A0A5K4FF55_SCHMA Loading...

Chromo domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FF55, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 86 aa.

						>A0A5K4FF55_SCHMA|A0A5K4FF55
MPTRHWKNSTGDEVEFEVEDILDMRTINGEPEYLIKWKGHSPSKNTWEPQSNLNCPVLLRRFLDKHAAIEPTVATIAQNRTDLIVV
					

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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	52.7	Low	59.6	Low	226 Å²	226	149.4 Å²	149.4	100%	1.113	78%	0.78	S	S	*	*				0	110.2	0	-57.6	-61	175	0	0	107.6	T3	M1-T3 PolarHBondContact O-N 3.31Å
2	P	62.6	Low	58.9	Low	135 Å²	135	147.4 Å²	147.4	88%	0.877	77%	0.771	S	S	*	*			trans	-77.3	114.8	-178	28.8	-29.5	0	0	0	110.1	R4	P2-R4 PolarHBondContact O-N 2.83Å
3	T	68.4	Low	58.9	Low	130 Å²	130	149.5 Å²	149.5	80%	0.798	77%	0.774	S	S	*	*			trans	-69.6	115.9	168.8	38.9	0	0	0	0	108.4	M1 H5	M1-T3 PolarHBondContact O-N 3.31Å; T3-H5 VanDerWaalsContact C-N 3.31Å; T3-H5 PolarHBondContact O-N 2.99Å
4	R	63.2	Low	59.2	Low	252 Å²	252	145.1 Å²	145.1	95%	0.951	76%	0.757	S	S	*	*			trans	-65.1	90.3	176.2	-154.8	172.2	-160.8	-124.2	3.8	108.4	P2 W6	P2-R4 PolarHBondContact O-N 2.83Å; R4-W6 PolarHBondContact O-N 3.37Å
5	H	62.2	Low	59.7	Low	143 Å²	143	146.6 Å²	146.6	66%	0.662	76%	0.759	S	S	*	*			trans	-85.6	86	179.8	-162.3	80.6	0	0	0	108.8	T3 K7	T3-H5 VanDerWaalsContact C-N 3.31Å; T3-H5 PolarHBondContact O-N 2.99Å; H5-K7 VanDerWaalsContact CD2-CG 3.45Å; H5-K7 WeakPolarHBondContact CD2-CG 3.38Å; H5-K7 WeakPolarHBondContact NE2-CE 3.38Å; H5-K7 WeakPolarHBondContact NE2-CG 2.92Å; H5-K7 PolarHBondContact O-N 3.12Å
6	W	61.8	Low	60.5	Low	208 Å²	208	144.2 Å²	144.2	79%	0.788	74%	0.741	S	S	*	*			trans	-76.5	99.5	164.4	167.1	-88.7	0	0	0	107.6	R4 N8	R4-W6 PolarHBondContact O-N 3.37Å; W6-N8 HydrophobicContact CZ2-CB 4.45Å; W6-N8 VanDerWaalsContact CZ2-OD1 3.24Å; W6-N8 WeakPolarHBondContact CZ2-OD1 3.24Å; W6-N8 PolarHBondContact O-N 2.62Å
7	K	59.4	Low	61.7	Low	155 Å²	155	143.3 Å²	143.3	67%	0.674	73%	0.733	S	S	*	*			trans	-77.1	96.6	161.5	-83.2	168.2	176.8	-178.6	0	107.3	H5 S9	H5-K7 VanDerWaalsContact CD2-CG 3.45Å; H5-K7 WeakPolarHBondContact CD2-CG 3.38Å; H5-K7 WeakPolarHBondContact NE2-CE 3.38Å; H5-K7 WeakPolarHBondContact NE2-CG 2.92Å; H5-K7 PolarHBondContact O-N 3.12Å; K7-S9 PolarHBondContact O-N 3.45Å
8	N	57.8	Low	63	Low	114 Å²	114	136.7 Å²	136.7	61%	0.61	70%	0.701	S	S	*	*			trans	-79.8	79.4	144.4	-135.5	55	0	0	0	106	W6	W6-N8 HydrophobicContact CZ2-CB 4.45Å; W6-N8 VanDerWaalsContact CZ2-OD1 3.24Å; W6-N8 WeakPolarHBondContact CZ2-OD1 3.24Å; W6-N8 PolarHBondContact O-N 2.62Å
9	S	56.6	Low	64.3	Low	85 Å²	85	133.9 Å²	133.9	59%	0.594	69%	0.685	S	S	*	*			trans	-81.6	125	171.9	-167.9	0	0	0	0	107	K7	K7-S9 PolarHBondContact O-N 3.45Å
10	T	55.3	Low	65.5	Low	119 Å²	119	131.2 Å²	131.2	73%	0.73	67%	0.671	S	S	*	*	S	Bend	trans	81.5	87	149.7	7.6	0	0	0	0	117.6	D12	T10-D12 PolarHBondContact O-N 3.41Å
11	G	55.4	Low	66.6	Low	76 Å²	76	125.4 Å²	125.4	78%	0.784	64%	0.642	S	S	*	*				71.3	34.7	125.5	0	0	0	0	0	118.8	E13	G11-E13 PolarHBondContact O-N 2.88Å
12	D	51.3	Low	68.3	Low	126 Å²	126	118.3 Å²	118.3	67%	0.674	61%	0.608	S	S	*	*			trans	-68.8	95.7	166.2	-68.8	-87.7	0	0	0	109.6	T10 V14	T10-D12 PolarHBondContact O-N 3.41Å; D12-V14 HydrophobicContact CB-CG2 4.13Å; D12-V14 PolarHBondContact O-N 3.35Å
13	E	59.2	Low	69.6	Low	174 Å²	174	115.4 Å²	115.4	81%	0.813	59%	0.585	S	S	*	*			trans	-60.5	87.3	153.2	-66.7	-179.2	112.5	0	0	106.4	G11 E15	G11-E13 PolarHBondContact O-N 2.88Å; E13-E15 PolarHBondContact O-N 2.86Å
