1 4.45Å; Y20-V28 HydrophobicContact CG-CG1 3.9Å; K22-V28 HydrophobicContact CG-CG2 4.22Å; V28-D30 HydrophobicContact CG1-CB 4.37Å; V28-L75 HydrophobicContact CG2-CD1 3.92Å
29	E	66.8	Low	65.7	Low	84 Å²	84	65.6 Å²	65.6	39%	0.393	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	113.7	171.1	-67	177.1	172.3	0	0	108	R21 A23 Y27	R21-E29 PolarHBondContact N-O 3.41Å; R21-E29 PolarHBondContact O-N 3.05Å; A23-E29 HydrophobicContact CB-CG 4.05Å; Y27-E29 HydrophobicContact CD1-CG 4.43Å; Y27-E29 HydrophobicContact CE1-CG 3.54Å
30	D	69.3	Low	66.9	Low	30 Å²	30	70.4 Å²	70.4	16%	0.16	36%	0.364	C	S	.	.			trans	-139.2	90.4	178.6	-169.8	-17.2	0	0	0	109.6	V28 E32 F33 L34	V28-D30 HydrophobicContact CG1-CB 4.37Å; D30-E32 VanDerWaalsContact C-N 3.31Å; D30-E32 PolarHBondContact OD1-N 3.03Å; D30-F33 HydrophobicContact CB-CB 3.88Å; D30-F33 PolarHBondContact O-N 2.79Å; D30-F33 PolarHBondContact OD1-N 2.97Å; D30-L34 PolarHBondContact O-N 3.18Å
31	D	73	Confident	67.9	Low	122 Å²	122	70.3 Å²	70.3	65%	0.652	37%	0.367	S	S	*	.	H	α-helix	trans	-66.7	-33.8	179.6	-62.2	-30.8	0	0	0	111.6	F33 L34 D35	D31-F33 VanDerWaalsContact C-N 3.3Å; D31-F33 PolarHBondContact O-N 3.11Å; D31-L34 PolarHBondContact O-N 3.15Å; D31-D35 PolarHBondContact O-N 2.94Å
32	E	73.2	Confident	69	Low	48 Å²	48	66.9 Å²	66.9	22%	0.224	36%	0.356	C	S	.	.	H	α-helix	trans	-67.3	-35.7	179.8	-161.6	-170.9	140.2	0	0	110.6	Y16 K18 D30 K36	Y16-E32 HydrophobicContact CD1-CB 4.04Å; Y16-E32 HydrophobicContact CD1-CG 3.87Å; Y16-E32 VanDerWaalsContact CD1-OE1 3.22Å; Y16-E32 WeakPolarHBondContact CD1-OE1 3.41Å; Y16-E32 HydrophobicContact CE1-CB 4.34Å; Y16-E32 HydrophobicContact CE1-CG 4.18Å; K18-E32 PolarHBondContact N-OE2 3.27Å; D30-E32 VanDerWaalsContact C-N 3.31Å; D30-E32 PolarHBondContact OD1-N 3.03Å; E32-K36 WeakPolarHBondContact O-CG 3.33Å; E32-K36 PolarHBondContact O-N 3.2Å; E32-K36 VanDerWaalsContact O-N 3.13Å; E32-K36 WeakPolarHBondContact OE1-CE 3.36Å; E32-K36 IonicContact OE1-NZ 2.82Å; E32-K36 PolarHBondContact OE1-NZ 2.98Å
33	F	71.8	Confident	70	Confident	65 Å²	65	72.6 Å²	72.6	29%	0.285	38%	0.381	S	S	.	.	H	α-helix	trans	-66.1	-43.2	172.8	-174.8	-118.5	0	0	0	112.4	Y16 D30 D31 D35 K36 I37 V58	Y16-F33 WeakPolarHBondContact OH-CD2 3.13Å; D30-F33 HydrophobicContact CB-CB 3.88Å; D30-F33 PolarHBondContact O-N 2.79Å; D30-F33 PolarHBondContact OD1-N 2.97Å; D31-F33 VanDerWaalsContact C-N 3.3Å; D31-F33 PolarHBondContact O-N 3.11Å; F33-D35 PolarHBondContact O-N 2.82Å; F33-K36 PolarHBondContact O-N 3.24Å; F33-I37 HydrophobicContact CD1-CD1 3.77Å; F33-I37 HydrophobicContact CE1-CD1 3.38Å; F33-I37 HydrophobicContact CE1-CG1 4.42Å; F33-I37 HydrophobicContact CE2-CD1 4.19Å; F33-I37 HydrophobicContact CE2-CG1 4.44Å; F33-I37 HydrophobicContact CG-CD1 4.33Å; F33-I37 HydrophobicContact CZ-CD1 3.62Å; F33-I37 HydrophobicContact CZ-CG1 4.29Å; F33-I37 WeakPolarHBondContact O-CG1 3.27Å; F33-I37 PolarHBondContact O-N 3.14Å; F33-V58 HydrophobicContact CE1-CG2 3.86Å; F33-V58 HydrophobicContact CZ-CG2 4.18Å
34	L	75.9	Confident	70.8	Confident	27 Å²	27	74.6 Å²	74.6	14%	0.141	40%	0.404	C	S	.	.	H	α-helix	trans	-63.9	-39.3	176.9	-69.3	176.4	0	0	0	112.6	D30 D31 I37 T38 A53 F54 C56	D30-L34 PolarHBondContact O-N 3.18Å; D31-L34 PolarHBondContact O-N 3.15Å; L34-I37 PolarHBondContact O-N 3.46Å; L34-T38 WeakPolarHBondContact O-CB 3.4Å; L34-T38 PolarHBondContact O-N 3.14Å; L34-T38 PolarHBondContact O-OG1 3.39Å; L34-A53 HydrophobicContact CD2-CB 4.17Å; L34-F54 WeakPolarHBondContact CD1-O 3.5Å; L34-C56 HydrophobicContact CD2-CB 3.76Å
35	D	79.5	Confident	71.6	Confident	92 Å²	92	71.5 Å²	71.5	49%	0.492	39%	0.391	S	S	.	.	H	α-helix	trans	-65.3	-41.1	176.4	-76.7	-18.5	0	0	0	111.4	D31 F33 T38 D39	D31-D35 PolarHBondContact O-N 2.94Å; F33-D35 PolarHBondContact O-N 2.82Å; D35-T38 WeakPolarHBondContact O-CB 2.99Å; D35-T38 PolarHBondContact O-N 3.4Å; D35-D39 WeakPolarHBondContact O-CB 3.31Å; D35-D39 PolarHBondContact O-N 3.35Å
36	K	75	Confident	72.3	Confident	73 Å²	73	75.2 Å²	75.2	32%	0.317	40%	0.398	S	S	.	.	H	α-helix	trans	-64.3	-44.8	175.1	-74.3	179.1	-166.2	168.9	0	112.3	Y16 E32 F33 T38 D39 E40	Y16-K36 HydrophobicContact CE1-CD 3.64Å; E32-K36 WeakPolarHBondContact O-CG 3.33Å; E32-K36 PolarHBondContact O-N 3.2Å; E32-K36 VanDerWaalsContact O-N 3.13Å; E32-K36 WeakPolarHBondContact OE1-CE 3.36Å; E32-K36 IonicContact OE1-NZ 2.82Å; E32-K36 PolarHBondContact OE1-NZ 2.98Å; F33-K36 PolarHBondContact O-N 3.24Å; K36-T38 VanDerWaalsContact C-N 3.26Å; K36-T38 PolarHBondContact O-N 3.1Å; K36-D39 PolarHBondContact O-N 3.34Å; K36-E40 WeakPolarHBondContact O-CB 3.47Å; K36-E40 WeakPolarHBondContact O-CG 3.29Å; K36-E40 PolarHBondContact O-N 2.95Å
