A0A077ZGA8_TRITR Loading...

p450 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZGA8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 109 aa.

						>A0A077ZGA8_TRITR|A0A077ZGA8
MSSCKLRNYDLPEGSIVVANLWKINRDPKYFDEPEKFMPERFIQEDGSFNDDLTKKLAAFSVGKRKCIGEKIARDELFLLITNLVRTFKVRLPLPAFYAFSPRSNKQNS
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	60.8	Low	88.4	Confident	184 Å²	184	128.5 Å²	128.5	91%	0.906	65%	0.648	S	S	*	*				0	104	0	-87.3	-178.8	173.4	0	0	107.3	E13	M1-E13 WeakPolarHBondContact CA-OE1 3.34Å; M1-E13 HydrophobicContact CB-CG 3.9Å; M1-E13 WeakPolarHBondContact CB-OE1 3.34Å; M1-E13 PolarHBondContact N-OE1 3.22Å; M1-E13 WeakPolarHBondContact O-CB 2.98Å; M1-E13 WeakPolarHBondContact O-CG 3.11Å; M1-E13 VanDerWaalsContact O-OE1 3.08Å
2	S	79.3	Confident	88.9	Confident	107 Å²	107	125.3 Å²	125.3	75%	0.748	64%	0.642	S	S	*	*			trans	-62.1	150.6	-175.4	53.8	0	0	0	0	113.1
3	S	84.4	Confident	89.4	Confident	88 Å²	88	125.6 Å²	125.6	62%	0.615	64%	0.64	S	S	*	*			trans	-53.7	144.6	165	56.6	0	0	0	0	110.1
4	C	91.8	Very high	89.6	Confident	70 Å²	70	121.2 Å²	121.2	47%	0.473	64%	0.641	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-136.9	159.7	-177.6	74.5	0	0	0	0	111.4	L11	C4-L11 PolarHBondContact N-O 3.21Å; C4-L11 WeakPolarHBondContact O-CB 3.21Å; C4-L11 PolarHBondContact O-N 3.05Å
5	K	93.5	Very high	89.9	Confident	158 Å²	158	116.5 Å²	116.5	69%	0.687	62%	0.622	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-103.2	129.8	175.5	-76.3	-175.1	172	-175.7	0	110.4	Y9 D10	K5-Y9 WeakPolarHBondContact CA-O 3.39Å; K5-D10 WeakPolarHBondContact CE-OD1 3.17Å; K5-D10 WeakPolarHBondContact CG-OD1 3.45Å
6	L	92.8	Very high	90.2	Very high	98 Å²	98	119.3 Å²	119.3	51%	0.513	64%	0.635	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116	110.4	169.2	179.6	64.5	0	0	0	108.9	N8 Y9 L11	L6-N8 PolarHBondContact O-N 3.46Å; L6-Y9 PolarHBondContact N-O 2.61Å; L6-Y9 PolarHBondContact O-N 3.23Å; L6-L11 HydrophobicContact CB-CD1 3.47Å; L6-L11 VanDerWaalsContact CB-CD1 3.47Å; L6-L11 HydrophobicContact CB-CG 4.32Å; L6-L11 HydrophobicContact CD2-CD1 4.13Å; L6-L11 HydrophobicContact CG-CD1 4.44Å
7	R	92.4	Very high	90.3	Very high	223 Å²	223	118.4 Å²	118.4	84%	0.842	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	54.9	-117.6	-169.1	-58	176.1	171.2	166.2	-3.8	109.5
8	N	94.2	Very high	90.6	Very high	155 Å²	155	118.7 Å²	118.7	83%	0.829	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	11.8	-179.2	-60	-12.7	0	0	0	112.8	L6	L6-N8 PolarHBondContact O-N 3.46Å
9	Y	94.7	Very high	90.7	Very high	175 Å²	175	115.9 Å²	115.9	69%	0.686	64%	0.636	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-111.3	134.1	-177.2	-60	-81.9	0	0	0	111.4	K5 L6	K5-Y9 WeakPolarHBondContact CA-O 3.39Å; L6-Y9 PolarHBondContact N-O 2.61Å; L6-Y9 PolarHBondContact O-N 3.23Å
10	D	94.4	Very high	91	Very high	113 Å²	113	114.7 Å²	114.7	60%	0.604	63%	0.628	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-82.1	124.8	169.7	-71.6	-69.1	0	0	0	109.9	K5	K5-D10 WeakPolarHBondContact CE-OD1 3.17Å; K5-D10 WeakPolarHBondContact CG-OD1 3.45Å
11	L	94.4	Very high	91.2	Very high	42 Å²	42	111.9 Å²	111.9	22%	0.22	61%	0.612	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.7	115.2	176.6	-69.4	164.6	0	0	0	109	C4 L6	C4-L11 PolarHBondContact N-O 3.21Å; C4-L11 WeakPolarHBondContact O-CB 3.21Å; C4-L11 PolarHBondContact O-N 3.05Å; L6-L11 HydrophobicContact CB-CD1 3.47Å; L6-L11 VanDerWaalsContact CB-CD1 3.47Å; L6-L11 HydrophobicContact CB-CG 4.32Å; L6-L11 HydrophobicContact CD2-CD1 4.13Å; L6-L11 HydrophobicContact CG-CD1 4.44Å
12	P	94.6	Very high	92.8	Very high	90 Å²	90	110.3 Å²	110.3	58%	0.584	60%	0.597	S	S	*	*			trans	-58.9	152.8	172.2	-23.8	33.4	0	0	0	112.5	G14 S15	P12-G14 PolarHBondContact O-N 3.4Å; P12-S15 WeakPolarHBondContact CD-OG 3.1Å; P12-S15 WeakPolarHBondContact O-CB 3.41Å; P12-S15 PolarHBondContact O-N 2.93Å; P12-S15 PolarHBondContact O-OG 3.07Å
13	E	94.9	Very high	93.6	Very high	130 Å²	130	111.2 Å²	111.2	61%	0.607	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.6	138.2	169.2	173.9	163.5	-160.8	0	0	110.6	M1 S15	M1-E13 WeakPolarHBondContact CA-OE1 3.34Å; M1-E13 HydrophobicContact CB-CG 3.9Å; M1-E13 WeakPolarHBondContact CB-OE1 3.34Å; M1-E13 PolarHBondContact N-OE1 3.22Å; M1-E13 WeakPolarHBondContact O-CB 2.98Å; M1-E13 WeakPolarHBondContact O-CG 3.11Å; M1-E13 VanDerWaalsContact O-OE1 3.08Å; E13-S15 VanDerWaalsContact C-N 3.32Å; E13-S15 PolarHBondContact O-N 3.21Å
14	G	92.4	Very high	94.1	Very high	64 Å²	64	110.6 Å²	110.6	66%	0.66	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	83	0.4	-178.9	0	0	0	0	0	115.2	P12 I16	P12-G14 PolarHBondContact O-N 3.4Å; G14-I16 PolarHBondContact O-N 3.28Å
15	S	94.4	Very high	94.3	Very high	51 Å²	51	108.8 Å²	108.8	36%	0.357	56%	0.562	S	S	.	*			trans	-57.9	130.6	175.2	-63.9	0	0	0	0	112.1	P12 E13	P12-S15 WeakPolarHBondContact CD-OG 3.1Å; P12-S15 WeakPolarHBondContact O-CB 3.41Å; P12-S15 PolarHBondContact O-N 2.93Å; P12-S15 PolarHBondContact O-OG 3.07Å; E13-S15 VanDerWaalsContact C-N 3.32Å; E13-S15 PolarHBondContact O-N 3.21Å
16	I	94	Very high	94.4	Very high	161 Å²	161	105.3 Å²	105.3	83%	0.826	54%	0.544	S	S	*	.			trans	-79.4	121.8	172.4	-60.3	176.1	0	0	0	108.6	G14 V18	G14-I16 PolarHBondContact O-N 3.28Å; I16-V18 HydrophobicContact CG2-CG2 4.21Å
17	V	93	Very high	94.6	Very high	104 Å²	104	102.8 Å²	102.8	63%	0.63	53%	0.531	S	S	*	.			trans	-114.8	122.5	177.3	-177.5	0	0	0	0	109.3
18	V	94.4	Very high	94.8	Very high	124 Å²	124	97 Å²	97	75%	0.752	52%	0.522	S	S	*	.			trans	-111.9	120.8	177.2	-176.5	0	0	0	0	109.3	I16	I16-V18 HydrophobicContact CG2-CG2 4.21Å
19	A	93.4	Very high	94.9	Very high	65 Å²	65	96.9 Å²	96.9	54%	0.537	52%	0.515	S	S	.	.			trans	-79.2	120.9	172.8	0	0	0	0	0	110	L21	A19-L21 HydrophobicContact CB-CD2 4.27Å; A19-L21 HydrophobicContact CB-CG 4.44Å; A19-L21 PolarHBondContact O-N 2.85Å