14	V	62.9	Low	70.4	Confident	88 Å²	88	111.1 Å²	111.1	53%	0.533	56%	0.556	S	S	.	*			trans	-63.6	104.6	-178.7	-178.6	0	0	0	0	107.3	D12 F16	D12-V14 HydrophobicContact CB-CG2 4.13Å; D12-V14 PolarHBondContact O-N 3.35Å; V14-F16 HydrophobicContact CB-CD2 4.26Å; V14-F16 HydrophobicContact CB-CE2 3.6Å; V14-F16 HydrophobicContact CB-CZ 3.77Å; V14-F16 HydrophobicContact CG1-CD1 4.16Å; V14-F16 HydrophobicContact CG1-CD2 4.08Å; V14-F16 HydrophobicContact CG1-CE1 3.69Å; V14-F16 HydrophobicContact CG1-CE2 3.6Å; V14-F16 HydrophobicContact CG1-CG 4.33Å; V14-F16 HydrophobicContact CG1-CZ 3.38Å; V14-F16 WeakPolarHBondContact O-CD2 3.24Å; V14-F16 VanDerWaalsContact O-CE2 3.29Å; V14-F16 WeakPolarHBondContact O-CE2 3.32Å; V14-F16 PolarHBondContact O-N 3.21Å; V14-F16 VanDerWaalsContact O-N 3.14Å
15	E	66.8	Low	71.6	Confident	168 Å²	168	103.5 Å²	103.5	79%	0.785	53%	0.528	S	S	*	.			trans	-68.1	108.7	173.1	-63.9	-179.2	101	0	0	108.3	E13	E13-E15 PolarHBondContact O-N 2.86Å
16	F	72.8	Confident	72.7	Confident	108 Å²	108	100.2 Å²	100.2	47%	0.474	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-94.1	138.1	174.4	-64.1	-85.4	0	0	0	109.6	V14 V18 W37	V14-F16 HydrophobicContact CB-CD2 4.26Å; V14-F16 HydrophobicContact CB-CE2 3.6Å; V14-F16 HydrophobicContact CB-CZ 3.77Å; V14-F16 HydrophobicContact CG1-CD1 4.16Å; V14-F16 HydrophobicContact CG1-CD2 4.08Å; V14-F16 HydrophobicContact CG1-CE1 3.69Å; V14-F16 HydrophobicContact CG1-CE2 3.6Å; V14-F16 HydrophobicContact CG1-CG 4.33Å; V14-F16 HydrophobicContact CG1-CZ 3.38Å; V14-F16 WeakPolarHBondContact O-CD2 3.24Å; V14-F16 VanDerWaalsContact O-CE2 3.29Å; V14-F16 WeakPolarHBondContact O-CE2 3.32Å; V14-F16 PolarHBondContact O-N 3.21Å; V14-F16 VanDerWaalsContact O-N 3.14Å; F16-V18 PolarHBondContact O-N 2.83Å; F16-W37 HydrophobicContact CB-CD2 4Å; F16-W37 HydrophobicContact CB-CE3 3.24Å; F16-W37 HydrophobicContact CB-CH2 4.13Å; F16-W37 HydrophobicContact CB-CZ3 3.34Å; F16-W37 HydrophobicContact CG-CE3 4.3Å; F16-W37 HydrophobicContact CG-CZ3 4.4Å; F16-W37 WeakPolarHBondContact O-CZ3 3.36Å
17	E	80.3	Confident	73.8	Confident	129 Å²	129	93.4 Å²	93.4	60%	0.603	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-69.2	123	176	-73.4	-170.5	101.7	0	0	110.5	K38	E17-K38 HydrophobicContact CB-CB 4.01Å; E17-K38 HydrophobicContact CB-CD 4.06Å; E17-K38 VanDerWaalsContact CD-NZ 3.27Å; E17-K38 WeakPolarHBondContact O-CB 3.45Å; E17-K38 PolarHBondContact O-N 2.87Å; E17-K38 IonicContact OE1-NZ 2.83Å; E17-K38 PolarHBondContact OE1-NZ 3.49Å; E17-K38 IonicContact OE2-NZ 2.79Å; E17-K38 PolarHBondContact OE2-NZ 3Å
18	V	84.6	Confident	74.9	Confident	25 Å²	25	93.7 Å²	93.7	15%	0.152	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	124.8	171.5	-179	0	0	0	0	109.5	F16 I35 W37 L58	F16-V18 PolarHBondContact O-N 2.83Å; V18-I35 HydrophobicContact CB-CG2 4.15Å; V18-I35 HydrophobicContact CG1-CD1 4.46Å; V18-I35 HydrophobicContact CG1-CG2 3.77Å; V18-I35 HydrophobicContact CG2-CG2 3.61Å; V18-W37 HydrophobicContact CG2-CE3 4.38Å; V18-W37 HydrophobicContact CG2-CZ3 3.99Å; V18-L58 HydrophobicContact CB-CD1 4.01Å; V18-L58 HydrophobicContact CG1-CD1 3.66Å
19	E	89	Confident	76	Confident	84 Å²	84	91.2 Å²	91.2	39%	0.393	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-51.6	172.2	-169.5	172.9	104.6	0	0	111.2	K36 K38	E19-K36 WeakPolarHBondContact CA-O 3.44Å; E19-K36 HydrophobicContact CB-CB 4.37Å; E19-K36 HydrophobicContact CB-CD 4.39Å; E19-K36 HydrophobicContact CB-CG 4.24Å; E19-K36 VanDerWaalsContact CB-O 3.27Å; E19-K36 WeakPolarHBondContact CB-O 2.98Å; E19-K36 HydrophobicContact CG-CD 4.42Å; E19-K36 PolarHBondContact N-O 3.2Å; E19-K36 VanDerWaalsContact OE1-CD 3.24Å; E19-K36 WeakPolarHBondContact OE1-CD 3.35Å; E19-K36 WeakPolarHBondContact OE1-CE 3.14Å; E19-K36 IonicContact OE1-NZ 2.62Å; E19-K36 PolarHBondContact OE1-NZ 3.06Å; E19-K38 HydrophobicContact CB-CB 4.01Å
20	D	87.6	Confident	77.3	Confident	79 Å²	79	93 Å²	93	42%	0.422	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	160.3	178.3	-148.4	-6.3	0	0	0	111.4	K36	D20-K36 PolarHBondContact N-O 2.69Å; D20-K36 VanDerWaalsContact O-CB 3.31Å; D20-K36 WeakPolarHBondContact O-CB 3.27Å; D20-K36 PolarHBondContact O-N 3.33Å