37	I	76.7	Confident	73.5	Confident	32 Å²	32	76.6 Å²	76.6	16%	0.164	41%	0.412	C	S	.	.	H	α-helix	trans	-58.4	-43.9	174.3	-71.9	170.3	0	0	0	110.3	F33 L34 E40 I41 A53 C56	F33-I37 HydrophobicContact CD1-CD1 3.77Å; F33-I37 HydrophobicContact CE1-CD1 3.38Å; F33-I37 HydrophobicContact CE1-CG1 4.42Å; F33-I37 HydrophobicContact CE2-CD1 4.19Å; F33-I37 HydrophobicContact CE2-CG1 4.44Å; F33-I37 HydrophobicContact CG-CD1 4.33Å; F33-I37 HydrophobicContact CZ-CD1 3.62Å; F33-I37 HydrophobicContact CZ-CG1 4.29Å; F33-I37 WeakPolarHBondContact O-CG1 3.27Å; F33-I37 PolarHBondContact O-N 3.14Å; L34-I37 PolarHBondContact O-N 3.46Å; I37-E40 PolarHBondContact O-N 3.48Å; I37-I41 HydrophobicContact CG2-CD1 3.61Å; I37-I41 HydrophobicContact CG2-CG1 4.34Å; I37-I41 WeakPolarHBondContact O-CB 3.35Å; I37-I41 VanDerWaalsContact O-CG1 3.28Å; I37-I41 WeakPolarHBondContact O-CG1 3.34Å; I37-I41 PolarHBondContact O-N 3.46Å; I37-A53 HydrophobicContact CG2-CB 4.2Å; I37-C56 HydrophobicContact CD1-CB 4.01Å
38	T	79.1	Confident	74.4	Confident	12 Å²	12	72.3 Å²	72.3	7%	0.074	40%	0.398	C	S	.	.	H	α-helix	trans	-59.4	-48.7	178.4	-62.8	0	0	0	0	110.9	L34 D35 K36 I41 Q42 F51 R52 A53	L34-T38 WeakPolarHBondContact O-CB 3.4Å; L34-T38 PolarHBondContact O-N 3.14Å; L34-T38 PolarHBondContact O-OG1 3.39Å; D35-T38 WeakPolarHBondContact O-CB 2.99Å; D35-T38 PolarHBondContact O-N 3.4Å; K36-T38 VanDerWaalsContact C-N 3.26Å; K36-T38 PolarHBondContact O-N 3.1Å; T38-I41 PolarHBondContact O-N 2.88Å; T38-Q42 HydrophobicContact CG2-CG 4.43Å; T38-Q42 WeakPolarHBondContact O-CB 3.47Å; T38-Q42 VanDerWaalsContact O-CG 3.27Å; T38-Q42 WeakPolarHBondContact O-CG 3.38Å; T38-Q42 PolarHBondContact O-N 3.39Å; T38-F51 WeakPolarHBondContact CG2-O 3.46Å; T38-R52 HydrophobicContact CG2-CB 4.48Å; T38-R52 HydrophobicContact CG2-CG 4.47Å; T38-A53 WeakPolarHBondContact OG1-CB 3.36Å; T38-A53 PolarHBondContact OG1-N 3.47Å
39	D	79.8	Confident	75	Confident	69 Å²	69	77 Å²	77	37%	0.369	42%	0.422	S	S	.	.	H	α-helix	trans	-63.3	-44.5	179.4	-174.7	57.2	0	0	0	112.4	D35 K36 I41 Q42 K43	D35-D39 WeakPolarHBondContact O-CB 3.31Å; D35-D39 PolarHBondContact O-N 3.35Å; K36-D39 PolarHBondContact O-N 3.34Å; D39-I41 PolarHBondContact O-N 3.26Å; D39-Q42 PolarHBondContact O-N 2.91Å; D39-K43 WeakPolarHBondContact O-CB 3.4Å; D39-K43 WeakPolarHBondContact O-CG 3.5Å; D39-K43 PolarHBondContact O-N 3.28Å; D39-K43 WeakPolarHBondContact OD1-CE 3.5Å; D39-K43 IonicContact OD1-NZ 2.88Å; D39-K43 PolarHBondContact OD1-NZ 2.76Å; D39-K43 IonicContact OD2-NZ 2.68Å; D39-K43 PolarHBondContact OD2-NZ 3.16Å
40	E	77.6	Confident	75.5	Confident	140 Å²	140	76 Å²	76	65%	0.654	43%	0.434	S	S	*	.	H	α-helix	trans	-62.2	-42.5	176.6	-76.1	-175.6	-178.5	0	0	112.1	K36 I37 K43 G44	K36-E40 WeakPolarHBondContact O-CB 3.47Å; K36-E40 WeakPolarHBondContact O-CG 3.29Å; K36-E40 PolarHBondContact O-N 2.95Å; I37-E40 PolarHBondContact O-N 3.48Å; E40-K43 PolarHBondContact O-N 3.4Å; E40-G44 WeakPolarHBondContact O-CA 3.3Å; E40-G44 PolarHBondContact O-N 3.46Å
41	I	75.1	Confident	75.9	Confident	47 Å²	47	77.7 Å²	77.7	24%	0.241	44%	0.44	C	S	.	.	H	α-helix	trans	-68.1	-44.2	178.4	-71.7	174.1	0	0	0	110.9	I37 T38 D39 K43 G44 I45 A48 F51	I37-I41 HydrophobicContact CG2-CD1 3.61Å; I37-I41 HydrophobicContact CG2-CG1 4.34Å; I37-I41 WeakPolarHBondContact O-CB 3.35Å; I37-I41 VanDerWaalsContact O-CG1 3.28Å; I37-I41 WeakPolarHBondContact O-CG1 3.34Å; I37-I41 PolarHBondContact O-N 3.46Å; T38-I41 PolarHBondContact O-N 2.88Å; D39-I41 PolarHBondContact O-N 3.26Å; I41-K43 VanDerWaalsContact C-N 3.3Å; I41-K43 PolarHBondContact O-N 2.9Å; I41-G44 PolarHBondContact O-N 2.79Å; I41-I45 HydrophobicContact CG2-CD1 4.27Å; I41-I45 WeakPolarHBondContact O-CB 3.28Å; I41-I45 PolarHBondContact O-N 3.34Å; I41-A48 HydrophobicContact CG2-CB 3.87Å; I41-F51 HydrophobicContact CB-CD1 4.03Å; I41-F51 HydrophobicContact CB-CE1 4.19Å; I41-F51 HydrophobicContact CD1-CD1 4.28Å; I41-F51 HydrophobicContact CD1-CE1 3.57Å; I41-F51 HydrophobicContact CD1-CZ 4.02Å; I41-F51 HydrophobicContact CG1-CE1 4.47Å; I41-F51 HydrophobicContact CG2-CB 4.48Å; I41-F51 HydrophobicContact CG2-CD1 3.59Å; I41-F51 HydrophobicContact CG2-CE1 3.97Å; I41-F51 HydrophobicContact CG2-CG 4.01Å
42	Q	79.5	Confident	76.3	Confident	71 Å²	71	79.3 Å²	79.3	33%	0.332	44%	0.437	S	S	.	.	H	α-helix	trans	-61.7	-39	178.2	-76.6	-174.3	-1	0	0	112.2	T38 D39 A48 F51	T38-Q42 HydrophobicContact CG2-CG 4.43Å; T38-Q42 WeakPolarHBondContact O-CB 3.47Å; T38-Q42 VanDerWaalsContact O-CG 3.27Å; T38-Q42 WeakPolarHBondContact O-CG 3.38Å; T38-Q42 PolarHBondContact O-N 3.39Å; D39-Q42 PolarHBondContact O-N 2.91Å; Q42-A48 WeakPolarHBondContact CG-O 3.44Å; Q42-F51 PolarHBondContact NE2-O 3.29Å
43	K	76.7	Confident	76.3	Confident	155 Å²	155	77.7 Å²	77.7	67%	0.674	43%	0.432	S	S	*	.	H	α-helix	trans	-79.9	-35.1	178.8	-71.9	171.7	176.4	163.5	0	113.1	D39 E40 I41	D39-K43 WeakPolarHBondContact O-CB 3.4Å; D39-K43 WeakPolarHBondContact O-CG 3.5Å; D39-K43 PolarHBondContact O-N 3.28Å; D39-K43 WeakPolarHBondContact OD1-CE 3.5Å; D39-K43 IonicContact OD1-NZ 2.88Å; D39-K43 PolarHBondContact OD1-NZ 2.76Å; D39-K43 IonicContact OD2-NZ 2.68Å; D39-K43 PolarHBondContact OD2-NZ 3.16Å; E40-K43 PolarHBondContact O-N 3.4Å; I41-K43 VanDerWaalsContact C-N 3.3Å; I41-K43 PolarHBondContact O-N 2.9Å