20	N	95.9	Very high	94.9	Very high	92 Å²	92	93.2 Å²	93.2	49%	0.492	50%	0.5	S	S	.	.			trans	-78.6	76	175	-169.8	-17.1	0	0	0	110.8	W22 K23 I24	N20-W22 PolarHBondContact O-N 3.06Å; N20-W22 PolarHBondContact OD1-N 2.99Å; N20-K23 HydrophobicContact CB-CB 4.26Å; N20-K23 PolarHBondContact O-N 3.04Å; N20-K23 WeakPolarHBondContact OD1-CB 3.14Å; N20-K23 PolarHBondContact OD1-N 3.41Å; N20-I24 WeakPolarHBondContact O-CG1 3.21Å; N20-I24 PolarHBondContact O-N 2.91Å; N20-I24 VanDerWaalsContact O-N 3.09Å
21	L	95.7	Very high	94.9	Very high	56 Å²	56	88 Å²	88	29%	0.293	47%	0.472	S	S	.	.	H	α-helix	trans	-62.6	-30.9	179.2	-62.6	-179.5	0	0	0	112.3	A19 I24 N25 A58	A19-L21 HydrophobicContact CB-CD2 4.27Å; A19-L21 HydrophobicContact CB-CG 4.44Å; A19-L21 PolarHBondContact O-N 2.85Å; L21-I24 HydrophobicContact CD2-CD1 4.28Å; L21-I24 PolarHBondContact O-N 2.76Å; L21-N25 WeakPolarHBondContact O-CB 3.25Å; L21-N25 VanDerWaalsContact O-CG 3.31Å; L21-N25 PolarHBondContact O-N 3.34Å; L21-N25 PolarHBondContact O-ND2 2.94Å; L21-A58 HydrophobicContact CD2-CB 4.08Å
22	W	94.4	Very high	94.9	Very high	151 Å²	151	91.6 Å²	91.6	57%	0.572	49%	0.491	S	S	*	.	H	α-helix	trans	-60.2	-48.2	176.9	-174.8	94.2	0	0	0	111	N20 R26	N20-W22 PolarHBondContact O-N 3.06Å; N20-W22 PolarHBondContact OD1-N 2.99Å; W22-R26 WeakPolarHBondContact O-CB 3.36Å; W22-R26 PolarHBondContact O-N 3.04Å
23	K	95.6	Very high	95	Very high	125 Å²	125	91.1 Å²	91.1	54%	0.543	48%	0.481	S	S	.	.	H	α-helix	trans	-63.6	-47	175	-175.8	-162.1	175.2	-179.1	0	111.3	N20 N25 R26 D27	N20-K23 HydrophobicContact CB-CB 4.26Å; N20-K23 PolarHBondContact O-N 3.04Å; N20-K23 WeakPolarHBondContact OD1-CB 3.14Å; N20-K23 PolarHBondContact OD1-N 3.41Å; K23-N25 VanDerWaalsContact C-N 3.3Å; K23-N25 PolarHBondContact O-N 3.47Å; K23-R26 CarbonylContact O-C 3.37Å; K23-R26 PolarHBondContact O-N 3.18Å; K23-D27 PolarHBondContact O-N 2.62Å
24	I	95.1	Very high	95	Very high	75 Å²	75	86.5 Å²	86.5	39%	0.385	46%	0.463	S	S	.	.	H	α-helix	trans	-58	-45.6	-176.8	-70.4	164.2	0	0	0	110.8	N20 L21 R26 D27 F31 A58	N20-I24 WeakPolarHBondContact O-CG1 3.21Å; N20-I24 PolarHBondContact O-N 2.91Å; N20-I24 VanDerWaalsContact O-N 3.09Å; L21-I24 HydrophobicContact CD2-CD1 4.28Å; L21-I24 PolarHBondContact O-N 2.76Å; I24-R26 PolarHBondContact O-N 3.36Å; I24-D27 PolarHBondContact O-N 2.89Å; I24-F31 WeakPolarHBondContact O-CE2 3.46Å; I24-A58 HydrophobicContact CG2-CB 4.16Å
25	N	96.2	Very high	95.1	Very high	33 Å²	33	89.5 Å²	89.5	18%	0.176	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	1.3	-178.8	-64.2	-31.8	0	0	0	113.6	L21 K23 L57 A58	L21-N25 WeakPolarHBondContact O-CB 3.25Å; L21-N25 VanDerWaalsContact O-CG 3.31Å; L21-N25 PolarHBondContact O-N 3.34Å; L21-N25 PolarHBondContact O-ND2 2.94Å; K23-N25 VanDerWaalsContact C-N 3.3Å; K23-N25 PolarHBondContact O-N 3.47Å; N25-L57 HydrophobicContact CB-CD1 4.15Å; N25-A58 PolarHBondContact OD1-N 2.97Å
26	R	96.4	Very high	95.1	Very high	85 Å²	85	92.8 Å²	92.8	32%	0.321	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131	15.3	178.7	-73.5	174.4	168	68.6	6.2	112.8	W22 K23 I24 P28 P34 E35	W22-R26 WeakPolarHBondContact O-CB 3.36Å; W22-R26 PolarHBondContact O-N 3.04Å; K23-R26 CarbonylContact O-C 3.37Å; K23-R26 PolarHBondContact O-N 3.18Å; I24-R26 PolarHBondContact O-N 3.36Å; R26-P28 VanDerWaalsContact O-CD 3.25Å; R26-P28 WeakPolarHBondContact O-CD 3.38Å; R26-P34 HydrophobicContact CB-CB 4.01Å; R26-P34 HydrophobicContact CG-CB 4.32Å; R26-P34 WeakPolarHBondContact O-CB 3.48Å; R26-P34 WeakPolarHBondContact O-CG 3.41Å; R26-E35 WeakPolarHBondContact CD-OE1 3.19Å; R26-E35 IonicContact NE-OE1 2.81Å; R26-E35 IonicContact NE-OE2 2.94Å; R26-E35 PolarHBondContact NE-OE2 3.28Å
27	D	96.6	Very high	95.1	Very high	44 Å²	44	94.5 Å²	94.5	24%	0.235	47%	0.469	C	S	.	.			trans	-69.6	115.7	-179.1	-169.4	-26.4	0	0	0	109.1	K23 I24 K29 Y30 F31	K23-D27 PolarHBondContact O-N 2.62Å; I24-D27 PolarHBondContact O-N 2.89Å; D27-K29 PolarHBondContact O-N 2.94Å; D27-K29 WeakPolarHBondContact OD1-CB 3.41Å; D27-K29 PolarHBondContact OD1-N 2.84Å; D27-Y30 HydrophobicContact CB-CD2 4.05Å; D27-Y30 PolarHBondContact O-N 3Å; D27-F31 PolarHBondContact O-N 3.06Å
28	P	96.2	Very high	95.2	Very high	101 Å²	101	92.3 Å²	92.3	66%	0.656	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-14.1	-177.7	26.8	-34.8	0	0	0	112.8	R26 Y30 F31 P34	R26-P28 VanDerWaalsContact O-CD 3.25Å; R26-P28 WeakPolarHBondContact O-CD 3.38Å; P28-Y30 PolarHBondContact O-N 2.81Å; P28-F31 WeakPolarHBondContact CA-O 3.1Å; P28-P34 HydrophobicContact CB-CG 4.47Å
29	K	95.8	Very high	95.2	Very high	154 Å²	154	89 Å²	89	67%	0.67	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-29.6	170.4	-175	-179.1	175.8	-168.4	0	112.6	D27	D27-K29 PolarHBondContact O-N 2.94Å; D27-K29 WeakPolarHBondContact OD1-CB 3.41Å; D27-K29 PolarHBondContact OD1-N 2.84Å
30	Y	94.7	Very high	95.3	Very high	97 Å²	97	91.7 Å²	91.7	38%	0.38	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-32.1	-175.3	-56.4	-60.6	0	0	0	113.1	D27 P28 L53 K56	D27-Y30 HydrophobicContact CB-CD2 4.05Å; D27-Y30 PolarHBondContact O-N 3Å; P28-Y30 PolarHBondContact O-N 2.81Å; Y30-L53 WeakPolarHBondContact O-CD1 3.48Å; Y30-K56 HydrophobicContact CD1-CD 3.77Å; Y30-K56 HydrophobicContact CG-CD 4.02Å
31	F	96	Very high	95.3	Very high	4 Å²	4	89 Å²	89	2%	0.018	42%	0.418	C	S	.	.	S	Bend	trans	-115.9	108	-175.4	-60.5	-77.1	0	0	0	109.2	I24 D27 P28 P34 F42 L53 K56 L57	I24-F31 WeakPolarHBondContact O-CE2 3.46Å; D27-F31 PolarHBondContact O-N 3.06Å; P28-F31 WeakPolarHBondContact CA-O 3.1Å; F31-P34 HydrophobicContact CB-CB 4.12Å; F31-P34 WeakPolarHBondContact O-CD 3.39Å; F31-F42 HydrophobicContact CE1-CE1 4.33Å; F31-F42 HydrophobicContact CE1-CZ 4.37Å; F31-L53 HydrophobicContact CD1-CD1 3.91Å; F31-L53 HydrophobicContact CD1-CG 4.37Å; F31-L53 HydrophobicContact CE1-CD1 3.88Å; F31-L53 HydrophobicContact CE1-CG 4.16Å; F31-K56 HydrophobicContact CZ-CB 4.19Å; F31-L57 HydrophobicContact CZ-CD1 4.38Å