21	I	89.7	Confident	78.7	Confident	9 Å²	9	89.2 Å²	89.2	5%	0.046	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	115.8	170.6	-59.3	175.6	0	0	0	107.2	Y33 I35 L53 L58 L59 F62	I21-Y33 HydrophobicContact CD1-CD1 4.49Å; I21-Y33 HydrophobicContact CG2-CD1 3.84Å; I21-Y33 HydrophobicContact CG2-CG 4.36Å; I21-I35 HydrophobicContact CG1-CD1 3.98Å; I21-L53 HydrophobicContact CD1-CD1 4.46Å; I21-L58 HydrophobicContact CD1-CB 4.11Å; I21-L58 HydrophobicContact CG1-CB 4.36Å; I21-L59 HydrophobicContact CD1-CB 4.24Å; I21-L59 HydrophobicContact CD1-CD1 4.16Å; I21-F62 HydrophobicContact CB-CB 4.13Å; I21-F62 HydrophobicContact CB-CD2 3.77Å; I21-F62 HydrophobicContact CB-CE2 4.48Å; I21-F62 HydrophobicContact CB-CG 4.01Å; I21-F62 HydrophobicContact CD1-CB 4.18Å; I21-F62 HydrophobicContact CG2-CB 4.21Å; I21-F62 HydrophobicContact CG2-CD1 4.12Å; I21-F62 HydrophobicContact CG2-CD2 3.42Å; I21-F62 VanDerWaalsContact CG2-CD2 3.42Å; I21-F62 HydrophobicContact CG2-CE1 4.45Å; I21-F62 HydrophobicContact CG2-CE2 3.75Å; I21-F62 HydrophobicContact CG2-CG 3.61Å; I21-F62 HydrophobicContact CG2-CZ 4.26Å; I21-F62 WeakPolarHBondContact O-CD2 3.4Å
22	L	88.4	Confident	80.4	Confident	78 Å²	78	87.6 Å²	87.6	41%	0.408	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-35.1	-175.7	-64.4	179.5	0	0	0	112.6	L34 K36 N45	L22-L34 HydrophobicContact CB-CB 4.4Å; L22-L34 HydrophobicContact CB-CD2 4.03Å; L22-L34 HydrophobicContact CB-CG 4.24Å; L22-L34 HydrophobicContact CD1-CD2 4.3Å; L22-L34 PolarHBondContact N-O 3.14Å; L22-K36 HydrophobicContact CD1-CB 4.14Å; L22-K36 HydrophobicContact CD2-CD 4.32Å; L22-K36 HydrophobicContact CG-CB 4.09Å; L22-N45 WeakPolarHBondContact CD1-ND2 3.4Å
23	D	88.6	Confident	82.2	Confident	73 Å²	73	81.7 Å²	81.7	39%	0.39	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	164.3	-172	-150.4	-14.8	0	0	0	111.2	Y33 L34 W47 F62	D23-Y33 CarbonylContact O-C 3.55Å; D23-Y33 WeakPolarHBondContact O-CA 3.29Å; D23-L34 HydrophobicContact CB-CB 3.85Å; D23-L34 HydrophobicContact CB-CD2 4.19Å; D23-L34 PolarHBondContact O-N 2.85Å; D23-W47 HydrophobicContact CB-CH2 3.76Å; D23-W47 HydrophobicContact CB-CZ3 4.32Å; D23-F62 VanDerWaalsContact C-CZ 3.46Å
24	M	86.6	Confident	83.7	Confident	40 Å²	40	74.9 Å²	74.9	20%	0.197	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	140.8	175.8	178.3	-168.9	75	0	0	110.1	E32 Y33 F62 L63	M24-E32 CarbonylContact C-O 3.6Å; M24-E32 VanDerWaalsContact CA-O 3.29Å; M24-E32 WeakPolarHBondContact CA-O 3.03Å; M24-Y33 HydrophobicContact CB-CD1 3.65Å; M24-Y33 HydrophobicContact CB-CE1 3.76Å; M24-Y33 HydrophobicContact CG-CD1 3.65Å; M24-Y33 HydrophobicContact CG-CE1 3.35Å; M24-Y33 HydrophobicContact CG-CE2 4.47Å; M24-Y33 HydrophobicContact CG-CG 4.35Å; M24-Y33 HydrophobicContact SD-CD1 4.18Å; M24-Y33 HydrophobicContact SD-CE1 3.28Å; M24-Y33 WeakPolarHBondContact SD-CE1 3.39Å; M24-Y33 VanDerWaalsContact SD-CZ 3.55Å; M24-Y33 PolarHBondContact SD-OH 2.72Å; M24-F62 HydrophobicContact CB-CD1 4.25Å; M24-F62 HydrophobicContact CB-CE1 3.23Å; M24-F62 HydrophobicContact CB-CZ 3.59Å; M24-F62 HydrophobicContact CG-CE1 4.22Å; M24-F62 HydrophobicContact SD-CE1 4.16Å; M24-L63 HydrophobicContact SD-CD2 3.77Å
25	R	87.4	Confident	85	Confident	93 Å²	93	70.7 Å²	70.7	35%	0.351	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	153.2	174	69.1	-173.8	-173	-178.7	3.8	110	I27 E32 W47	R25-I27 HydrophobicContact CG-CD1 4.35Å; R25-I27 HydrophobicContact CG-CG1 4.12Å; R25-E32 HydrophobicContact CG-CB 4.13Å; R25-E32 IonicContact CZ-OE2 3Å; R25-E32 PolarHBondContact N-O 2.9Å; R25-E32 IonicContact NE-OE2 2.78Å; R25-E32 PolarHBondContact NE-OE2 3.24Å; R25-E32 IonicContact NH2-OE2 3.22Å; R25-E32 PolarHBondContact NH2-OE2 3.27Å; R25-E32 PolarHBondContact O-N 3.42Å; R25-E32 VanDerWaalsContact O-O 3.1Å; R25-W47 HydrophobicContact CB-CH2 4.24Å; R25-W47 HydrophobicContact CB-CZ3 3.95Å; R25-W47 HydrophobicContact CG-CD2 4.43Å; R25-W47 HydrophobicContact CG-CE3 3.68Å; R25-W47 HydrophobicContact CG-CH2 4.01Å; R25-W47 HydrophobicContact CG-CZ3 3.44Å; R25-W47 VanDerWaalsContact CG-CZ3 3.44Å