44	G	74.4	Confident	76.4	Confident	63 Å²	63	81.5 Å²	81.5	65%	0.649	45%	0.449	S	S	*	.	H	α-helix	trans	-85.6	-23.5	-173.9	0	0	0	0	0	114.5	E40 I41	E40-G44 WeakPolarHBondContact O-CA 3.3Å; E40-G44 PolarHBondContact O-N 3.46Å; I41-G44 PolarHBondContact O-N 2.79Å
45	I	71.9	Confident	76.1	Confident	73 Å²	73	87.9 Å²	87.9	37%	0.374	48%	0.477	S	S	.	.	S	Bend	trans	-121	115.2	-173.8	-56.1	-175	0	0	0	111.1	I41 G47 A48 I104	I41-I45 HydrophobicContact CG2-CD1 4.27Å; I41-I45 WeakPolarHBondContact O-CB 3.28Å; I41-I45 PolarHBondContact O-N 3.34Å; I45-G47 PolarHBondContact O-N 3.1Å; I45-A48 HydrophobicContact CB-CB 3.89Å; I45-A48 HydrophobicContact CG2-CB 4.13Å; I45-A48 VanDerWaalsContact O-CB 3.31Å; I45-A48 WeakPolarHBondContact O-CB 3.38Å; I45-A48 PolarHBondContact O-N 3.18Å; I45-I104 HydrophobicContact CD1-CD1 3.93Å
46	N	71.6	Confident	75.4	Confident	169 Å²	169	86.5 Å²	86.5	90%	0.904	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	125.3	172.3	-77.6	-14.9	0	0	0	110.8
47	G	78.2	Confident	75	Confident	82 Å²	82	89.1 Å²	89.1	85%	0.845	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.7	-1.7	-177.2	0	0	0	0	0	114.8	I45 N49	I45-G47 PolarHBondContact O-N 3.1Å; G47-N49 PolarHBondContact O-N 3.16Å
48	A	74.2	Confident	74.4	Confident	14 Å²	14	92.2 Å²	92.2	12%	0.116	51%	0.511	C	S	.	.			trans	-82.1	9.4	171.6	0	0	0	0	0	113.3	I41 Q42 I45 G50 F51	I41-A48 HydrophobicContact CG2-CB 3.87Å; Q42-A48 WeakPolarHBondContact CG-O 3.44Å; I45-A48 HydrophobicContact CB-CB 3.89Å; I45-A48 HydrophobicContact CG2-CB 4.13Å; I45-A48 VanDerWaalsContact O-CB 3.31Å; I45-A48 WeakPolarHBondContact O-CB 3.38Å; I45-A48 PolarHBondContact O-N 3.18Å; A48-G50 PolarHBondContact O-N 3.32Å; A48-F51 HydrophobicContact CB-CB 4.26Å; A48-F51 WeakPolarHBondContact O-CB 3.48Å; A48-F51 PolarHBondContact O-N 3.32Å
49	N	75	Confident	73.2	Confident	149 Å²	149	93.7 Å²	93.7	80%	0.797	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	120.2	-180	-152.1	1.8	0	0	0	110	G47	G47-N49 PolarHBondContact O-N 3.16Å
50	G	78.3	Confident	71.9	Confident	63 Å²	63	93 Å²	93	65%	0.649	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.6	-4	-172.1	0	0	0	0	0	115.6	A48	A48-G50 PolarHBondContact O-N 3.32Å
51	F	78.3	Confident	70.6	Confident	65 Å²	65	91.2 Å²	91.2	29%	0.285	51%	0.505	S	S	.	.			trans	-58.7	139.5	168.2	175.1	-94.7	0	0	0	110.1	T38 I41 Q42 A48 A53 V107	T38-F51 WeakPolarHBondContact CG2-O 3.46Å; I41-F51 HydrophobicContact CB-CD1 4.03Å; I41-F51 HydrophobicContact CB-CE1 4.19Å; I41-F51 HydrophobicContact CD1-CD1 4.28Å; I41-F51 HydrophobicContact CD1-CE1 3.57Å; I41-F51 HydrophobicContact CD1-CZ 4.02Å; I41-F51 HydrophobicContact CG1-CE1 4.47Å; I41-F51 HydrophobicContact CG2-CB 4.48Å; I41-F51 HydrophobicContact CG2-CD1 3.59Å; I41-F51 HydrophobicContact CG2-CE1 3.97Å; I41-F51 HydrophobicContact CG2-CG 4.01Å; Q42-F51 PolarHBondContact NE2-O 3.29Å; A48-F51 HydrophobicContact CB-CB 4.26Å; A48-F51 WeakPolarHBondContact O-CB 3.48Å; A48-F51 PolarHBondContact O-N 3.32Å; F51-A53 HydrophobicContact CE1-CB 4.06Å; F51-A53 HydrophobicContact CZ-CB 4.35Å; F51-V107 HydrophobicContact CE2-CG1 4.41Å
52	R	80.3	Confident	68.9	Low	157 Å²	157	94 Å²	94	59%	0.592	52%	0.518	S	S	*	.			trans	-139.8	124.3	173.1	-171.3	175.4	-177.7	-179.8	-0.1	109.9	T38 F54	T38-R52 HydrophobicContact CG2-CB 4.48Å; T38-R52 HydrophobicContact CG2-CG 4.47Å; R52-F54 WeakPolarHBondContact O-CD2 3.2Å; R52-F54 PolarHBondContact O-N 3.47Å
53	A	73.6	Confident	67.2	Low	13 Å²	13	94.1 Å²	94.1	11%	0.107	52%	0.515	C	S	.	.			trans	-76.4	115	176.2	0	0	0	0	0	109.8	L34 I37 T38 F51	L34-A53 HydrophobicContact CD2-CB 4.17Å; I37-A53 HydrophobicContact CG2-CB 4.2Å; T38-A53 WeakPolarHBondContact OG1-CB 3.36Å; T38-A53 PolarHBondContact OG1-N 3.47Å; F51-A53 HydrophobicContact CE1-CB 4.06Å; F51-A53 HydrophobicContact CZ-CB 4.35Å
54	F	73.3	Confident	65.7	Low	146 Å²	146	90.3 Å²	90.3	64%	0.64	50%	0.5	S	S	*	.	S	Bend	trans	-88	-33.3	172.6	-64.4	-76.6	0	0	0	112	L34 R52	L34-F54 WeakPolarHBondContact CD1-O 3.5Å; R52-F54 WeakPolarHBondContact O-CD2 3.2Å; R52-F54 PolarHBondContact O-N 3.47Å
55	H	69.6	Low	64	Low	161 Å²	161	90.3 Å²	90.3	75%	0.745	50%	0.495	S	S	*	.			trans	-144.6	147.2	-179.2	-56.5	-55.6	0	0	0	110.1
56	C	65.7	Low	62.5	Low	63 Å²	63	94 Å²	94	43%	0.426	51%	0.505	S	S	.	.			trans	-133.1	133.2	174.4	-178.1	0	0	0	0	109.8	L34 I37	L34-C56 HydrophobicContact CD2-CB 3.76Å; I37-C56 HydrophobicContact CD1-CB 4.01Å
57	L	65.3	Low	61.1	Low	127 Å²	127	89.5 Å²	89.5	67%	0.665	50%	0.499	S	S	*	.			trans	-106	104.7	170.9	-176.9	67.6	0	0	0	109.1	V59	L57-V59 HydrophobicContact CD2-CG2 3.77Å; L57-V59 HydrophobicContact CG-CG2 3.75Å; L57-V59 PolarHBondContact O-N 3.46Å