32	D	93.9	Very high	95.3	Very high	117 Å²	117	88.8 Å²	88.8	63%	0.626	42%	0.415	S	S	*	.	S	Bend	trans	-63.7	142.1	173.3	-168.9	18.8	0	0	0	110.3	R41	D32-R41 PolarHBondContact O-NH1 3.07Å; D32-R41 PolarHBondContact O-NH2 3.46Å
33	E	95.3	Very high	95.4	Very high	80 Å²	80	85.6 Å²	85.6	37%	0.374	41%	0.409	S	S	.	.	S	Bend	trans	38.9	61.5	-176	-52.1	-158.8	76.9	0	0	113.4	E35 K36 R41	E33-E35 PolarHBondContact O-N 2.94Å; E33-K36 HydrophobicContact CB-CB 4.26Å; E33-K36 HydrophobicContact CB-CD 4.08Å; E33-K36 HydrophobicContact CB-CG 4.26Å; E33-K36 VanDerWaalsContact CD-NZ 3.3Å; E33-K36 PolarHBondContact O-N 3.36Å; E33-K36 WeakPolarHBondContact OE1-CD 3.39Å; E33-K36 WeakPolarHBondContact OE1-CE 3.26Å; E33-K36 IonicContact OE1-NZ 2.61Å; E33-K36 PolarHBondContact OE1-NZ 3.08Å; E33-K36 IonicContact OE2-NZ 3.22Å; E33-K36 PolarHBondContact OE2-NZ 2.89Å; E33-R41 PolarHBondContact O-NH2 3.03Å
34	P	95.6	Very high	95.4	Very high	33 Å²	33	84.2 Å²	84.2	21%	0.214	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-17.4	-164.4	25.4	-33.4	0	0	0	114.4	R26 P28 F31	R26-P34 HydrophobicContact CB-CB 4.01Å; R26-P34 HydrophobicContact CG-CB 4.32Å; R26-P34 WeakPolarHBondContact O-CB 3.48Å; R26-P34 WeakPolarHBondContact O-CG 3.41Å; P28-P34 HydrophobicContact CB-CG 4.47Å; F31-P34 HydrophobicContact CB-CB 4.12Å; F31-P34 WeakPolarHBondContact O-CD 3.39Å
35	E	94.2	Very high	95.4	Very high	127 Å²	127	90.7 Å²	90.7	59%	0.593	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-12.5	177.1	-58	-56.1	157.3	0	0	113.3	R26 E33	R26-E35 WeakPolarHBondContact CD-OE1 3.19Å; R26-E35 IonicContact NE-OE1 2.81Å; R26-E35 IonicContact NE-OE2 2.94Å; R26-E35 PolarHBondContact NE-OE2 3.28Å; E33-E35 PolarHBondContact O-N 2.94Å
36	K	94.7	Very high	95.4	Very high	120 Å²	120	95 Å²	95	52%	0.522	46%	0.456	S	S	.	.	S	Bend	trans	-86.1	132.8	175.4	-71.2	-172.9	179.9	169.7	0	110.6	E33 M38 R41	E33-K36 HydrophobicContact CB-CB 4.26Å; E33-K36 HydrophobicContact CB-CD 4.08Å; E33-K36 HydrophobicContact CB-CG 4.26Å; E33-K36 VanDerWaalsContact CD-NZ 3.3Å; E33-K36 PolarHBondContact O-N 3.36Å; E33-K36 WeakPolarHBondContact OE1-CD 3.39Å; E33-K36 WeakPolarHBondContact OE1-CE 3.26Å; E33-K36 IonicContact OE1-NZ 2.61Å; E33-K36 PolarHBondContact OE1-NZ 3.08Å; E33-K36 IonicContact OE2-NZ 3.22Å; E33-K36 PolarHBondContact OE2-NZ 2.89Å; K36-M38 PolarHBondContact O-N 3.17Å; K36-R41 PolarHBondContact O-NH2 2.93Å
37	F	94	Very high	95.3	Very high	198 Å²	198	93.7 Å²	93.7	87%	0.868	47%	0.468	S	S	*	.			trans	-72.6	97.6	166.5	-176.9	-97.7	0	0	0	109.2	P39	F37-P39 HydrophobicContact CD1-CG 4.09Å; F37-P39 HydrophobicContact CE1-CG 3.44Å; F37-P39 VanDerWaalsContact CE1-CG 3.44Å; F37-P39 HydrophobicContact CE2-CG 4.4Å; F37-P39 HydrophobicContact CZ-CG 3.62Å
38	M	94.9	Very high	95.3	Very high	57 Å²	57	93.7 Å²	93.7	28%	0.281	47%	0.472	S	S	.	.			trans	-132.8	85.6	-178.3	-175.2	175.4	79.1	0	0	109	K36 E40 R41	K36-M38 PolarHBondContact O-N 3.17Å; M38-E40 HydrophobicContact CG-CB 4.41Å; M38-E40 WeakPolarHBondContact CG-OE2 3.39Å; M38-E40 PolarHBondContact O-N 2.72Å; M38-R41 HydrophobicContact CE-CB 3.77Å; M38-R41 WeakPolarHBondContact O-CG 3.43Å; M38-R41 PolarHBondContact O-N 3.4Å; M38-R41 PolarHBondContact O-NE 3.33Å; M38-R41 VanDerWaalsContact O-NE 3.09Å
39	P	94.4	Very high	95.3	Very high	55 Å²	55	96.1 Å²	96.1	36%	0.357	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-57.3	-30.7	179.1	-25.5	35.7	0	0	0	113.5	F37 R41 F42	F37-P39 HydrophobicContact CD1-CG 4.09Å; F37-P39 HydrophobicContact CE1-CG 3.44Å; F37-P39 VanDerWaalsContact CE1-CG 3.44Å; F37-P39 HydrophobicContact CE2-CG 4.4Å; F37-P39 HydrophobicContact CZ-CG 3.62Å; P39-R41 PolarHBondContact O-N 2.88Å; P39-R41 VanDerWaalsContact O-N 3.08Å; P39-F42 PolarHBondContact O-N 2.75Å
40	E	95.8	Very high	95.4	Very high	122 Å²	122	90.9 Å²	90.9	57%	0.57	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-58.8	-22.9	-178.7	-60.5	74.7	-163	0	0	112.2	M38 F42 I43	M38-E40 HydrophobicContact CG-CB 4.41Å; M38-E40 WeakPolarHBondContact CG-OE2 3.39Å; M38-E40 PolarHBondContact O-N 2.72Å; E40-F42 PolarHBondContact O-N 3.09Å; E40-I43 PolarHBondContact O-N 2.75Å
41	R	95.7	Very high	95.4	Very high	34 Å²	34	90.8 Å²	90.8	13%	0.128	46%	0.458	C	S	.	.	G	3₁₀ helix	trans	-57.4	-25.5	174.7	78.4	-177.8	56.2	-149.6	-9.2	113.3	D32 E33 K36 M38 P39 I43 L53	D32-R41 PolarHBondContact O-NH1 3.07Å; D32-R41 PolarHBondContact O-NH2 3.46Å; E33-R41 PolarHBondContact O-NH2 3.03Å; K36-R41 PolarHBondContact O-NH2 2.93Å; M38-R41 HydrophobicContact CE-CB 3.77Å; M38-R41 WeakPolarHBondContact O-CG 3.43Å; M38-R41 PolarHBondContact O-N 3.4Å; M38-R41 PolarHBondContact O-NE 3.33Å; M38-R41 VanDerWaalsContact O-NE 3.09Å; P39-R41 PolarHBondContact O-N 2.88Å; P39-R41 VanDerWaalsContact O-N 3.08Å; R41-I43 VanDerWaalsContact C-N 3.32Å; R41-L53 HydrophobicContact CB-CD2 4.24Å; R41-L53 HydrophobicContact CG-CD2 4Å; R41-L53 WeakPolarHBondContact O-CD2 3.25Å
42	F	96.1	Very high	95.3	Very high	53 Å²	53	95.9 Å²	95.9	23%	0.232	49%	0.485	C	S	.	.	G	3₁₀ helix	trans	-92.2	9	179.9	-61.8	-74.6	0	0	0	112.9	F31 P39 E40 N50 L53 L57	F31-F42 HydrophobicContact CE1-CE1 4.33Å; F31-F42 HydrophobicContact CE1-CZ 4.37Å; P39-F42 PolarHBondContact O-N 2.75Å; E40-F42 PolarHBondContact O-N 3.09Å; F42-N50 PolarHBondContact O-N 3.1Å; F42-L53 HydrophobicContact CD1-CD2 3.93Å; F42-L53 HydrophobicContact CD1-CG 4.16Å; F42-L53 HydrophobicContact CE1-CD2 3.99Å; F42-L53 HydrophobicContact CE1-CG 4.01Å; F42-L57 HydrophobicContact CZ-CD2 4.49Å
43	I	96.8	Very high	95.4	Very high	84 Å²	84	91.1 Å²	91.1	43%	0.431	46%	0.459	S	S	.	.	B	Isolated β-bridge	trans	-121.3	134.8	-179.3	-53.1	178	0	0	0	107.9	E40 R41 S48	E40-I43 PolarHBondContact O-N 2.75Å; R41-I43 VanDerWaalsContact C-N 3.32Å; I43-S48 CarbonylContact C-O 3.57Å; I43-S48 WeakPolarHBondContact CA-O 3.48Å