26	T	86	Confident	86.1	Confident	74 Å²	74	65.4 Å²	65.4	45%	0.454	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	115	173.8	-54.2	0	0	0	0	109.2	E30	T26-E30 WeakPolarHBondContact CA-O 3.2Å
27	I	84.7	Confident	87	Confident	65 Å²	65	61.8 Å²	61.8	33%	0.333	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	129	176.9	-62.7	-167	0	0	0	108.7	R25 G29 E30 E32	R25-I27 HydrophobicContact CG-CD1 4.35Å; R25-I27 HydrophobicContact CG-CG1 4.12Å; I27-G29 PolarHBondContact O-N 3.4Å; I27-G29 VanDerWaalsContact O-N 3.08Å; I27-E30 PolarHBondContact N-O 3.07Å; I27-E30 PolarHBondContact O-N 3.19Å; I27-E32 WeakPolarHBondContact CD1-OE2 3.42Å
28	N	81.1	Confident	87.3	Confident	160 Å²	160	60.7 Å²	60.7	86%	0.856	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	23.7	-178	-60.9	-43.9	0	0	0	114.9	E30	N28-E30 VanDerWaalsContact C-N 3.3Å
29	G	82.4	Confident	87.3	Confident	63 Å²	63	63.1 Å²	63.1	65%	0.649	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	85	-0.5	-175.5	0	0	0	0	0	114.3	I27	I27-G29 PolarHBondContact O-N 3.4Å; I27-G29 VanDerWaalsContact O-N 3.08Å
30	E	83.1	Confident	87.1	Confident	122 Å²	122	63.3 Å²	63.3	57%	0.57	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.5	127.2	175.3	-63	-168.4	97.6	0	0	110.6	T26 I27 N28 E32	T26-E30 WeakPolarHBondContact CA-O 3.2Å; I27-E30 PolarHBondContact N-O 3.07Å; I27-E30 PolarHBondContact O-N 3.19Å; N28-E30 VanDerWaalsContact C-N 3.3Å; E30-E32 PolarHBondContact O-N 3.49Å
31	P	84.8	Confident	87	Confident	39 Å²	39	63.2 Å²	63.2	25%	0.253	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	122.8	174.1	28.6	-31.3	0	0	0	110.6	Y33 Q50	P31-Y33 HydrophobicContact CB-CE2 4.01Å; P31-Q50 HydrophobicContact CG-CB 4.16Å; P31-Q50 PolarHBondContact O-N 2.86Å
32	E	90.7	Very high	86.8	Confident	42 Å²	42	66.8 Å²	66.8	20%	0.196	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	146.1	171.6	-62.3	-176.7	130.1	0	0	110.3	M24 R25 I27 E30 W47 E48	M24-E32 CarbonylContact C-O 3.6Å; M24-E32 VanDerWaalsContact CA-O 3.29Å; M24-E32 WeakPolarHBondContact CA-O 3.03Å; R25-E32 HydrophobicContact CG-CB 4.13Å; R25-E32 IonicContact CZ-OE2 3Å; R25-E32 PolarHBondContact N-O 2.9Å; R25-E32 IonicContact NE-OE2 2.78Å; R25-E32 PolarHBondContact NE-OE2 3.24Å; R25-E32 IonicContact NH2-OE2 3.22Å; R25-E32 PolarHBondContact NH2-OE2 3.27Å; R25-E32 PolarHBondContact O-N 3.42Å; R25-E32 VanDerWaalsContact O-O 3.1Å; I27-E32 WeakPolarHBondContact CD1-OE2 3.42Å; E30-E32 PolarHBondContact O-N 3.49Å; E32-W47 HydrophobicContact CB-CE3 4.17Å; E32-E48 CarbonylContact C-O 3.6Å; E32-E48 WeakPolarHBondContact CA-O 3.31Å
33	Y	89.6	Confident	86.8	Confident	3 Å²	3	68.6 Å²	68.6	1%	0.012	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	137.7	-177.3	-61.1	-93.1	0	0	0	110.4	I21 D23 M24 P31 I35 W47 E48 Q50 L53 L59 F62 L63	I21-Y33 HydrophobicContact CD1-CD1 4.49Å; I21-Y33 HydrophobicContact CG2-CD1 3.84Å; I21-Y33 HydrophobicContact CG2-CG 4.36Å; D23-Y33 CarbonylContact O-C 3.55Å; D23-Y33 WeakPolarHBondContact O-CA 3.29Å; M24-Y33 HydrophobicContact CB-CD1 3.65Å; M24-Y33 HydrophobicContact CB-CE1 3.76Å; M24-Y33 HydrophobicContact CG-CD1 3.65Å; M24-Y33 HydrophobicContact CG-CE1 3.35Å; M24-Y33 HydrophobicContact CG-CE2 4.47Å; M24-Y33 HydrophobicContact CG-CG 4.35Å; M24-Y33 HydrophobicContact SD-CD1 4.18Å; M24-Y33 HydrophobicContact SD-CE1 3.28Å; M24-Y33 WeakPolarHBondContact SD-CE1 3.39Å; M24-Y33 VanDerWaalsContact SD-CZ 3.55Å; M24-Y33 PolarHBondContact SD-OH 2.72Å; P31-Y33 HydrophobicContact CB-CE2 4.01Å; Y33-I35 PolarHBondContact O-N 2.9Å; Y33-W47 CarbonylContact O-C 3.54Å; Y33-W47 WeakPolarHBondContact O-CA 3.29Å; Y33-E48 PolarHBondContact N-O 3.47Å; Y33-E48 PolarHBondContact O-N 3.28Å; Y33-Q50 HydrophobicContact CD2-CB 4.47Å; Y33-Q50 HydrophobicContact CE2-CB 3.82Å; Y33-Q50 HydrophobicContact