58	V	64.5	Low	59.2	Low	97 Å²	97	88.3 Å²	88.3	59%	0.588	49%	0.486	S	S	*	.			trans	-82.3	106.1	172.5	-176.4	0	0	0	0	108.6	F33	F33-V58 HydrophobicContact CE1-CG2 3.86Å; F33-V58 HydrophobicContact CZ-CG2 4.18Å
59	V	54.4	Low	57.3	Low	44 Å²	44	91.2 Å²	91.2	27%	0.267	51%	0.506	S	S	.	.			trans	-97.9	112.8	175.2	-172.9	0	0	0	0	108.3	L57 R63 M64 F99	L57-V59 HydrophobicContact CD2-CG2 3.77Å; L57-V59 HydrophobicContact CG-CG2 3.75Å; L57-V59 PolarHBondContact O-N 3.46Å; V59-R63 HydrophobicContact CG1-CB 3.72Å; V59-M64 HydrophobicContact CG1-CG 3.92Å; V59-F99 HydrophobicContact CB-CZ 4.06Å
60	T	51.9	Low	55.6	Low	53 Å²	53	88.7 Å²	88.7	33%	0.325	50%	0.497	S	S	.	.			trans	-78.6	151	168.5	57	0	0	0	0	109.9	E62 R63	T60-E62 PolarHBondContact O-N 3.02Å; T60-E62 VanDerWaalsContact O-N 3.12Å; T60-R63 WeakPolarHBondContact O-CB 3.42Å; T60-R63 PolarHBondContact O-N 3.16Å
61	W	50.1	Low	53.7	Low	103 Å²	103	92.1 Å²	92.1	39%	0.39	49%	0.494	S	S	.	.	H	α-helix	trans	-55.6	-29.9	-177.7	179.5	-94.3	0	0	0	114.5	R63 M64 A65 W84 T95	W61-R63 PolarHBondContact O-N 2.95Å; W61-R63 VanDerWaalsContact O-N 3.13Å; W61-M64 HydrophobicContact CE3-CB 4.46Å; W61-M64 HydrophobicContact CE3-CE 3.86Å; W61-M64 CarbonylContact O-C 3.59Å; W61-M64 WeakPolarHBondContact O-CA 3.42Å; W61-M64 PolarHBondContact O-N 3.28Å; W61-A65 PolarHBondContact O-N 3.45Å; W61-W84 HydrophobicContact CB-CE3 4.06Å; W61-W84 HydrophobicContact CB-CH2 3.11Å; W61-W84 HydrophobicContact CB-CZ2 3.9Å; W61-W84 HydrophobicContact CB-CZ3 3.19Å; W61-W84 AromaticContact CD1-CH2 3.19Å; W61-W84 AromaticContact CD1-CZ2 3.15Å; W61-W84 AromaticContact CD2-CH2 3.78Å; W61-W84 HydrophobicContact CD2-CH2 3.78Å; W61-W84 HydrophobicContact CD2-CZ2 4.4Å; W61-W84 AromaticContact CG-CH2 3.05Å; W61-W84 HydrophobicContact CG-CH2 3.05Å; W61-W84 AromaticContact CG-CZ2 3.58Å; W61-W84 HydrophobicContact CG-CZ2 3.58Å; W61-W84 AromaticContact CG-CZ3 3.75Å; W61-W84 HydrophobicContact CG-CZ3 3.75Å; W61-W84 AromaticContact NE1-CH2 3.9Å; W61-W84 AromaticContact NE1-CZ2 3.75Å; W61-T95 HydrophobicContact CZ3-CG2 4.39Å
62	E	39.8	Very low	52	Low	107 Å²	107	95.3 Å²	95.3	50%	0.5	51%	0.513	S	S	.	.	H	α-helix	trans	-53.9	-32.9	171.4	-80.9	-164.9	137.9	0	0	112.2	T60 Y66	T60-E62 PolarHBondContact O-N 3.02Å; T60-E62 VanDerWaalsContact O-N 3.12Å; E62-Y66 WeakPolarHBondContact O-CD2 3.15Å
63	R	44	Very low	50.2	Low	72 Å²	72	89.9 Å²	89.9	27%	0.272	50%	0.497	S	S	.	.	H	α-helix	trans	-76.8	-28.7	173.9	-66.2	-166.1	176.6	-150.6	4.2	113.2	V59 T60 W61 G68	V59-R63 HydrophobicContact CG1-CB 3.72Å; T60-R63 WeakPolarHBondContact O-CB 3.42Å; T60-R63 PolarHBondContact O-N 3.16Å; W61-R63 PolarHBondContact O-N 2.95Å; W61-R63 VanDerWaalsContact O-N 3.13Å; R63-G68 VanDerWaalsContact O-CA 3.29Å; R63-G68 WeakPolarHBondContact O-CA 3.39Å; R63-G68 PolarHBondContact O-N 2.8Å
64	M	44.8	Very low	48.9	Very low	75 Å²	75	93.1 Å²	93.1	37%	0.369	51%	0.513	S	S	.	.	H	α-helix	trans	-77.2	-44.2	176.4	-72.1	-164.4	-91.4	0	0	112.5	V59 W61 Y66 G67 F99	V59-M64 HydrophobicContact CG1-CG 3.92Å; W61-M64 HydrophobicContact CE3-CB 4.46Å; W61-M64 HydrophobicContact CE3-CE 3.86Å; W61-M64 CarbonylContact O-C 3.59Å; W61-M64 WeakPolarHBondContact O-CA 3.42Å; W61-M64 PolarHBondContact O-N 3.28Å; M64-Y66 VanDerWaalsContact C-N 3.34Å; M64-Y66 PolarHBondContact O-N 3.36Å; M64-G67 PolarHBondContact O-N 3Å; M64-F99 HydrophobicContact CE-CD2 3.81Å; M64-F99 HydrophobicContact CE-CE2 3.52Å; M64-F99 HydrophobicContact CE-CZ 3.98Å; M64-F99 HydrophobicContact CG-CE2 4.45Å; M64-F99 HydrophobicContact SD-CD2 3.69Å; M64-F99 HydrophobicContact SD-CE2 3.26Å; M64-F99 WeakPolarHBondContact SD-CE2 3.22Å; M64-F99 HydrophobicContact SD-CZ 4.15Å
65	A	40.2	Very low	47.4	Very low	64 Å²	64	89.5 Å²	89.5	53%	0.529	50%	0.499	S	S	.	.	H	α-helix	trans	-68.2	-30.4	-175.3	0	0	0	0	0	113.2	W61 G67	W61-A65 PolarHBondContact O-N 3.45Å; A65-G67 PolarHBondContact O-N 3.07Å
66	Y	40.1	Very low	46.3	Very low	150 Å²	150	86.3 Å²	86.3	59%	0.588	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	27.9	179.2	-80.6	-80.6	0	0	0	114	E62 M64 G68 S69	E62-Y66 WeakPolarHBondContact O-CD2 3.15Å; M64-Y66 VanDerWaalsContact C-N 3.34Å; M64-Y66 PolarHBondContact O-N 3.36Å; Y66-G68 VanDerWaalsContact C-N 3.26Å; Y66-G68 PolarHBondContact O-N 3.23Å; Y66-S69 PolarHBondContact O-N 3.46Å
67	G	41.1	Very low	45.2	Very low	75 Å²	75	88.4 Å²	88.4	77%	0.773	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	29.2	176.4	0	0	0	0	0	113.5	M64 A65 S69	M64-G67 PolarHBondContact O-N 3Å; A65-G67 PolarHBondContact O-N 3.07Å; G67-S69 VanDerWaalsContact C-N 3.26Å; G67-S69 PolarHBondContact O-N 3.24Å