44	Q	95.6	Very high	95.3	Very high	96 Å²	96	89.6 Å²	89.6	45%	0.449	46%	0.456	S	S	.	.			trans	-83.2	167.6	175.4	-63.7	-170.3	67.1	0	0	110.9	D46 G47 S48 F49 N50	Q44-D46 WeakPolarHBondContact CB-OD1 3.25Å; Q44-D46 PolarHBondContact O-N 3.32Å; Q44-G47 PolarHBondContact O-N 3Å; Q44-S48 PolarHBondContact N-O 2.77Å; Q44-S48 PolarHBondContact NE2-OG 3.07Å; Q44-F49 PolarHBondContact NE2-O 2.95Å; Q44-N50 HydrophobicContact CG-CB 4.03Å
45	E	94.6	Very high	95.2	Very high	211 Å²	211	95.4 Å²	95.4	99%	0.986	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-29.3	-179.6	-65.4	-177.2	175.3	0	0	113.2	G47	E45-G47 PolarHBondContact O-N 3.35Å
46	D	95.8	Very high	95.3	Very high	124 Å²	124	94 Å²	94	66%	0.663	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-0.6	176	71.6	-10	0	0	0	113.8	Q44 S48	Q44-D46 WeakPolarHBondContact CB-OD1 3.25Å; Q44-D46 PolarHBondContact O-N 3.32Å; D46-S48 VanDerWaalsContact C-N 3.33Å; D46-S48 WeakPolarHBondContact OD1-CB 3.34Å; D46-S48 PolarHBondContact OD1-N 3.33Å; D46-S48 PolarHBondContact OD1-OG 2.93Å; D46-S48 PolarHBondContact OD2-OG 3.02Å
47	G	95.4	Very high	95.3	Very high	56 Å²	56	91 Å²	91	58%	0.577	46%	0.459	S	S	*	.	S	Bend	trans	84.5	-0.3	-178	0	0	0	0	0	114.8	Q44 E45	Q44-G47 PolarHBondContact O-N 3Å; E45-G47 PolarHBondContact O-N 3.35Å
48	S	96.6	Very high	95.4	Very high	44 Å²	44	81.8 Å²	81.8	31%	0.308	42%	0.42	S	S	.	.			trans	-75.5	164	174.5	71.4	0	0	0	0	112	I43 Q44 D46	I43-S48 CarbonylContact C-O 3.57Å; I43-S48 WeakPolarHBondContact CA-O 3.48Å; Q44-S48 PolarHBondContact N-O 2.77Å; Q44-S48 PolarHBondContact NE2-OG 3.07Å; D46-S48 VanDerWaalsContact C-N 3.33Å; D46-S48 WeakPolarHBondContact OD1-CB 3.34Å; D46-S48 PolarHBondContact OD1-N 3.33Å; D46-S48 PolarHBondContact OD1-OG 2.93Å; D46-S48 PolarHBondContact OD2-OG 3.02Å
49	F	96.1	Very high	95.4	Very high	152 Å²	152	81.8 Å²	81.8	67%	0.667	43%	0.428	S	S	*	.	B	Isolated β-bridge	trans	-71.2	140.4	174.2	-69.8	-69.2	0	0	0	111.2	Q44 D51	Q44-F49 PolarHBondContact NE2-O 2.95Å; F49-D51 VanDerWaalsContact C-N 3.33Å; F49-D51 PolarHBondContact O-N 2.97Å; F49-D51 VanDerWaalsContact O-N 3.07Å
50	N	96.2	Very high	95.5	Very high	45 Å²	45	81.7 Å²	81.7	24%	0.241	42%	0.422	C	S	.	.			trans	-81	82.2	170.1	-171.5	-21.8	0	0	0	109.5	F42 Q44 D52 L53 T54	F42-N50 PolarHBondContact O-N 3.1Å; Q44-N50 HydrophobicContact CG-CB 4.03Å; N50-D52 VanDerWaalsContact C-N 3.25Å; N50-D52 PolarHBondContact O-N 3.05Å; N50-L53 HydrophobicContact CB-CB 4.23Å; N50-L53 PolarHBondContact O-N 3.23Å; N50-L53 WeakPolarHBondContact OD1-CB 3.4Å; N50-L53 PolarHBondContact OD1-N 3.4Å; N50-T54 WeakPolarHBondContact O-CB 3.45Å; N50-T54 PolarHBondContact O-N 2.94Å; N50-T54 PolarHBondContact O-OG1 3.5Å
51	D	95.2	Very high	95.5	Very high	95 Å²	95	77.8 Å²	77.8	51%	0.508	41%	0.408	S	S	.	.	H	α-helix	trans	-60.8	-34.6	-178	-77.6	-19.1	0	0	0	112.8	F49 T54 K55	F49-D51 VanDerWaalsContact C-N 3.33Å; F49-D51 PolarHBondContact O-N 2.97Å; F49-D51 VanDerWaalsContact O-N 3.07Å; D51-T54 PolarHBondContact O-N 3.46Å; D51-K55 WeakPolarHBondContact O-CD 3.47Å; D51-K55 VanDerWaalsContact O-CG 3.22Å; D51-K55 WeakPolarHBondContact O-CG 3.27Å; D51-K55 PolarHBondContact O-N 3.48Å
52	D	94.4	Very high	95.4	Very high	110 Å²	110	80.9 Å²	80.9	59%	0.588	43%	0.431	S	S	*	.	H	α-helix	trans	-69.1	-38.7	-178.6	-73.5	-16.8	0	0	0	112.3	N50 K55 K56	N50-D52 VanDerWaalsContact C-N 3.25Å; N50-D52 PolarHBondContact O-N 3.05Å; D52-K55 IonicContact OD1-NZ 3.79Å; D52-K56 WeakPolarHBondContact O-CG 3.29Å
53	L	95.1	Very high	95.4	Very high	17 Å²	17	81.3 Å²	81.3	9%	0.089	45%	0.45	C	S	.	.	H	α-helix	trans	-71	-41.1	171.2	-170.8	66.1	0	0	0	111.1	Y30 F31 R41 F42 N50 K55 K56	Y30-L53 WeakPolarHBondContact O-CD1 3.48Å; F31-L53 HydrophobicContact CD1-CD1 3.91Å; F31-L53 HydrophobicContact CD1-CG 4.37Å; F31-L53 HydrophobicContact CE1-CD1 3.88Å; F31-L53 HydrophobicContact CE1-CG 4.16Å; R41-L53 HydrophobicContact CB-CD2 4.24Å; R41-L53 HydrophobicContact CG-CD2 4Å; R41-L53 WeakPolarHBondContact O-CD2 3.25Å; F42-L53 HydrophobicContact CD1-CD2 3.93Å; F42-L53 HydrophobicContact CD1-CG 4.16Å; F42-L53 HydrophobicContact CE1-CD2 3.99Å; F42-L53 HydrophobicContact CE1-CG 4.01Å; N50-L53 HydrophobicContact CB-CB 4.23Å; N50-L53 PolarHBondContact O-N 3.23Å; N50-L53 WeakPolarHBondContact OD1-CB 3.4Å; N50-L53 PolarHBondContact OD1-N 3.4Å; L53-K55 VanDerWaalsContact C-N 3.31Å; L53-K55 PolarHBondContact O-N 2.71Å; L53-K56 WeakPolarHBondContact O-CB 3.43Å; L53-K56 PolarHBondContact O-N 3.36Å
54	T	94.5	Very high	95.3	Very high	48 Å²	48	87.8 Å²	87.8	29%	0.294	48%	0.475	S	S	.	.	H	α-helix	trans	-61.5	-38.6	-178.4	-58.2	0	0	0	0	112	N50 D51 K56 L57	N50-T54 WeakPolarHBondContact O-CB 3.45Å; N50-T54 PolarHBondContact O-N 2.94Å; N50-T54 PolarHBondContact O-OG1 3.5Å; D51-T54 PolarHBondContact O-N 3.46Å; T54-K56 PolarHBondContact O-N 3.16Å; T54-L57 WeakPolarHBondContact O-CB 3.47Å; T54-L57 PolarHBondContact O-N 3.26Å; T54-L57 VanDerWaalsContact O-N 3.12Å
55	K	94	Very high	95.3	Very high	156 Å²	156	93.9 Å²	93.9	68%	0.678	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-22.6	175.2	-72.4	163.5	-167.5	159.7	0	113.7	D51 D52 L53 L57	D51-K55 WeakPolarHBondContact O-CD 3.47Å; D51-K55 VanDerWaalsContact O-CG 3.22Å; D51-K55 WeakPolarHBondContact O-CG 3.27Å; D51-K55 PolarHBondContact O-N 3.48Å; D52-K55 IonicContact OD1-NZ 3.79Å; L53-K55 VanDerWaalsContact C-N 3.31Å; L53-K55 PolarHBondContact O-N 2.71Å; K55-L57 VanDerWaalsContact C-N 3.32Å
56	K	95.4	Very high	95.4	Very high	98 Å²	98	88.4 Å²	88.4	43%	0.426	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-15	176.9	-63.6	172.3	-173.3	168.6	0	112.5	Y30 F31 D52 L53 T54 A58	Y30-K56 HydrophobicContact CD1-CD 3.77Å; Y30-K56 HydrophobicContact CG-CD 4.02Å; F31-K56 HydrophobicContact CZ-CB 4.19Å; D52-K56 WeakPolarHBondContact O-CG 3.29Å; L53-K56 WeakPolarHBondContact O-CB 3.43Å; L53-K56 PolarHBondContact O-N 3.36Å; T54-K56 PolarHBondContact O-N 3.16Å; K56-A58 PolarHBondContact O-N 2.94Å