CE2-CG 4.03Å; Y33-Q50 PolarHBondContact OH-OE1 3.31Å; Y33-L53 HydrophobicContact CD2-CD1 3.49Å; Y33-L53 VanDerWaalsContact CD2-CD1 3.49Å; Y33-L53 HydrophobicContact CE2-CD1 4.3Å; Y33-L53 HydrophobicContact CG-CD1 3.7Å; Y33-L59 HydrophobicContact CD1-CD1 3.84Å; Y33-L59 HydrophobicContact CD2-CD1 4.1Å; Y33-L59 HydrophobicContact CE1-CD1 3.3Å; Y33-L59 HydrophobicContact CE2-CD1 3.63Å; Y33-L59 HydrophobicContact CG-CD1 4.2Å; Y33-L59 WeakPolarHBondContact OH-CD1 3.48Å; Y33-F62 HydrophobicContact CD1-CD1 4.11Å; Y33-F62 HydrophobicContact CD1-CE1 4.25Å; Y33-F62 AromaticContact CE1-CD1 3.96Å; Y33-F62 HydrophobicContact CE1-CD1 3.96Å; Y33-F62 HydrophobicContact CE1-CE1 4.21Å; Y33-L63 HydrophobicContact CE1-CD2 4.32Å
34	L	91.7	Very high	86.7	Confident	30 Å²	30	71.6 Å²	71.6	16%	0.157	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	106.8	175.5	-176	62.2	0	0	0	109.5	L22 D23 N45 W47	L22-L34 HydrophobicContact CB-CB 4.4Å; L22-L34 HydrophobicContact CB-CD2 4.03Å; L22-L34 HydrophobicContact CB-CG 4.24Å; L22-L34 HydrophobicContact CD1-CD2 4.3Å; L22-L34 PolarHBondContact N-O 3.14Å; D23-L34 HydrophobicContact CB-CB 3.85Å; D23-L34 HydrophobicContact CB-CD2 4.19Å; D23-L34 PolarHBondContact O-N 2.85Å; L34-N45 HydrophobicContact CD1-CB 3.68Å; L34-N45 HydrophobicContact CG-CB 4.15Å; L34-W47 HydrophobicContact CB-CD2 4.11Å; L34-W47 HydrophobicContact CB-CE3 4.01Å; L34-W47 HydrophobicContact CB-CH2 3.96Å; L34-W47 HydrophobicContact CB-CZ2 4.04Å; L34-W47 HydrophobicContact CB-CZ3 3.92Å; L34-W47 HydrophobicContact CD1-CD2 4.22Å; L34-W47 HydrophobicContact CD1-CG 4.32Å; L34-W47 HydrophobicContact CD1-CZ2 4.45Å; L34-W47 HydrophobicContact CD2-CZ2 4.31Å
35	I	90.2	Very high	86.8	Confident	0 Å²	0	71 Å²	71	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	123.6	-174.7	-58.5	-48.8	0	0	0	110.5	V18 I21 Y33 W37 N45 T46 E48 L53	V18-I35 HydrophobicContact CB-CG2 4.15Å; V18-I35 HydrophobicContact CG1-CD1 4.46Å; V18-I35 HydrophobicContact CG1-CG2 3.77Å; V18-I35 HydrophobicContact CG2-CG2 3.61Å; I21-I35 HydrophobicContact CG1-CD1 3.98Å; Y33-I35 PolarHBondContact O-N 2.9Å; I35-W37 HydrophobicContact CB-CZ2 4.26Å; I35-W37 HydrophobicContact CG2-CD2 3.72Å; I35-W37 HydrophobicContact CG2-CE3 3.7Å; I35-W37 HydrophobicContact CG2-CG 4.43Å; I35-W37 HydrophobicContact CG2-CH2 3.91Å; I35-W37 HydrophobicContact CG2-CZ2 3.9Å; I35-W37 HydrophobicContact CG2-CZ3 3.77Å; I35-N45 WeakPolarHBondContact O-CA 3.45Å; I35-N45 VanDerWaalsContact O-CB 3.25Å; I35-N45 WeakPolarHBondContact O-CB 3.37Å; I35-N45 PolarHBondContact O-OD1 2.99Å; I35-T46 PolarHBondContact N-O 2.81Å; I35-T46 PolarHBondContact O-N 2.86Å; I35-E48 HydrophobicContact CB-CG 4.25Å; I35-E48 HydrophobicContact CG1-CB 3.76Å; I35-E48 HydrophobicContact CG1-CG 3.69Å; I35-L53 HydrophobicContact CD1-CD1 3.92Å; I35-L53 HydrophobicContact CD1-CD2 3.36Å; I35-L53 HydrophobicContact CD1-CG 4.27Å; I35-L53 HydrophobicContact CG1-CD2 3.54Å
36	K	89.9	Confident	86.9	Confident	57 Å²	57	69.2 Å²	69.2	25%	0.248	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	112.4	166.5	-168.5	-178.4	-173.3	-163.8	0	108.7	E19 D20 L22 N45	E19-K36 WeakPolarHBondContact CA-O 3.44Å; E19-K36 HydrophobicContact CB-CB 4.37Å; E19-K36 HydrophobicContact CB-CD 4.39Å; E19-K36 HydrophobicContact CB-CG 4.24Å; E19-K36 VanDerWaalsContact CB-O 3.27Å; E19-K36 WeakPolarHBondContact CB-O 2.98Å; E19-K36 HydrophobicContact CG-CD 4.42Å; E19-K36 PolarHBondContact N-O 3.2Å; E19-K36 VanDerWaalsContact OE1-CD 3.24Å; E19-K36 WeakPolarHBondContact OE1-CD 3.35Å; E19-K36 WeakPolarHBondContact OE1-CE 3.14Å; E19-K36 IonicContact OE1-NZ 2.62Å; E19-K36 PolarHBondContact OE1-NZ 3.06Å; D20-K36 PolarHBondContact N-O 2.69Å; D20-K36 VanDerWaalsContact O-CB 3.31Å; D20-K36 WeakPolarHBondContact O-CB 3.27Å; D20-K36 PolarHBondContact O-N 3.33Å; L22-K36 HydrophobicContact CD1-CB 4.14Å; L22-K36 HydrophobicContact CD2-CD 4.32Å; L22-K36 HydrophobicContact CG-CB 4.09Å; K36-N45 WeakPolarHBondContact CA-OD1 3.41Å