68	G	38.6	Very low	44.2	Very low	56 Å²	56	85.4 Å²	85.4	58%	0.577	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	3.8	176.4	0	0	0	0	0	115.4	R63 Y66 P70	R63-G68 VanDerWaalsContact O-CA 3.29Å; R63-G68 WeakPolarHBondContact O-CA 3.39Å; R63-G68 PolarHBondContact O-N 2.8Å; Y66-G68 VanDerWaalsContact C-N 3.26Å; Y66-G68 PolarHBondContact O-N 3.23Å; G68-P70 WeakPolarHBondContact O-CD 3.11Å
69	S	34.7	Very low	43.3	Very low	76 Å²	76	86.4 Å²	86.4	53%	0.531	47%	0.471	S	S	.	.			trans	-68.4	124.6	177.4	-166.3	0	0	0	0	110.2	Y66 G67 K71	Y66-S69 PolarHBondContact O-N 3.46Å; G67-S69 VanDerWaalsContact C-N 3.26Å; G67-S69 PolarHBondContact O-N 3.24Å; S69-K71 PolarHBondContact O-N 3.34Å
70	P	38.5	Very low	42.9	Very low	96 Å²	96	87.8 Å²	87.8	62%	0.623	48%	0.482	S	S	*	.			trans	-71.4	91.2	-174.2	29	-34.7	0	0	0	110.4	G68	G68-P70 WeakPolarHBondContact O-CD 3.11Å
71	K	39.9	Very low	42.4	Very low	134 Å²	134	86.6 Å²	86.6	58%	0.583	48%	0.478	S	S	*	.			trans	-77.3	124.8	160	-74.5	-169.6	176.3	179.4	0	108.6	S69 V73	S69-K71 PolarHBondContact O-N 3.34Å; K71-V73 VanDerWaalsContact C-N 3.25Å; K71-V73 PolarHBondContact O-N 2.96Å
72	I	41.5	Very low	42	Very low	133 Å²	133	83.8 Å²	83.8	68%	0.682	47%	0.468	S	S	*	.			trans	-66	91.7	170.4	-59.3	169.3	0	0	0	106	D74	I72-D74 PolarHBondContact O-N 3.5Å; I72-D74 VanDerWaalsContact O-N 3.16Å
73	V	43.3	Very low	42.3	Very low	43 Å²	43	87.5 Å²	87.5	26%	0.261	48%	0.478	S	S	.	.			trans	-66.6	112.8	167.4	175.7	0	0	0	0	105.7	K71 L75	K71-V73 VanDerWaalsContact C-N 3.25Å; K71-V73 PolarHBondContact O-N 2.96Å; V73-L75 PolarHBondContact O-N 2.95Å; V73-L75 VanDerWaalsContact O-N 3.1Å
74	D	44.9	Very low	42.1	Very low	80 Å²	80	88.4 Å²	88.4	43%	0.428	48%	0.481	S	S	.	.			trans	-61.4	114.7	172.9	-165.1	-17.4	0	0	0	108.2	I72 E76 N77	I72-D74 PolarHBondContact O-N 3.5Å; I72-D74 VanDerWaalsContact O-N 3.16Å; D74-E76 PolarHBondContact O-N 2.65Å; D74-E76 VanDerWaalsContact O-N 3.09Å; D74-E76 WeakPolarHBondContact OD1-CB 3.29Å; D74-E76 WeakPolarHBondContact OD1-CG 3.42Å; D74-E76 PolarHBondContact OD1-N 3.41Å; D74-N77 PolarHBondContact O-N 2.82Å
75	L	43.2	Very low	41.8	Very low	70 Å²	70	88.7 Å²	88.7	37%	0.366	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-60.2	-16	176.4	-75	159.1	0	0	0	111.5	V28 V73 N77 Y78	V28-L75 HydrophobicContact CG2-CD1 3.92Å; V73-L75 PolarHBondContact O-N 2.95Å; V73-L75 VanDerWaalsContact O-N 3.1Å; L75-N77 PolarHBondContact O-N 3.44Å; L75-Y78 WeakPolarHBondContact O-CB 3.49Å; L75-Y78 PolarHBondContact O-N 2.94Å; L75-Y78 VanDerWaalsContact O-N 3.16Å
76	E	45.9	Very low	41.6	Very low	95 Å²	95	94.1 Å²	94.1	44%	0.444	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-63.8	-24.1	170.5	-63.9	-176.3	-174.5	0	0	112	D74 Y78	D74-E76 PolarHBondContact O-N 2.65Å; D74-E76 VanDerWaalsContact O-N 3.09Å; D74-E76 WeakPolarHBondContact OD1-CB 3.29Å; D74-E76 WeakPolarHBondContact OD1-CG 3.42Å; D74-E76 PolarHBondContact OD1-N 3.41Å; E76-Y78 VanDerWaalsContact C-N 3.31Å; E76-Y78 PolarHBondContact O-N 3.48Å
77	N	43.5	Very low	41.7	Very low	106 Å²	106	92.7 Å²	92.7	57%	0.567	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-92.4	24.7	172.5	-90.2	-9.4	0	0	0	113.7	D74 L75 E79 S80 A81	D74-N77 PolarHBondContact O-N 2.82Å; L75-N77 PolarHBondContact O-N 3.44Å; N77-E79 PolarHBondContact O-N 3.13Å; N77-S80 VanDerWaalsContact O-CB 3.32Å; N77-S80 WeakPolarHBondContact O-CB 3.08Å; N77-S80 PolarHBondContact O-N 3.16Å; N77-A81 PolarHBondContact O-N 3.31Å
78	Y	43.6	Very low	41.6	Very low	64 Å²	64	90.3 Å²	90.3	25%	0.251	47%	0.466	S	S	.	.	H	α-helix	trans	-55.6	-32.3	-179.6	172.9	-112.6	0	0	0	114.4	A13 Y14 L75 E76 S80 A81 K82	A13-Y78 HydrophobicContact CB-CE1 3.64Å; Y14-Y78 WeakPolarHBondContact CE2-OH 3.44Å; L75-Y78 WeakPolarHBondContact O-CB 3.49Å; L75-Y78 PolarHBondContact O-N 2.94Å; L75-Y78 VanDerWaalsContact O-N 3.16Å; E76-Y78 VanDerWaalsContact C-N 3.31Å; E76-Y78 PolarHBondContact O-N 3.48Å; Y78-S80 VanDerWaalsContact C-N 3.31Å; Y78-S80 PolarHBondContact O-N 3.2Å; Y78-A81 WeakPolarHBondContact O-CB 3.41Å; Y78-A81 PolarHBondContact O-N 3.23Å; Y78-K82 HydrophobicContact CE1-CD 4.25Å; Y78-K82 PolarHBondContact O-N 3.27Å; Y78-K82 WeakPolarHBondContact OH-CE 3.42Å
79	E	46.6	Very low	41.8	Very low	119 Å²	119	96 Å²	96	56%	0.556	48%	0.477	S	S	*	.	H	α-helix	trans	-63	-35.7	173.6	-75.5	-60.1	146	0	0	112.9	N77 K82 R83	N77-E79 PolarHBondContact O-N 3.13Å; E79-K82 PolarHBondContact O-N 3.31Å; E79-K82 IonicContact OE1-NZ 2.66Å; E79-K82 PolarHBondContact OE1-NZ 2.95Å; E79-K82 IonicContact OE2-NZ 3.73Å; E79-R83 PolarHBondContact O-N 3.49Å
80	S	45.8	Very low	41.9	Very low	73 Å²	73	96.7 Å²	96.7	51%	0.51	49%	0.488	S	S	.	.	H	α-helix	trans	-67.2	-40.4	174.4	-57.5	0	0	0	0	111.2	N77 Y78 K82 R83 W84	N77-S80 VanDerWaalsContact O-CB 3.32Å; N77-S80 WeakPolarHBondContact O-CB 3.08Å; N77-S80 PolarHBondContact O-N 3.16Å; Y78-S80 VanDerWaalsContact C-N 3.31Å; Y78-S80 PolarHBondContact O-N 3.2Å; S80-K82 VanDerWaalsContact C-N 3.35Å; S80-R83 PolarHBondContact O-N 3.36Å; S80-W84 PolarHBondContact O-N 2.9Å