57	L	95.4	Very high	95.5	Very high	55 Å²	55	85.4 Å²	85.4	29%	0.288	46%	0.455	S	S	.	.			trans	-77.6	111.4	177.6	-172.1	69.8	0	0	0	110.5	N25 F31 F42 T54 K55 A59	N25-L57 HydrophobicContact CB-CD1 4.15Å; F31-L57 HydrophobicContact CZ-CD1 4.38Å; F42-L57 HydrophobicContact CZ-CD2 4.49Å; T54-L57 WeakPolarHBondContact O-CB 3.47Å; T54-L57 PolarHBondContact O-N 3.26Å; T54-L57 VanDerWaalsContact O-N 3.12Å; K55-L57 VanDerWaalsContact C-N 3.32Å; L57-A59 VanDerWaalsContact C-N 3.31Å; L57-A59 HydrophobicContact CD2-CB 4.27Å; L57-A59 HydrophobicContact CG-CB 4.13Å; L57-A59 PolarHBondContact O-N 3.44Å
58	A	95.9	Very high	95.6	Very high	6 Å²	6	91.1 Å²	91.1	5%	0.05	47%	0.471	C	S	.	.			trans	-94.4	42	-180	0	0	0	0	0	112.4	L21 I24 N25 K56 F60 S61 V62	L21-A58 HydrophobicContact CD2-CB 4.08Å; I24-A58 HydrophobicContact CG2-CB 4.16Å; N25-A58 PolarHBondContact OD1-N 2.97Å; K56-A58 PolarHBondContact O-N 2.94Å; A58-F60 PolarHBondContact O-N 2.98Å; A58-S61 PolarHBondContact O-N 3.48Å; A58-V62 HydrophobicContact CB-CG1 4.17Å
59	A	94.8	Very high	95.6	Very high	56 Å²	56	90.1 Å²	90.1	46%	0.463	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-32.1	-176.5	0	0	0	0	0	113.3	L57	L57-A59 VanDerWaalsContact C-N 3.31Å; L57-A59 HydrophobicContact CD2-CB 4.27Å; L57-A59 HydrophobicContact CG-CB 4.13Å; L57-A59 PolarHBondContact O-N 3.44Å
60	F	96.7	Very high	95.7	Very high	53 Å²	53	84.4 Å²	84.4	23%	0.232	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	26.4	-179.4	-68.5	-79	0	0	0	112.6	A58 K66 C67 E70 A73 R74	A58-F60 PolarHBondContact O-N 2.98Å; F60-K66 WeakPolarHBondContact O-CG 3.36Å; F60-C67 HydrophobicContact CB-CB 3.89Å; F60-C67 HydrophobicContact CD1-CB 3.91Å; F60-C67 HydrophobicContact CG-CB 4.38Å; F60-C67 PolarHBondContact O-N 2.69Å; F60-E70 HydrophobicContact CB-CB 3.99Å; F60-E70 HydrophobicContact CB-CG 4.02Å; F60-E70 HydrophobicContact CD1-CB 3.99Å; F60-E70 HydrophobicContact CD1-CG 4.24Å; F60-E70 HydrophobicContact CD2-CB 4.21Å; F60-E70 HydrophobicContact CD2-CG 3.56Å; F60-E70 HydrophobicContact CE2-CG 4.02Å; F60-E70 HydrophobicContact CG-CB 3.79Å; F60-E70 HydrophobicContact CG-CG 3.67Å; F60-A73 HydrophobicContact CE1-CB 3.71Å; F60-A73 HydrophobicContact CZ-CB 3.8Å; F60-R74 HydrophobicContact CE2-CG 4.07Å; F60-R74 HydrophobicContact CZ-CG 4.43Å
61	S	95.5	Very high	95.8	Very high	40 Å²	40	89.2 Å²	89.2	28%	0.28	46%	0.461	S	S	.	.			trans	60.8	-171.5	-169.1	-166.5	0	0	0	0	112.2	A58	A58-S61 PolarHBondContact O-N 3.48Å
62	V	94.5	Very high	95.9	Very high	100 Å²	100	89.5 Å²	89.5	61%	0.606	46%	0.462	S	S	*	.			trans	-143.8	162.7	179.8	-65.1	0	0	0	0	111.1	A58	A58-V62 HydrophobicContact CB-CG1 4.17Å
63	G	94.5	Very high	96.1	Very high	61 Å²	61	86 Å²	86	63%	0.629	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	75.8	-154.4	174.2	0	0	0	0	0	114.5	R65 K66	G63-R65 PolarHBondContact O-N 3.04Å; G63-R65 VanDerWaalsContact O-N 3.1Å; G63-K66 VanDerWaalsContact O-CB 3.28Å; G63-K66 WeakPolarHBondContact O-CB 3.22Å; G63-K66 PolarHBondContact O-N 2.93Å; G63-K66 VanDerWaalsContact O-N 3.12Å
64	K	95.3	Very high	96.2	Very high	220 Å²	220	90.1 Å²	90.1	96%	0.957	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-64.4	-17.5	-170.9	-65.4	-173.5	178	-177.8	0	114.8
65	R	95.5	Very high	96.4	Very high	224 Å²	224	91.3 Å²	91.3	85%	0.845	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-115.3	24.1	180	-57.2	-64.4	-71.1	168.8	-3.9	111.7	G63	G63-R65 PolarHBondContact O-N 3.04Å; G63-R65 VanDerWaalsContact O-N 3.1Å
66	K	96	Very high	96.6	Very high	96 Å²	96	90 Å²	90	42%	0.417	46%	0.463	S	S	.	.			trans	-58.4	146.8	171.6	-167.5	177.8	-169.1	-158.7	0	110.1	F60 G63 I68 E70	F60-K66 WeakPolarHBondContact O-CG 3.36Å; G63-K66 VanDerWaalsContact O-CB 3.28Å; G63-K66 WeakPolarHBondContact O-CB 3.22Å; G63-K66 PolarHBondContact O-N 2.93Å; G63-K66 VanDerWaalsContact O-N 3.12Å; K66-I68 PolarHBondContact O-N 2.98Å; K66-E70 WeakPolarHBondContact CE-OE2 3.38Å; K66-E70 IonicContact NZ-OE1 3.68Å; K66-E70 IonicContact NZ-OE2 2.6Å; K66-E70 PolarHBondContact NZ-OE2 2.95Å
67	C	97.9	Very high	96.7	Very high	61 Å²	61	90.1 Å²	90.1	41%	0.412	47%	0.468	S	S	.	.			trans	-57.1	121.7	179.2	-174	0	0	0	0	110.8	F60 G69 E70	F60-C67 HydrophobicContact CB-CB 3.89Å; F60-C67 HydrophobicContact CD1-CB 3.91Å; F60-C67 HydrophobicContact CG-CB 4.38Å; F60-C67 PolarHBondContact O-N 2.69Å; C67-G69 PolarHBondContact O-N 2.92Å; C67-G69 PolarHBondContact SG-N 3.36Å; C67-G69 VanDerWaalsContact SG-N 3.43Å; C67-E70 PolarHBondContact O-N 3.12Å
68	I	97.9	Very high	96.8	Very high	177 Å²	177	94 Å²	94	91%	0.908	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-27.5	176.4	-167	169.5	0	0	0	112.2	K66 E70	K66-I68 PolarHBondContact O-N 2.98Å; I68-E70 VanDerWaalsContact C-N 3.33Å; I68-E70 PolarHBondContact O-N 3.34Å
69	G	98.2	Very high	97	Very high	22 Å²	22	98.3 Å²	98.3	23%	0.227	50%	0.504	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	6.4	179.4	0	0	0	0	0	114.7	C67 K71 I72 A73	C67-G69 PolarHBondContact O-N 2.92Å; C67-G69 PolarHBondContact SG-N 3.36Å; C67-G69 VanDerWaalsContact SG-N 3.43Å; G69-K71 VanDerWaalsContact C-N 3.3Å; G69-K71 PolarHBondContact O-N 3.09Å; G69-I72 PolarHBondContact O-N 3.34Å; G69-A73 WeakPolarHBondContact O-CB 3.37Å; G69-A73 PolarHBondContact O-N 3.17Å