37	W	90	Very high	87.2	Confident	33 Å²	33	69.4 Å²	69.4	13%	0.125	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	132.5	178.8	-56.7	107.6	0	0	0	110.9	F16 V18 I35 G39 H40 K44 T46 E48	F16-W37 HydrophobicContact CB-CD2 4Å; F16-W37 HydrophobicContact CB-CE3 3.24Å; F16-W37 HydrophobicContact CB-CH2 4.13Å; F16-W37 HydrophobicContact CB-CZ3 3.34Å; F16-W37 HydrophobicContact CG-CE3 4.3Å; F16-W37 HydrophobicContact CG-CZ3 4.4Å; F16-W37 WeakPolarHBondContact O-CZ3 3.36Å; V18-W37 HydrophobicContact CG2-CE3 4.38Å; V18-W37 HydrophobicContact CG2-CZ3 3.99Å; I35-W37 HydrophobicContact CB-CZ2 4.26Å; I35-W37 HydrophobicContact CG2-CD2 3.72Å; I35-W37 HydrophobicContact CG2-CE3 3.7Å; I35-W37 HydrophobicContact CG2-CG 4.43Å; I35-W37 HydrophobicContact CG2-CH2 3.91Å; I35-W37 HydrophobicContact CG2-CZ2 3.9Å; I35-W37 HydrophobicContact CG2-CZ3 3.77Å; W37-G39 PolarHBondContact O-N 3.29Å; W37-H40 HydrophobicContact CB-CB 3.97Å; W37-H40 PolarHBondContact O-N 2.95Å; W37-H40 VanDerWaalsContact O-N 3.12Å; W37-K44 VanDerWaalsContact CD1-O 3.32Å; W37-T46 WeakPolarHBondContact CZ2-OG1 3.35Å; W37-T46 PolarHBondContact NE1-OG1 2.81Å; W37-E48 HydrophobicContact CH2-CG 4.32Å; W37-E48 HydrophobicContact CZ2-CG 3.93Å
38	K	86.5	Confident	87.4	Confident	106 Å²	106	68 Å²	68	46%	0.461	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	129.1	-177.8	-173.6	178.2	167.6	-155.6	0	110.8	E17 E19 H40	E17-K38 HydrophobicContact CB-CB 4.01Å; E17-K38 HydrophobicContact CB-CD 4.06Å; E17-K38 VanDerWaalsContact CD-NZ 3.27Å; E17-K38 WeakPolarHBondContact O-CB 3.45Å; E17-K38 PolarHBondContact O-N 2.87Å; E17-K38 IonicContact OE1-NZ 2.83Å; E17-K38 PolarHBondContact OE1-NZ 3.49Å; E17-K38 IonicContact OE2-NZ 2.79Å; E17-K38 PolarHBondContact OE2-NZ 3Å; E19-K38 HydrophobicContact CB-CB 4.01Å; K38-H40 PolarHBondContact O-CD2 2.89Å; K38-H40 PolarHBondContact O-N 3.38Å
39	G	85.9	Confident	87.7	Confident	75 Å²	75	62.4 Å²	62.4	77%	0.773	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	2.7	-177.2	0	0	0	0	0	114.7	W37	W37-G39 PolarHBondContact O-N 3.29Å
40	H	84.1	Confident	87.8	Confident	89 Å²	89	63.5 Å²	63.5	41%	0.412	35%	0.348	S	S	.	.	S	Bend	trans	-107.4	152.1	172.4	-65.3	-89	0	0	0	111.4	W37 K38 K44	W37-H40 HydrophobicContact CB-CB 3.97Å; W37-H40 PolarHBondContact O-N 2.95Å; W37-H40 VanDerWaalsContact O-N 3.12Å; K38-H40 PolarHBondContact O-CD2 2.89Å; K38-H40 PolarHBondContact O-N 3.38Å; H40-K44 HydrophobicContact CB-CB 4.08Å; H40-K44 HydrophobicContact CB-CG 4.43Å
41	S	85.9	Confident	87.9	Confident	76 Å²	76	62.8 Å²	62.8	53%	0.531	36%	0.357	S	S	.	.			trans	-66.7	151.8	174.7	-54.4	0	0	0	0	111	S43 K44	S41-S43 PolarHBondContact O-N 3.15Å; S41-K44 WeakPolarHBondContact O-CB 3.49Å; S41-K44 PolarHBondContact O-N 3.42Å
42	P	84.7	Confident	87.8	Confident	85 Å²	85	64.7 Å²	64.7	55%	0.552	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-59.7	-18.5	177.2	25	-35.2	0	0	0	113.5	K44 N45	P42-K44 PolarHBondContact O-N 3.11Å; P42-N45 WeakPolarHBondContact CA-ND2 3.26Å; P42-N45 WeakPolarHBondContact CA-OD1 3.25Å; P42-N45 WeakPolarHBondContact O-CB 3.37Å; P42-N45 PolarHBondContact O-N 3.08Å; P42-N45 PolarHBondContact O-ND2 3.3Å; P42-N45 PolarHBondContact O-OD1 3.14Å
43	S	88.9	Confident	87.4	Confident	115 Å²	115	63.5 Å²	63.5	80%	0.804	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-66.9	-13.8	171.5	-45.6	0	0	0	0	113.9	S41	S41-S43 PolarHBondContact O-N 3.15Å
44	K	86.2	Confident	87	Confident	137 Å²	137	69.4 Å²	69.4	60%	0.596	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-98.3	2.6	175.5	-64.4	-62.8	-173.4	178.9	0	112.7	W37 H40 S41 P42 T46	W37-K44 VanDerWaalsContact CD1-O 3.32Å; H40-K44 HydrophobicContact CB-CB 4.08Å; H40-K44 HydrophobicContact CB-CG 4.43Å; S41-K44 WeakPolarHBondContact O-CB 3.49Å; S41-K44 PolarHBondContact O-N 3.42Å; P42-K44 PolarHBondContact O-N 3.11Å; K44-T46 PolarHBondContact O-N 3.35Å