81	A	41.5	Very low	41.9	Very low	28 Å²	28	93 Å²	93	23%	0.231	46%	0.464	C	S	.	.	H	α-helix	trans	-63.4	-40.8	174.1	0	0	0	0	0	111.7	N77 Y78 W84 V85	N77-A81 PolarHBondContact O-N 3.31Å; Y78-A81 WeakPolarHBondContact O-CB 3.41Å; Y78-A81 PolarHBondContact O-N 3.23Å; A81-W84 WeakPolarHBondContact O-CB 3.44Å; A81-W84 PolarHBondContact O-N 2.66Å; A81-V85 PolarHBondContact O-N 2.72Å
82	K	41.5	Very low	41.9	Very low	44 Å²	44	90.8 Å²	90.8	19%	0.191	46%	0.459	C	S	.	.	H	α-helix	trans	-64.5	-44.7	176.9	-115	-168.4	-86.1	158.5	0	113.2	A13 Y78 E79 S80 W84 V85 R86	A13-K82 VanDerWaalsContact CB-NZ 3.34Å; Y78-K82 HydrophobicContact CE1-CD 4.25Å; Y78-K82 PolarHBondContact O-N 3.27Å; Y78-K82 WeakPolarHBondContact OH-CE 3.42Å; E79-K82 PolarHBondContact O-N 3.31Å; E79-K82 IonicContact OE1-NZ 2.66Å; E79-K82 PolarHBondContact OE1-NZ 2.95Å; E79-K82 IonicContact OE2-NZ 3.73Å; S80-K82 VanDerWaalsContact C-N 3.35Å; K82-W84 PolarHBondContact O-N 3.45Å; K82-V85 PolarHBondContact O-N 3.21Å; K82-V85 VanDerWaalsContact O-N 3.16Å; K82-R86 PolarHBondContact O-N 3.26Å; K82-R86 VanDerWaalsContact O-N 3.07Å
83	R	44.7	Very low	41.9	Very low	185 Å²	185	89.1 Å²	89.1	70%	0.698	46%	0.457	S	S	*	.	H	α-helix	trans	-55.2	-36.2	175	-88.9	-175.9	176.9	170.2	-0.3	111.3	E79 S80 R86 N87	E79-R83 PolarHBondContact O-N 3.49Å; S80-R83 PolarHBondContact O-N 3.36Å; R83-R86 PolarHBondContact O-N 3.42Å; R83-N87 WeakPolarHBondContact O-CB 3.35Å; R83-N87 PolarHBondContact O-N 2.82Å; R83-N87 PolarHBondContact O-OD1 3.12Å
84	W	41.1	Very low	41.5	Very low	91 Å²	91	92.7 Å²	92.7	35%	0.345	47%	0.473	S	S	.	.	H	α-helix	trans	-70.6	-44	178.5	-161.3	85.6	0	0	0	112.3	W61 S80 A81 K82 R86 N87 N88	W61-W84 HydrophobicContact CB-CE3 4.06Å; W61-W84 HydrophobicContact CB-CH2 3.11Å; W61-W84 HydrophobicContact CB-CZ2 3.9Å; W61-W84 HydrophobicContact CB-CZ3 3.19Å; W61-W84 AromaticContact CD1-CH2 3.19Å; W61-W84 AromaticContact CD1-CZ2 3.15Å; W61-W84 AromaticContact CD2-CH2 3.78Å; W61-W84 HydrophobicContact CD2-CH2 3.78Å; W61-W84 HydrophobicContact CD2-CZ2 4.4Å; W61-W84 AromaticContact CG-CH2 3.05Å; W61-W84 HydrophobicContact CG-CH2 3.05Å; W61-W84 AromaticContact CG-CZ2 3.58Å; W61-W84 HydrophobicContact CG-CZ2 3.58Å; W61-W84 AromaticContact CG-CZ3 3.75Å; W61-W84 HydrophobicContact CG-CZ3 3.75Å; W61-W84 AromaticContact NE1-CH2 3.9Å; W61-W84 AromaticContact NE1-CZ2 3.75Å; S80-W84 PolarHBondContact O-N 2.9Å; A81-W84 WeakPolarHBondContact O-CB 3.44Å; A81-W84 PolarHBondContact O-N 2.66Å; K82-W84 PolarHBondContact O-N 3.45Å; W84-R86 PolarHBondContact O-N 3.41Å; W84-N87 PolarHBondContact O-N 3.3Å; W84-N87 VanDerWaalsContact O-N 3.16Å; W84-N88 HydrophobicContact CE3-CB 4.44Å; W84-N88 VanDerWaalsContact CE3-ND2 3.29Å; W84-N88 HydrophobicContact CH2-CB 4.18Å; W84-N88 VanDerWaalsContact CH2-ND2 3.29Å; W84-N88 WeakPolarHBondContact CH2-ND2 3.26Å; W84-N88 WeakPolarHBondContact CH2-OD1 3.47Å; W84-N88 VanDerWaalsContact CZ2-CG 3.42Å; W84-N88 WeakPolarHBondContact CZ2-ND2 3.47Å; W84-N88 WeakPolarHBondContact CZ2-OD1 3.36Å; W84-N88 HydrophobicContact CZ3-CB 4.06Å; W84-N88 WeakPolarHBondContact CZ3-ND2 3.43Å; W84-N88 PolarHBondContact NE1-ND2 2.96Å; W84-N88 PolarHBondContact O-N 2.88Å; W84-N88 PolarHBondContact O-ND2 3.22Å
85	V	37.8	Very low	41.3	Very low	80 Å²	80	91.6 Å²	91.6	49%	0.485	47%	0.47	S	S	.	.	H	α-helix	trans	-54.3	-43.1	173.2	175.9	0	0	0	0	110.9	A81 K82 N88	A81-V85 PolarHBondContact O-N 2.72Å; K82-V85 PolarHBondContact O-N 3.21Å; K82-V85 VanDerWaalsContact O-N 3.16Å; V85-N88 PolarHBondContact O-N 3.13Å
86	R	36.6	Very low	41.2	Very low	178 Å²	178	93.5 Å²	93.5	67%	0.672	47%	0.473	S	S	*	.	H	α-helix	trans	-70.6	-36.1	179.3	-165.3	-179.8	-64.1	171.8	-0.5	113.4	K82 R83 W84 N88	K82-R86 PolarHBondContact O-N 3.26Å; K82-R86 VanDerWaalsContact O-N 3.07Å; R83-R86 PolarHBondContact O-N 3.42Å; W84-R86 PolarHBondContact O-N 3.41Å; R86-N88 VanDerWaalsContact C-N 3.28Å; R86-N88 PolarHBondContact O-N 2.83Å
87	N	41.6	Very low	40.5	Very low	120 Å²	120	94.2 Å²	94.2	64%	0.642	48%	0.476	S	S	*	.	H	α-helix	trans	-78	-14.5	178.9	-69.6	-6.1	0	0	0	113.1	R83 W84 E89	R83-N87 WeakPolarHBondContact O-CB 3.35Å; R83-N87 PolarHBondContact O-N 2.82Å; R83-N87 PolarHBondContact O-OD1 3.12Å; W84-N87 PolarHBondContact O-N 3.3Å; W84-N87 VanDerWaalsContact O-N 3.16Å; N87-E89 PolarHBondContact O-N 3.21Å