70	E	97.5	Very high	97.1	Very high	33 Å²	33	100.6 Å²	100.6	15%	0.154	51%	0.508	C	S	.	.	H	α-helix	trans	-53.3	-46.7	-176.3	171.1	174.8	-155	0	0	112.4	F60 K66 C67 I68 I72 A73 R74	F60-E70 HydrophobicContact CB-CB 3.99Å; F60-E70 HydrophobicContact CB-CG 4.02Å; F60-E70 HydrophobicContact CD1-CB 3.99Å; F60-E70 HydrophobicContact CD1-CG 4.24Å; F60-E70 HydrophobicContact CD2-CB 4.21Å; F60-E70 HydrophobicContact CD2-CG 3.56Å; F60-E70 HydrophobicContact CE2-CG 4.02Å; F60-E70 HydrophobicContact CG-CB 3.79Å; F60-E70 HydrophobicContact CG-CG 3.67Å; K66-E70 WeakPolarHBondContact CE-OE2 3.38Å; K66-E70 IonicContact NZ-OE1 3.68Å; K66-E70 IonicContact NZ-OE2 2.6Å; K66-E70 PolarHBondContact NZ-OE2 2.95Å; C67-E70 PolarHBondContact O-N 3.12Å; I68-E70 VanDerWaalsContact C-N 3.33Å; I68-E70 PolarHBondContact O-N 3.34Å; E70-I72 PolarHBondContact O-N 3.27Å; E70-A73 PolarHBondContact O-N 3.31Å; E70-R74 HydrophobicContact CG-CG 4.38Å; E70-R74 VanDerWaalsContact O-CG 3.32Å; E70-R74 WeakPolarHBondContact O-CG 3.27Å; E70-R74 PolarHBondContact O-N 2.81Å; E70-R74 IonicContact OE1-CZ 3.4Å; E70-R74 IonicContact OE1-NE 3.32Å; E70-R74 PolarHBondContact OE1-NE 3.47Å; E70-R74 IonicContact OE1-NH2 3.71Å; E70-R74 PolarHBondContact OE1-NH2 2.97Å
71	K	97.4	Very high	97.2	Very high	145 Å²	145	102.2 Å²	102.2	63%	0.63	52%	0.518	S	S	*	.	H	α-helix	trans	-61.8	-47.6	-178	-172.6	-175	-179.3	-60.2	0	111.1	G69 A73 R74 D75	G69-K71 VanDerWaalsContact C-N 3.3Å; G69-K71 PolarHBondContact O-N 3.09Å; K71-A73 PolarHBondContact O-N 3.47Å; K71-R74 PolarHBondContact O-N 2.96Å; K71-D75 IonicContact NZ-OD2 2.64Å; K71-D75 PolarHBondContact NZ-OD2 3.35Å; K71-D75 VanDerWaalsContact O-CG 3.26Å; K71-D75 PolarHBondContact O-N 3.31Å
72	I	98.5	Very high	97.3	Very high	102 Å²	102	102.9 Å²	102.9	52%	0.523	52%	0.521	S	S	.	.	H	α-helix	trans	-59.9	-49.6	179.5	-61.1	171.8	0	0	0	109.8	G69 E70 R74 D75 E76	G69-I72 PolarHBondContact O-N 3.34Å; E70-I72 PolarHBondContact O-N 3.27Å; I72-R74 VanDerWaalsContact C-N 3.29Å; I72-R74 PolarHBondContact O-N 2.98Å; I72-D75 PolarHBondContact O-N 3.44Å; I72-E76 HydrophobicContact CG2-CG 4.16Å; I72-E76 WeakPolarHBondContact CG2-OE1 3.48Å; I72-E76 WeakPolarHBondContact O-CB 3.38Å; I72-E76 WeakPolarHBondContact O-CG 3.34Å; I72-E76 PolarHBondContact O-N 2.83Å
73	A	98.3	Very high	97.5	Very high	35 Å²	35	102.2 Å²	102.2	29%	0.289	51%	0.514	S	S	.	.	H	α-helix	trans	-60.3	-38.5	-179.6	0	0	0	0	0	112.6	F60 G69 E70 K71 L77	F60-A73 HydrophobicContact CE1-CB 3.71Å; F60-A73 HydrophobicContact CZ-CB 3.8Å; G69-A73 WeakPolarHBondContact O-CB 3.37Å; G69-A73 PolarHBondContact O-N 3.17Å; E70-A73 PolarHBondContact O-N 3.31Å; K71-A73 PolarHBondContact O-N 3.47Å; A73-L77 WeakPolarHBondContact O-CB 3.32Å; A73-L77 PolarHBondContact O-N 3Å
74	R	96.9	Very high	97.6	Very high	105 Å²	105	102.9 Å²	102.9	40%	0.396	50%	0.502	S	S	.	.	H	α-helix	trans	-67.9	-45.6	176.7	-73.1	178.4	-177.6	-79.6	3.6	112	F60 E70 K71 I72 L77 F78	F60-R74 HydrophobicContact CE2-CG 4.07Å; F60-R74 HydrophobicContact CZ-CG 4.43Å; E70-R74 HydrophobicContact CG-CG 4.38Å; E70-R74 VanDerWaalsContact O-CG 3.32Å; E70-R74 WeakPolarHBondContact O-CG 3.27Å; E70-R74 PolarHBondContact O-N 2.81Å; E70-R74 IonicContact OE1-CZ 3.4Å; E70-R74 IonicContact OE1-NE 3.32Å; E70-R74 PolarHBondContact OE1-NE 3.47Å; E70-R74 IonicContact OE1-NH2 3.71Å; E70-R74 PolarHBondContact OE1-NH2 2.97Å; K71-R74 PolarHBondContact O-N 2.96Å; I72-R74 VanDerWaalsContact C-N 3.29Å; I72-R74 PolarHBondContact O-N 2.98Å; R74-L77 PolarHBondContact O-N 3.38Å; R74-F78 WeakPolarHBondContact O-CB 3.12Å; R74-F78 PolarHBondContact O-N 3.34Å
75	D	98.2	Very high	97.7	Very high	73 Å²	73	97.5 Å²	97.5	39%	0.39	49%	0.488	S	S	.	.	H	α-helix	trans	-64.8	-46.8	-180	-66.6	-16.5	0	0	0	110.8	K71 I72 F78 L79	K71-D75 IonicContact NZ-OD2 2.64Å; K71-D75 PolarHBondContact NZ-OD2 3.35Å; K71-D75 VanDerWaalsContact O-CG 3.26Å; K71-D75 PolarHBondContact O-N 3.31Å; I72-D75 PolarHBondContact O-N 3.44Å; D75-F78 PolarHBondContact O-N 3.43Å; D75-L79 WeakPolarHBondContact O-CG 2.84Å; D75-L79 PolarHBondContact O-N 2.64Å
76	E	98.5	Very high	97.8	Very high	128 Å²	128	97.2 Å²	97.2	60%	0.598	49%	0.487	S	S	*	.	H	α-helix	trans	-62.1	-44.5	177.1	-74.2	-179.9	176.8	0	0	111.9	I72 F78 L79 L80	I72-E76 HydrophobicContact CG2-CG 4.16Å; I72-E76 WeakPolarHBondContact CG2-OE1 3.48Å; I72-E76 WeakPolarHBondContact O-CB 3.38Å; I72-E76 WeakPolarHBondContact O-CG 3.34Å; I72-E76 PolarHBondContact O-N 2.83Å; E76-F78 VanDerWaalsContact C-N 3.34Å; E76-F78 PolarHBondContact O-N 2.86Å; E76-L79 PolarHBondContact O-N 3.21Å; E76-L80 VanDerWaalsContact O-CB 3.27Å; E76-L80 WeakPolarHBondContact O-CB 3.39Å; E76-L80 PolarHBondContact O-N 3.26Å
77	L	97.8	Very high	97.9	Very high	100 Å²	100	97 Å²	97	52%	0.524	49%	0.493	S	S	.	.	H	α-helix	trans	-62.8	-42.7	178.2	-176.2	63.8	0	0	0	111.4	A73 R74 L80 I81	A73-L77 WeakPolarHBondContact O-CB 3.32Å; A73-L77 PolarHBondContact O-N 3Å; R74-L77 PolarHBondContact O-N 3.38Å; L77-L80 PolarHBondContact O-N 3.49Å; L77-I81 HydrophobicContact CD1-CD1 3.65Å; L77-I81 HydrophobicContact CD1-CG1 4.06Å; L77-I81 HydrophobicContact CD2-CD1 4.46Å; L77-I81 HydrophobicContact CG-CD1 3.74Å; L77-I81 HydrophobicContact CG-CG1 4.43Å; L77-I81 WeakPolarHBondContact O-CB 3.37Å; L77-I81 VanDerWaalsContact O-CG1 3.29Å; L77-I81 WeakPolarHBondContact O-CG1 3.46Å; L77-I81 PolarHBondContact O-N 3.23Å
78	F	98	Very high	97.9	Very high	137 Å²	137	100.3 Å²	100.3	60%	0.601	50%	0.501	S	S	*	.	H	α-helix	trans	-60.5	-50	176.8	176.5	-99.1	0	0	0	111.2	R74 D75 E76 L80 I81 T82	R74-F78 WeakPolarHBondContact O-CB 3.12Å; R74-F78 PolarHBondContact O-N 3.34Å; D75-F78 PolarHBondContact O-N 3.43Å; E76-F78 VanDerWaalsContact C-N 3.34Å; E76-F78 PolarHBondContact O-N 2.86Å; F78-L80 PolarHBondContact O-N 2.8Å; F78-I81 PolarHBondContact O-N 2.94Å; F78-T82 HydrophobicContact CD1-CG2 4.39Å; F78-T82 HydrophobicContact CD2-CG2 4.02Å; F78-T82 HydrophobicContact CE1-CG2 4.07Å; F78-T82 HydrophobicContact CE2-CG2 3.68Å; F78-T82 HydrophobicContact CG-CG2 4.38Å; F78-T82 HydrophobicContact CZ-CG2 3.71Å; F78-T82 WeakPolarHBondContact O-CB 3.38Å; F78-T82 VanDerWaalsContact O-CG2 3.25Å; F78-T82 WeakPolarHBondContact O-CG2 2.84Å; F78-T82 PolarHBondContact O-N 3.28Å; F78-T82 PolarHBondContact O-OG1 2.6Å