45	N	89	Confident	86.4	Confident	28 Å²	28	69.8 Å²	69.8	15%	0.15	40%	0.396	C	S	.	.			trans	-63.6	134	178.4	-60.6	-10.5	0	0	0	109.7	L22 L34 I35 K36 P42	L22-N45 WeakPolarHBondContact CD1-ND2 3.4Å; L34-N45 HydrophobicContact CD1-CB 3.68Å; L34-N45 HydrophobicContact CG-CB 4.15Å; I35-N45 WeakPolarHBondContact O-CA 3.45Å; I35-N45 VanDerWaalsContact O-CB 3.25Å; I35-N45 WeakPolarHBondContact O-CB 3.37Å; I35-N45 PolarHBondContact O-OD1 2.99Å; K36-N45 WeakPolarHBondContact CA-OD1 3.41Å; P42-N45 WeakPolarHBondContact CA-ND2 3.26Å; P42-N45 WeakPolarHBondContact CA-OD1 3.25Å; P42-N45 WeakPolarHBondContact O-CB 3.37Å; P42-N45 PolarHBondContact O-N 3.08Å; P42-N45 PolarHBondContact O-ND2 3.3Å; P42-N45 PolarHBondContact O-OD1 3.14Å
46	T	90.1	Very high	86.1	Confident	54 Å²	54	74.3 Å²	74.3	33%	0.331	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	153.3	179.9	55.2	0	0	0	0	109.9	I35 W37 K44 E48	I35-T46 PolarHBondContact N-O 2.81Å; I35-T46 PolarHBondContact O-N 2.86Å; W37-T46 WeakPolarHBondContact CZ2-OG1 3.35Å; W37-T46 PolarHBondContact NE1-OG1 2.81Å; K44-T46 PolarHBondContact O-N 3.35Å; T46-E48 VanDerWaalsContact CB-OE1 3.26Å; T46-E48 WeakPolarHBondContact CB-OE1 3.39Å; T46-E48 PolarHBondContact OG1-OE1 3.33Å
47	W	91.5	Very high	85.9	Confident	78 Å²	78	76.1 Å²	76.1	30%	0.295	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	115.7	172.1	-70.5	91.6	0	0	0	107.9	D23 R25 E32 Y33 L34	D23-W47 HydrophobicContact CB-CH2 3.76Å; D23-W47 HydrophobicContact CB-CZ3 4.32Å; R25-W47 HydrophobicContact CB-CH2 4.24Å; R25-W47 HydrophobicContact CB-CZ3 3.95Å; R25-W47 HydrophobicContact CG-CD2 4.43Å; R25-W47 HydrophobicContact CG-CE3 3.68Å; R25-W47 HydrophobicContact CG-CH2 4.01Å; R25-W47 HydrophobicContact CG-CZ3 3.44Å; R25-W47 VanDerWaalsContact CG-CZ3 3.44Å; E32-W47 HydrophobicContact CB-CE3 4.17Å; Y33-W47 CarbonylContact O-C 3.54Å; Y33-W47 WeakPolarHBondContact O-CA 3.29Å; L34-W47 HydrophobicContact CB-CD2 4.11Å; L34-W47 HydrophobicContact CB-CE3 4.01Å; L34-W47 HydrophobicContact CB-CH2 3.96Å; L34-W47 HydrophobicContact CB-CZ2 4.04Å; L34-W47 HydrophobicContact CB-CZ3 3.92Å; L34-W47 HydrophobicContact CD1-CD2 4.22Å; L34-W47 HydrophobicContact CD1-CG 4.32Å; L34-W47 HydrophobicContact CD1-CZ2 4.45Å; L34-W47 HydrophobicContact CD2-CZ2 4.31Å
48	E	89.6	Confident	85.7	Confident	35 Å²	35	76.4 Å²	76.4	16%	0.164	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	134.2	-178	-61	-58.5	137.1	0	0	109.6	E32 Y33 I35 W37 T46 N52 L53	E32-E48 CarbonylContact C-O 3.6Å; E32-E48 WeakPolarHBondContact CA-O 3.31Å; Y33-E48 PolarHBondContact N-O 3.47Å; Y33-E48 PolarHBondContact O-N 3.28Å; I35-E48 HydrophobicContact CB-CG 4.25Å; I35-E48 HydrophobicContact CG1-CB 3.76Å; I35-E48 HydrophobicContact CG1-CG 3.69Å; W37-E48 HydrophobicContact CH2-CG 4.32Å; W37-E48 HydrophobicContact CZ2-CG 3.93Å; T46-E48 VanDerWaalsContact CB-OE1 3.26Å; T46-E48 WeakPolarHBondContact CB-OE1 3.39Å; T46-E48 PolarHBondContact OG1-OE1 3.33Å; E48-N52 PolarHBondContact OE2-ND2 2.95Å; E48-L53 HydrophobicContact CB-CD2 3.8Å
49	P	87.4	Confident	85.7	Confident	43 Å²	43	72.3 Å²	72.3	28%	0.279	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	154	177	28.8	-34	0	0	0	110.2	S51 N52	P49-S51 PolarHBondContact O-N 2.71Å; P49-N52 HydrophobicContact CG-CB 3.94Å; P49-N52 PolarHBondContact O-N 3.02Å
50	Q	84.3	Confident	85.7	Confident	86 Å²	86	78 Å²	78	40%	0.402	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-49.7	-36.9	177.6	-164.4	174.1	-79.5	0	0	113.3	P31 Y33 N52 L53 L59	P31-Q50 HydrophobicContact CG-CB 4.16Å; P31-Q50 PolarHBondContact O-N 2.86Å; Y33-Q50 HydrophobicContact CD2-CB 4.47Å; Y33-Q50 HydrophobicContact CE2-CB 3.82Å; Y33-Q50 HydrophobicContact CE2-CG 4.03Å; Y33-Q50 PolarHBondContact OH-OE1 3.31Å; Q50-N52 PolarHBondContact O-N 3.39Å; Q50-L53 PolarHBondContact O-N 2.83Å; Q50-L53 VanDerWaalsContact O-N 3.11Å; Q50-L59 HydrophobicContact CG-CD2 3.7Å