88	N	38.2	Very low	40.1	Very low	26 Å²	26	95.1 Å²	95.1	14%	0.139	48%	0.48	C	S	.	.	G	3₁₀ helix	trans	-90.4	33.3	175.6	-77.2	-94.5	0	0	0	112.9	W84 V85 R86 A90 C91	W84-N88 HydrophobicContact CE3-CB 4.44Å; W84-N88 VanDerWaalsContact CE3-ND2 3.29Å; W84-N88 HydrophobicContact CH2-CB 4.18Å; W84-N88 VanDerWaalsContact CH2-ND2 3.29Å; W84-N88 WeakPolarHBondContact CH2-ND2 3.26Å; W84-N88 WeakPolarHBondContact CH2-OD1 3.47Å; W84-N88 VanDerWaalsContact CZ2-CG 3.42Å; W84-N88 WeakPolarHBondContact CZ2-ND2 3.47Å; W84-N88 WeakPolarHBondContact CZ2-OD1 3.36Å; W84-N88 HydrophobicContact CZ3-CB 4.06Å; W84-N88 WeakPolarHBondContact CZ3-ND2 3.43Å; W84-N88 PolarHBondContact NE1-ND2 2.96Å; W84-N88 PolarHBondContact O-N 2.88Å; W84-N88 PolarHBondContact O-ND2 3.22Å; V85-N88 PolarHBondContact O-N 3.13Å; R86-N88 VanDerWaalsContact C-N 3.28Å; R86-N88 PolarHBondContact O-N 2.83Å; N88-A90 PolarHBondContact O-N 3.43Å; N88-A90 VanDerWaalsContact O-N 3.11Å; N88-C91 HydrophobicContact CB-CB 4.18Å; N88-C91 WeakPolarHBondContact O-CB 3.22Å; N88-C91 PolarHBondContact O-N 3.29Å
89	E	43.2	Very low	39.9	Very low	174 Å²	174	95.3 Å²	95.3	81%	0.813	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-56	-14.1	151.1	-69.3	176.5	-175.1	0	0	111.5	N87	N87-E89 PolarHBondContact O-N 3.21Å
90	A	37.8	Very low	39.4	Very low	91 Å²	91	94.6 Å²	94.6	75%	0.752	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-83.1	-5.1	167.2	0	0	0	0	0	115.2	N88 D92	N88-A90 PolarHBondContact O-N 3.43Å; N88-A90 VanDerWaalsContact O-N 3.11Å; A90-D92 VanDerWaalsContact C-N 3.34Å; A90-D92 PolarHBondContact O-N 3.19Å
91	C	38.8	Very low	38.5	Very low	20 Å²	20	99.5 Å²	99.5	14%	0.135	49%	0.489	C	S	.	.	S	Bend	trans	-74.5	96.4	164.1	-92.8	0	0	0	0	107.1	N88 Y96	N88-C91 HydrophobicContact CB-CB 4.18Å; N88-C91 WeakPolarHBondContact O-CB 3.22Å; N88-C91 PolarHBondContact O-N 3.29Å; C91-Y96 HydrophobicContact CB-CD2 4.27Å; C91-Y96 HydrophobicContact CB-CE2 3.5Å; C91-Y96 VanDerWaalsContact CB-CE2 3.5Å; C91-Y96 WeakPolarHBondContact O-CE2 3.49Å
92	D	38.7	Very low	38	Very low	87 Å²	87	105.6 Å²	105.6	47%	0.465	51%	0.511	S	S	.	.			trans	-36.2	129.1	171.4	-167.1	-52.1	0	0	0	110.4	A90 L94 T95	A90-D92 VanDerWaalsContact C-N 3.34Å; A90-D92 PolarHBondContact O-N 3.19Å; D92-L94 PolarHBondContact O-N 2.95Å; D92-L94 WeakPolarHBondContact OD1-CB 3.46Å; D92-L94 WeakPolarHBondContact OD1-CG 3.37Å; D92-L94 PolarHBondContact OD1-N 3.16Å; D92-T95 VanDerWaalsContact O-CB 3.31Å; D92-T95 WeakPolarHBondContact O-CB 3.5Å; D92-T95 PolarHBondContact O-N 3.38Å; D92-T95 PolarHBondContact O-OG1 3.29Å
93	P	41.1	Very low	37.6	Very low	98 Å²	98	107.3 Å²	107.3	64%	0.636	52%	0.521	S	S	*	.	H	α-helix	trans	-48.6	-29.3	-176.6	-17.3	14.8	0	0	0	113.8	T95 Y96 E97	P93-T95 PolarHBondContact O-N 3.46Å; P93-Y96 PolarHBondContact O-N 2.87Å; P93-E97 PolarHBondContact O-N 3.46Å; P93-E97 VanDerWaalsContact O-N 3.15Å
94	L	36.5	Very low	36.9	Very low	117 Å²	117	102 Å²	102	61%	0.613	51%	0.506	S	S	*	.	H	α-helix	trans	-61.5	-28.6	176.5	-67.2	169.4	0	0	0	113.1	D92 L98	D92-L94 PolarHBondContact O-N 2.95Å; D92-L94 WeakPolarHBondContact OD1-CB 3.46Å; D92-L94 WeakPolarHBondContact OD1-CG 3.37Å; D92-L94 PolarHBondContact OD1-N 3.16Å; L94-L98 WeakPolarHBondContact O-CB 3.32Å; L94-L98 WeakPolarHBondContact O-CD1 3.11Å; L94-L98 VanDerWaalsContact O-CG 3.29Å; L94-L98 WeakPolarHBondContact O-CG 3.48Å; L94-L98 PolarHBondContact O-N 2.97Å
95	T	40.2	Very low	36.5	Very low	57 Å²	57	107.5 Å²	107.5	35%	0.35	53%	0.527	S	S	.	.	H	α-helix	trans	-72.6	-37.2	179.3	-39.3	0	0	0	0	111.2	W61 D92 P93 F99	W61-T95 HydrophobicContact CZ3-CG2 4.39Å; D92-T95 VanDerWaalsContact O-CB 3.31Å; D92-T95 WeakPolarHBondContact O-CB 3.5Å; D92-T95 PolarHBondContact O-N 3.38Å; D92-T95 PolarHBondContact O-OG1 3.29Å; P93-T95 PolarHBondContact O-N 3.46Å; T95-F99 WeakPolarHBondContact O-CB 3.37Å; T95-F99 PolarHBondContact O-N 3.45Å
96	Y	40.6	Very low	36.4	Very low	111 Å²	111	110.7 Å²	110.7	44%	0.435	54%	0.54	S	S	.	.	H	α-helix	trans	-69.3	-43.8	174.2	-72.8	-79.5	0	0	0	111.7	C91 P93 F99 L100	C91-Y96 HydrophobicContact CB-CD2 4.27Å; C91-Y96 HydrophobicContact CB-CE2 3.5Å; C91-Y96 VanDerWaalsContact CB-CE2 3.5Å; C91-Y96 WeakPolarHBondContact O-CE2 3.49Å; P93-Y96 PolarHBondContact O-N 2.87Å; Y96-F99 WeakPolarHBondContact O-CB 3.29Å; Y96-F99 PolarHBondContact O-N 2.86Å; Y96-F99 VanDerWaalsContact O-N 3.14Å; Y96-L100 PolarHBondContact O-N 3.14Å
97	E	32.3	Very low	36.5	Very low	110 Å²	110	107.3 Å²	107.3	51%	0.514	54%	0.539	S	S	.	.	H	α-helix	trans	-58	-50.1	174.9	-80.9	-71.8	145.5	0	0	111.5	P93 F99 L100 W101	P93-E97 PolarHBondContact O-N 3.46Å; P93-E97 VanDerWaalsContact O-N 3.15Å; E97-F99 PolarHBondContact O-N 3.1Å; E97-L100 PolarHBondContact O-N 3.35Å; E97-W101 WeakPolarHBondContact O-CB 3.38Å; E97-W101 PolarHBondContact O-N 2.89Å
98	L	33.7	Very low	36.4	Very low	125 Å²	125	113.2 Å²	113.2	65%	0.654	56%	0.559	S	S	*	*	H	α-helix	trans	-58.5	-32.7	176.2	-79.8	165.4	0	0	0	112.6	L94 K102	L94-L98 WeakPolarHBondContact O-CB 3.32Å; L94-L98 WeakPolarHBondContact O-CD1 3.11Å; L94-L98 VanDerWaalsContact O-CG 3.29Å; L94-L98 WeakPolarHBondContact O-CG 3.48Å; L94-L98 PolarHBondContact O-N 2.97Å; L98-K102 PolarHBondContact O-N 3.09Å; L98-K102 VanDerWaalsContact O-N 3.16Å