79	L	98.6	Very high	97.7	Very high	97 Å²	97	99.9 Å²	99.9	51%	0.508	49%	0.493	S	S	.	.	H	α-helix	trans	-62.6	-42.1	178.9	-69.1	174.4	0	0	0	111.8	D75 E76 T82 N83	D75-L79 WeakPolarHBondContact O-CG 2.84Å; D75-L79 PolarHBondContact O-N 2.64Å; E76-L79 PolarHBondContact O-N 3.21Å; L79-T82 WeakPolarHBondContact CA-OG1 3.21Å; L79-T82 PolarHBondContact O-OG1 2.92Å; L79-N83 VanDerWaalsContact O-CB 3.27Å; L79-N83 WeakPolarHBondContact O-CB 3.39Å; L79-N83 VanDerWaalsContact O-CG 3.32Å; L79-N83 PolarHBondContact O-N 2.87Å; L79-N83 PolarHBondContact O-ND2 2.9Å
80	L	98.3	Very high	97.3	Very high	103 Å²	103	104.2 Å²	104.2	54%	0.539	51%	0.514	S	S	.	.	H	α-helix	trans	-62.8	-51.5	179.3	-177.9	66.4	0	0	0	111.1	E76 L77 F78 N83 L84	E76-L80 VanDerWaalsContact O-CB 3.27Å; E76-L80 WeakPolarHBondContact O-CB 3.39Å; E76-L80 PolarHBondContact O-N 3.26Å; L77-L80 PolarHBondContact O-N 3.49Å; F78-L80 PolarHBondContact O-N 2.8Å; L80-N83 PolarHBondContact O-N 2.98Å; L80-L84 HydrophobicContact CD1-CD1 4.16Å; L80-L84 HydrophobicContact CD1-CG 4.49Å; L80-L84 HydrophobicContact CG-CD1 3.99Å; L80-L84 WeakPolarHBondContact O-CB 3.28Å; L80-L84 VanDerWaalsContact O-CG 3.25Å; L80-L84 WeakPolarHBondContact O-CG 3.39Å; L80-L84 PolarHBondContact O-N 3.4Å
81	I	97.5	Very high	97	Very high	88 Å²	88	111.5 Å²	111.5	45%	0.451	54%	0.541	S	S	.	.	H	α-helix	trans	-64.9	-46.6	-177.4	-67.4	173.7	0	0	0	110.6	L77 F78 N83 L84 V85	L77-I81 HydrophobicContact CD1-CD1 3.65Å; L77-I81 HydrophobicContact CD1-CG1 4.06Å; L77-I81 HydrophobicContact CD2-CD1 4.46Å; L77-I81 HydrophobicContact CG-CD1 3.74Å; L77-I81 HydrophobicContact CG-CG1 4.43Å; L77-I81 WeakPolarHBondContact O-CB 3.37Å; L77-I81 VanDerWaalsContact O-CG1 3.29Å; L77-I81 WeakPolarHBondContact O-CG1 3.46Å; L77-I81 PolarHBondContact O-N 3.23Å; F78-I81 PolarHBondContact O-N 2.94Å; I81-N83 PolarHBondContact O-N 2.99Å; I81-L84 PolarHBondContact O-N 3.31Å; I81-V85 HydrophobicContact CG2-CG2 4.23Å; I81-V85 WeakPolarHBondContact O-CG2 3.46Å; I81-V85 PolarHBondContact O-N 3.18Å
82	T	98.1	Very high	96.5	Very high	54 Å²	54	108.5 Å²	108.5	33%	0.331	53%	0.531	S	S	.	.	H	α-helix	trans	-62.4	-42.3	-179.1	51.9	0	0	0	0	111.8	F78 L79 R86	F78-T82 HydrophobicContact CD1-CG2 4.39Å; F78-T82 HydrophobicContact CD2-CG2 4.02Å; F78-T82 HydrophobicContact CE1-CG2 4.07Å; F78-T82 HydrophobicContact CE2-CG2 3.68Å; F78-T82 HydrophobicContact CG-CG2 4.38Å; F78-T82 HydrophobicContact CZ-CG2 3.71Å; F78-T82 WeakPolarHBondContact O-CB 3.38Å; F78-T82 VanDerWaalsContact O-CG2 3.25Å; F78-T82 WeakPolarHBondContact O-CG2 2.84Å; F78-T82 PolarHBondContact O-N 3.28Å; F78-T82 PolarHBondContact O-OG1 2.6Å; L79-T82 WeakPolarHBondContact CA-OG1 3.21Å; L79-T82 PolarHBondContact O-OG1 2.92Å; T82-R86 WeakPolarHBondContact O-CB 3.47Å; T82-R86 PolarHBondContact O-N 3.49Å
83	N	98.3	Very high	95.8	Very high	85 Å²	85	108.6 Å²	108.6	46%	0.455	54%	0.538	S	S	.	.	H	α-helix	trans	-66.4	-39.3	176.3	-76.8	-51.8	0	0	0	112.5	L79 L80 I81 T87	L79-N83 VanDerWaalsContact O-CB 3.27Å; L79-N83 WeakPolarHBondContact O-CB 3.39Å; L79-N83 VanDerWaalsContact O-CG 3.32Å; L79-N83 PolarHBondContact O-N 2.87Å; L79-N83 PolarHBondContact O-ND2 2.9Å; L80-N83 PolarHBondContact O-N 2.98Å; I81-N83 PolarHBondContact O-N 2.99Å; N83-T87 VanDerWaalsContact O-CB 3.26Å; N83-T87 WeakPolarHBondContact O-CB 3.35Å; N83-T87 PolarHBondContact O-N 2.95Å; N83-T87 PolarHBondContact O-OG1 3.39Å
84	L	97.8	Very high	94.9	Very high	75 Å²	75	112.1 Å²	112.1	39%	0.393	55%	0.552	S	S	.	*	H	α-helix	trans	-62.7	-51.9	176.3	-76.5	170.7	0	0	0	111.6	L80 I81 R86 T87 F88	L80-L84 HydrophobicContact CD1-CD1 4.16Å; L80-L84 HydrophobicContact CD1-CG 4.49Å; L80-L84 HydrophobicContact CG-CD1 3.99Å; L80-L84 WeakPolarHBondContact O-CB 3.28Å; L80-L84 VanDerWaalsContact O-CG 3.25Å; L80-L84 WeakPolarHBondContact O-CG 3.39Å; L80-L84 PolarHBondContact O-N 3.4Å; I81-L84 PolarHBondContact O-N 3.31Å; L84-R86 VanDerWaalsContact C-N 3.33Å; L84-R86 PolarHBondContact O-N 3.04Å; L84-T87 PolarHBondContact O-N 3.48Å; L84-F88 HydrophobicContact CD2-CD2 4.14Å; L84-F88 HydrophobicContact CD2-CE2 4.48Å; L84-F88 PolarHBondContact O-N 3.42Å
85	V	96.6	Very high	93.8	Very high	107 Å²	107	111.7 Å²	111.7	65%	0.648	56%	0.562	S	S	*	*	H	α-helix	trans	-68.3	-33.6	-177.5	178.2	0	0	0	0	111.7	I81	I81-V85 HydrophobicContact CG2-CG2 4.23Å; I81-V85 WeakPolarHBondContact O-CG2 3.46Å; I81-V85 PolarHBondContact O-N 3.18Å
86	R	97.6	Very high	92.5	Very high	218 Å²	218	112.3 Å²	112.3	82%	0.823	58%	0.577	S	S	*	*	H	α-helix	trans	-67.5	-38.5	175.8	-179.1	179.3	179.2	175.7	1.1	112.6	T82 L84	T82-R86 WeakPolarHBondContact O-CB 3.47Å; T82-R86 PolarHBondContact O-N 3.49Å; L84-R86 VanDerWaalsContact C-N 3.33Å; L84-R86 PolarHBondContact O-N 3.04Å
87	T	97.7	Very high	90.9	Very high	91 Å²	91	112.3 Å²	112.3	56%	0.558	58%	0.576	S	S	*	*	H	α-helix	trans	-95	-34.3	-169.7	-48.9	0	0	0	0	112.5	N83 L84	N83-T87 VanDerWaalsContact O-CB 3.26Å; N83-T87 WeakPolarHBondContact O-CB 3.35Å; N83-T87 PolarHBondContact O-N 2.95Å; N83-T87 PolarHBondContact O-OG1 3.39Å; L84-T87 PolarHBondContact O-N 3.48Å
88	F	97.3	Very high	89.3	Confident	132 Å²	132	115.2 Å²	115.2	58%	0.579	58%	0.581	S	S	*	*			trans	-126.2	145.2	-169.7	-57.1	-72.2	0	0	0	112.7	L84 V90	L84-F88 HydrophobicContact CD2-CD2 4.14Å; L84-F88 HydrophobicContact CD2-CE2 4.48Å; L84-F88 PolarHBondContact O-N 3.42Å; F88-V90 HydrophobicContact CB-CG2 4.45Å; F88-V90 PolarHBondContact O-N 3.43Å
89	K	94.4	Very high	87.6	Confident	167 Å²	167	112.3 Å²	112.3	73%	0.726	58%	0.582	S	S	*	*			trans	-90.2	92.8	163.4	-169.4	170.9	-169.2	168.7	0	109.4	R91	K89-R91 PolarHBondContact O-N 3.21Å
90	V	91	Very high	85.9	Confident	113 Å²	113	117.3 Å²	117.3	69%	0.685	60%	0.6	S	S	*	*			trans	-69	128.8	-178.2	-174.6	0	0	0	0	110.4	F88	F88-V90 HydrophobicContact CB-CG2 4.45Å; F88-V90 PolarHBondContact O-N 3.43Å
91	R	89.5	Confident	83.9	Confident	187 Å²	187	116.9 Å²	116.9	71%	0.706	61%	0.606	S	S	*	*			trans	-140.4	146	176.1	-69.2	-179.7	170.6	177.1	-5.8	109.3	K89	K89-R91 PolarHBondContact O-N 3.21Å
92	L	87.6	Confident	81.7	Confident	82 Å²	82	118.1 Å²	118.1	43%	0.429	62%	0.62	S	S	.	*			trans	-74.2	143.6	168.1	-67.4	176.8	0	0	0	109.5	L94 F97 Y98	L92-L94 VanDerWaalsContact C-N 3.32Å; L92-L94 PolarHBondContact O-N 3.27Å; L92-F97 HydrophobicContact CD1-CB 4.06Å; L92-F97 HydrophobicContact CD2-CB 4.31Å; L92-Y98 HydrophobicContact CD1-CD1 3.6Å; L92-Y98 HydrophobicContact CD1-CE1 3.61Å; L92-Y98 HydrophobicContact CD1-CG 4.26Å; L92-Y98 HydrophobicContact CG-CE1 4.48Å
93	P	83.8	Confident	79.4	Confident	104 Å²	104	127 Å²	127	68%	0.675	65%	0.647	S	S	*	*	S	Bend	trans	-68.9	-31.3	-177.6	26.2	-33.3	0	0	0	112.4	F97	P93-F97 HydrophobicContact CG-CD2 3.98Å; P93-F97 HydrophobicContact CG-CE2 3.92Å
94	L	79.3	Confident	76.6	Confident	109 Å²	109	127.1 Å²	127.1	57%	0.571	65%	0.654	S	S	*	*	S	Bend	trans	-149.4	153.4	-179	-70.7	173.4	0	0	0	112.5	L92 A96 F97	L92-L94 VanDerWaalsContact C-N 3.32Å; L92-L94 PolarHBondContact O-N 3.27Å; L94-A96 VanDerWaalsContact C-N 3.26Å; L94-A96 PolarHBondContact O-N 3.12Å; L94-F97 HydrophobicContact CB-CD2 4.2Å; L94-F97 HydrophobicContact CB-CE2 4.46Å; L94-F97 PolarHBondContact O-N 2.9Å
95	P	73.6	Confident	73.7	Confident	95 Å²	95	129.7 Å²	129.7	62%	0.617	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-62.6	-25.7	-179	-23.1	33.1	0	0	0	115.8	F97 Y98	P95-F97 PolarHBondContact O-N 3.1Å; P95-Y98 VanDerWaalsContact CA-CE2 3.48Å; P95-Y98 HydrophobicContact CB-CD2 3.82Å; P95-Y98 HydrophobicContact CB-CE2 3.9Å; P95-Y98 HydrophobicContact CG-CE2 4.45Å; P95-Y98 WeakPolarHBondContact O-CB 2.97Å; P95-Y98 WeakPolarHBondContact O-CD2 3.21Å; P95-Y98 PolarHBondContact O-N 2.81Å
96	A	71.1	Confident	70.8	Confident	86 Å²	86	133.2 Å²	133.2	71%	0.711	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-59.3	-20.5	177.7	0	0	0	0	0	113.1	L94	L94-A96 VanDerWaalsContact C-N 3.26Å; L94-A96 PolarHBondContact O-N 3.12Å
97	F	65.1	Low	68	Low	128 Å²	128	130.6 Å²	130.6	56%	0.561	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-80.7	-8.8	175.4	-69.8	-79.7	0	0	0	114.3	L92 P93 L94 P95 A99	L92-F97 HydrophobicContact CD1-CB 4.06Å; L92-F97 HydrophobicContact CD2-CB 4.31Å; P93-F97 HydrophobicContact CG-CD2 3.98Å; P93-F97 HydrophobicContact CG-CE2 3.92Å; L94-F97 HydrophobicContact CB-CD2 4.2Å; L94-F97 HydrophobicContact CB-CE2 4.46Å; L94-F97 PolarHBondContact O-N 2.9Å; P95-F97 PolarHBondContact O-N 3.1Å; F97-A99 PolarHBondContact O-N 3.18Å
98	Y	64	Low	64.9	Low	161 Å²	161	133 Å²	133	63%	0.631	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-69.4	-18.3	176.5	-69.7	-63	0	0	0	113.1	L92 P95 F100	L92-Y98 HydrophobicContact CD1-CD1 3.6Å; L92-Y98 HydrophobicContact CD1-CE1 3.61Å; L92-Y98 HydrophobicContact CD1-CG 4.26Å; L92-Y98 HydrophobicContact CG-CE1 4.48Å; P95-Y98 VanDerWaalsContact CA-CE2 3.48Å; P95-Y98 HydrophobicContact CB-CD2 3.82Å; P95-Y98 HydrophobicContact CB-CE2 3.9Å; P95-Y98 HydrophobicContact CG-CE2 4.45Å; P95-Y98 WeakPolarHBondContact O-CB 2.97Å; P95-Y98 WeakPolarHBondContact O-CD2 3.21Å; P95-Y98 PolarHBondContact O-N 2.81Å; Y98-F100 VanDerWaalsContact C-N 3.3Å; Y98-F100 PolarHBondContact O-N 3.38Å
99	A	63.3	Low	62.1	Low	76 Å²	76	135.8 Å²	135.8	63%	0.628	72%	0.717	S	S	*	*			trans	-75.1	85.3	174.3	0	0	0	0	0	109.7	F97 S101	F97-A99 PolarHBondContact O-N 3.18Å; A99-S101 PolarHBondContact O-N 2.69Å
100	F	62.4	Low	60.4	Low	202 Å²	202	134.2 Å²	134.2	89%	0.886	72%	0.717	S	S	*	*			trans	-60.3	80.5	148.9	-99.1	-88.3	0	0	0	106.4	Y98 P102	Y98-F100 VanDerWaalsContact C-N 3.3Å; Y98-F100 PolarHBondContact O-N 3.38Å; F100-P102 WeakPolarHBondContact O-CD 3.34Å; F100-P102 VanDerWaalsContact O-N 3.17Å
101	S	56.1	Low	58.8	Low	95 Å²	95	135.3 Å²	135.3	66%	0.664	72%	0.719	S	S	*	*			trans	-65.4	117.6	166.1	61.7	0	0	0	0	105.3	A99 R103	A99-S101 PolarHBondContact O-N 2.69Å; S101-R103 PolarHBondContact O-N 3.49Å; S101-R103 VanDerWaalsContact O-N 3.1Å
102	P	51.6	Low	57.1	Low	113 Å²	113	132.4 Å²	132.4	73%	0.734	72%	0.719	S	S	*	*			trans	-54.7	126	161.5	-12	27.1	0	0	0	103.8	F100 S104	F100-P102 WeakPolarHBondContact O-CD 3.34Å; F100-P102 VanDerWaalsContact O-N 3.17Å; P102-S104 VanDerWaalsContact C-N 3.33Å; P102-S104 PolarHBondContact O-N 3.18Å
103	R	49.5	Very low	55.3	Low	242 Å²	242	135.4 Å²	135.4	91%	0.913	74%	0.736	S	S	*	*			trans	-46.5	111.3	167.8	-82.5	-172.5	-177.8	-168.1	1.3	105	S101 N105	S101-R103 PolarHBondContact O-N 3.49Å; S101-R103 VanDerWaalsContact O-N 3.1Å; R103-N105 PolarHBondContact O-N 3.23Å
104	S	39.9	Very low	53.6	Low	86 Å²	86	137.4 Å²	137.4	60%	0.601	74%	0.74	S	S	*	*			trans	-45.9	120.1	-170.8	57.8	0	0	0	0	106.8	P102 K106	P102-S104 VanDerWaalsContact C-N 3.33Å; P102-S104 PolarHBondContact O-N 3.18Å; S104-K106 PolarHBondContact O-N 2.65Å
105	N	36.8	Very low	51.8	Low	129 Å²	129	139.3 Å²	139.3	69%	0.69	75%	0.752	S	S	*	*			trans	-67.8	77.2	169	-160.7	17.4	0	0	0	106.1	R103 Q107	R103-N105 PolarHBondContact O-N 3.23Å; N105-Q107 PolarHBondContact O-N 3.49Å; N105-Q107 WeakPolarHBondContact OD1-CG 3.35Å
106	K	34.9	Very low	50.3	Low	181 Å²	181	142.4 Å²	142.4	79%	0.787	76%	0.761	S	S	*	*			trans	-71.7	64	156.6	-74.1	-171.9	-178.1	-174.9	0	106.5	S104	S104-K106 PolarHBondContact O-N 2.65Å
107	Q	39.6	Very low	48.7	Very low	163 Å²	163	146.8 Å²	146.8	76%	0.762	77%	0.765	S	S	*	*			trans	-107.8	78.1	147.5	-71.1	-173.6	3.6	0	0	104	N105	N105-Q107 PolarHBondContact O-N 3.49Å; N105-Q107 WeakPolarHBondContact OD1-CG 3.35Å
108	N	32.2	Very low	47.3	Very low	142 Å²	142	148.3 Å²	148.3	76%	0.759	78%	0.782	S	S	*	*			trans	-62.8	140.7	160.9	-93.8	-7.1	0	0	0	107.9
109	S	37.5	Very low	45.8	Very low	190 Å²	190	147.2 Å²	147.2	100%	1.329	80%	0.796	S	S	*	*			trans	57.2	0	148.7	65	0	0	0	0	118.4

Retrieved 109 of 109 residues in 56.8 ms (Link to these results)

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