99	F	39.2	Very low	36.3	Very low	68 Å²	68	117.6 Å²	117.6	30%	0.298	58%	0.58	S	S	.	*	H	α-helix	trans	-77	-45.8	-178.5	-163.7	-101.5	0	0	0	112.6	V59 M64 T95 Y96 E97 W101 K102 I103	V59-F99 HydrophobicContact CB-CZ 4.06Å; M64-F99 HydrophobicContact CE-CD2 3.81Å; M64-F99 HydrophobicContact CE-CE2 3.52Å; M64-F99 HydrophobicContact CE-CZ 3.98Å; M64-F99 HydrophobicContact CG-CE2 4.45Å; M64-F99 HydrophobicContact SD-CD2 3.69Å; M64-F99 HydrophobicContact SD-CE2 3.26Å; M64-F99 WeakPolarHBondContact SD-CE2 3.22Å; M64-F99 HydrophobicContact SD-CZ 4.15Å; T95-F99 WeakPolarHBondContact O-CB 3.37Å; T95-F99 PolarHBondContact O-N 3.45Å; Y96-F99 WeakPolarHBondContact O-CB 3.29Å; Y96-F99 PolarHBondContact O-N 2.86Å; Y96-F99 VanDerWaalsContact O-N 3.14Å; E97-F99 PolarHBondContact O-N 3.1Å; F99-W101 VanDerWaalsContact C-N 3.26Å; F99-W101 PolarHBondContact O-N 3.06Å; F99-K102 PolarHBondContact O-N 3.46Å; F99-K102 VanDerWaalsContact O-N 3.1Å; F99-I103 HydrophobicContact CD1-CD1 4.18Å; F99-I103 HydrophobicContact CE1-CD1 3.76Å; F99-I103 HydrophobicContact CE1-CG1 4.46Å; F99-I103 HydrophobicContact CZ-CD1 4.44Å; F99-I103 PolarHBondContact O-N 3Å
100	L	35.8	Very low	35.9	Very low	103 Å²	103	114.6 Å²	114.6	54%	0.539	57%	0.567	S	S	.	*	H	α-helix	trans	-57	-43.2	171.3	-90.7	158.7	0	0	0	110.9	Y96 E97 K102 I103 I104	Y96-L100 PolarHBondContact O-N 3.14Å; E97-L100 PolarHBondContact O-N 3.35Å; L100-K102 VanDerWaalsContact C-N 3.3Å; L100-K102 PolarHBondContact O-N 2.98Å; L100-I103 PolarHBondContact O-N 3.3Å; L100-I104 WeakPolarHBondContact O-CD1 3.24Å; L100-I104 VanDerWaalsContact O-CG1 3.3Å; L100-I104 WeakPolarHBondContact O-CG1 3.36Å; L100-I104 PolarHBondContact O-N 3.43Å; L100-I104 VanDerWaalsContact O-N 3.1Å
101	W	26.8	Very low	35.8	Very low	177 Å²	177	115.9 Å²	115.9	67%	0.67	56%	0.557	S	S	*	*	H	α-helix	trans	-59.6	-37.6	175.2	-92.2	77.2	0	0	0	113.4	E97 F99 I104 R105	E97-W101 WeakPolarHBondContact O-CB 3.38Å; E97-W101 PolarHBondContact O-N 2.89Å; F99-W101 VanDerWaalsContact C-N 3.26Å; F99-W101 PolarHBondContact O-N 3.06Å; W101-I104 PolarHBondContact O-N 2.94Å; W101-R105 PolarHBondContact O-N 3.17Å; W101-R105 VanDerWaalsContact O-N 3.14Å
102	K	31.3	Very low	35.6	Very low	156 Å²	156	121.5 Å²	121.5	68%	0.678	58%	0.582	S	S	*	*	H	α-helix	trans	-73.9	-32.8	-178.1	-156.6	151.7	-175.5	176.8	0	112.8	L98 F99 L100	L98-K102 PolarHBondContact O-N 3.09Å; L98-K102 VanDerWaalsContact O-N 3.16Å; F99-K102 PolarHBondContact O-N 3.46Å; F99-K102 VanDerWaalsContact O-N 3.1Å; L100-K102 VanDerWaalsContact C-N 3.3Å; L100-K102 PolarHBondContact O-N 2.98Å
103	I	33.9	Very low	35.4	Very low	80 Å²	80	123.7 Å²	123.7	41%	0.41	59%	0.589	S	S	.	*	H	α-helix	trans	-66.7	-45.8	171.7	-68	177.2	0	0	0	110.3	F99 L100 R105 L106	F99-I103 HydrophobicContact CD1-CD1 4.18Å; F99-I103 HydrophobicContact CE1-CD1 3.76Å; F99-I103 HydrophobicContact CE1-CG1 4.46Å; F99-I103 HydrophobicContact CZ-CD1 4.44Å; F99-I103 PolarHBondContact O-N 3Å; L100-I103 PolarHBondContact O-N 3.3Å; I103-R105 VanDerWaalsContact C-N 3.26Å; I103-R105 PolarHBondContact O-N 3.16Å; I103-L106 PolarHBondContact O-N 3.31Å; I103-L106 VanDerWaalsContact O-N 3.16Å
104	I	30.4	Very low	35	Very low	73 Å²	73	125.4 Å²	125.4	37%	0.374	59%	0.586	S	S	.	*	H	α-helix	trans	-60	-37.9	-179.9	-67	164.6	0	0	0	111.4	I45 L100 W101 L106 V107	I45-I104 HydrophobicContact CD1-CD1 3.93Å; L100-I104 WeakPolarHBondContact O-CD1 3.24Å; L100-I104 VanDerWaalsContact O-CG1 3.3Å; L100-I104 WeakPolarHBondContact O-CG1 3.36Å; L100-I104 PolarHBondContact O-N 3.43Å; L100-I104 VanDerWaalsContact O-N 3.1Å; W101-I104 PolarHBondContact O-N 2.94Å; I104-L106 VanDerWaalsContact C-N 3.26Å; I104-L106 PolarHBondContact O-N 3.16Å; I104-V107 PolarHBondContact O-N 3.3Å
105	R	31.8	Very low	34.9	Very low	207 Å²	207	126 Å²	126	78%	0.781	58%	0.584	S	S	*	*	H	α-helix	trans	-71.4	-16.9	-178.4	-140.4	-178.9	-168.1	-179.9	4.2	114.3	W101 I103 V107	W101-R105 PolarHBondContact O-N 3.17Å; W101-R105 VanDerWaalsContact O-N 3.14Å; I103-R105 VanDerWaalsContact C-N 3.26Å; I103-R105 PolarHBondContact O-N 3.16Å; R105-V107 VanDerWaalsContact C-N 3.34Å
106	L	36.4	Very low	34.5	Very low	147 Å²	147	131.3 Å²	131.3	77%	0.77	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-7.7	176.9	-81.4	164.2	0	0	0	113.5	I103 I104	I103-L106 PolarHBondContact O-N 3.31Å; I103-L106 VanDerWaalsContact O-N 3.16Å; I104-L106 VanDerWaalsContact C-N 3.26Å; I104-L106 PolarHBondContact O-N 3.16Å
107	V	39.4	Very low	34	Very low	107 Å²	107	133 Å²	133	65%	0.648	62%	0.616	S	S	*	*			trans	-107.6	-4.2	-177.4	-172.9	0	0	0	0	112.7	F51 I104 R105	F51-V107 HydrophobicContact CE2-CG1 4.41Å; I104-V107 PolarHBondContact O-N 3.3Å; R105-V107 VanDerWaalsContact C-N 3.34Å
108	K	37.5	Very low	34.2	Very low	243 Å²	243	135.1 Å²	135.1	100%	1.057	63%	0.626	S	S	*	*			trans	-92	0	168.2	-76.3	-169.6	175.3	-178.9	0	110.9

Retrieved 108 of 108 residues in 19.1 ms (Link to these results)

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