51	S	84.4	Confident	85.9	Confident	107 Å²	107	81.7 Å²	81.7	75%	0.748	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-64.1	-25.3	179.7	-53.8	0	0	0	0	113.5	P49	P49-S51 PolarHBondContact O-N 2.71Å
52	N	82.6	Confident	85.9	Confident	79 Å²	79	78.8 Å²	78.8	42%	0.422	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-89.6	-6.9	177.1	-155.2	40.2	0	0	0	112.7	E48 P49 Q50 N54	E48-N52 PolarHBondContact OE2-ND2 2.95Å; P49-N52 HydrophobicContact CG-CB 3.94Å; P49-N52 PolarHBondContact O-N 3.02Å; Q50-N52 PolarHBondContact O-N 3.39Å; N52-N54 PolarHBondContact O-N 2.81Å
53	L	82.7	Confident	86	Confident	18 Å²	18	77.5 Å²	77.5	9%	0.094	40%	0.403	C	S	.	.			trans	-92.3	97.8	-179.7	-57	-175.9	0	0	0	111.6	I21 Y33 I35 E48 Q50 C55 L59	I21-L53 HydrophobicContact CD1-CD1 4.46Å; Y33-L53 HydrophobicContact CD2-CD1 3.49Å; Y33-L53 VanDerWaalsContact CD2-CD1 3.49Å; Y33-L53 HydrophobicContact CE2-CD1 4.3Å; Y33-L53 HydrophobicContact CG-CD1 3.7Å; I35-L53 HydrophobicContact CD1-CD1 3.92Å; I35-L53 HydrophobicContact CD1-CD2 3.36Å; I35-L53 HydrophobicContact CD1-CG 4.27Å; I35-L53 HydrophobicContact CG1-CD2 3.54Å; E48-L53 HydrophobicContact CB-CD2 3.8Å; Q50-L53 PolarHBondContact O-N 2.83Å; Q50-L53 VanDerWaalsContact O-N 3.11Å; L53-C55 PolarHBondContact O-N 3.49Å; L53-L59 HydrophobicContact CD1-CD1 4.2Å
54	N	80.5	Confident	85.9	Confident	126 Å²	126	78 Å²	78	67%	0.674	40%	0.396	S	S	*	.			trans	-77.8	32.4	171.3	-67	-45.3	0	0	0	113.1	N52	N52-N54 PolarHBondContact O-N 2.81Å
55	C	80.2	Confident	85.7	Confident	39 Å²	39	78.5 Å²	78.5	26%	0.264	40%	0.398	S	S	.	.			trans	-129.3	67.6	-173	-72.5	0	0	0	0	112.2	L53 V57 L58 L59	L53-C55 PolarHBondContact O-N 3.49Å; C55-V57 PolarHBondContact O-N 3.18Å; C55-V57 VanDerWaalsContact O-N 3.14Å; C55-L58 HydrophobicContact CB-CB 4.4Å; C55-L58 HydrophobicContact CB-CD1 4.4Å; C55-L58 PolarHBondContact O-N 3.28Å; C55-L59 WeakPolarHBondContact O-CB 3.18Å; C55-L59 PolarHBondContact O-N 2.95Å; C55-L59 VanDerWaalsContact O-N 3.08Å
56	P	83.8	Confident	85.1	Confident	94 Å²	94	80.2 Å²	80.2	61%	0.61	41%	0.405	S	S	*	.	H	α-helix	trans	-62.1	-27.1	-175.4	25	-35	0	0	0	113.3	R60	P56-R60 WeakPolarHBondContact O-CB 3.24Å; P56-R60 PolarHBondContact O-N 3.42Å
57	V	86	Confident	84.2	Confident	96 Å²	96	80.9 Å²	80.9	58%	0.582	42%	0.416	S	S	*	.	H	α-helix	trans	-70	-47.7	-180	-179.4	0	0	0	0	111.6	C55 R61	C55-V57 PolarHBondContact O-N 3.18Å; C55-V57 VanDerWaalsContact O-N 3.14Å; V57-R61 WeakPolarHBondContact O-CG 3.45Å; V57-R61 PolarHBondContact O-N 3.25Å; V57-R61 VanDerWaalsContact O-N 3.11Å
58	L	86	Confident	82.9	Confident	39 Å²	39	81.4 Å²	81.4	20%	0.204	44%	0.437	C	S	.	.	H	α-helix	trans	-67.3	-45.3	177.9	-68	179.4	0	0	0	110.4	V18 I21 C55 R60 R61 F62	V18-L58 HydrophobicContact CB-CD1 4.01Å; V18-L58 HydrophobicContact CG1-CD1 3.66Å; I21-L58 HydrophobicContact CD1-CB 4.11Å; I21-L58 HydrophobicContact CG1-CB 4.36Å; C55-L58 HydrophobicContact CB-CB 4.4Å; C55-L58 HydrophobicContact CB-CD1 4.4Å; C55-L58 PolarHBondContact O-N 3.28Å; L58-R60 VanDerWaalsContact C-N 3.32Å; L58-R60 PolarHBondContact O-N 3.4Å; L58-R61 PolarHBondContact O-N 3.11Å; L58-R61 VanDerWaalsContact O-N 3.15Å; L58-F62 WeakPolarHBondContact O-CB 3.23Å; L58-F62 PolarHBondContact O-N 3.32Å
59	L	85.6	Confident	81.4	Confident	19 Å²	19	86 Å²	86	10%	0.099	46%	0.461	C	S	.	.	H	α-helix	trans	-54.4	-49.5	175.7	-174.3	65.1	0	0	0	111.4	I21 Y33 Q50 L53 C55 R61 F62 L63	I21-L59 HydrophobicContact CD1-CB 4.24Å; I21-L59 HydrophobicContact CD1-CD1 4.16Å; Y33-L59 HydrophobicContact CD1-CD1 3.84Å; Y33-L59 HydrophobicContact CD2-CD1 4.1Å; Y33-L59 HydrophobicContact CE1-CD1 3.3Å; Y33-L59 HydrophobicContact CE2-CD1 3.63Å; Y33-L59 HydrophobicContact CG-CD1 4.2Å; Y33-L59 WeakPolarHBondContact OH-CD1 3.48Å; Q50-L59 HydrophobicContact CG-CD2 3.7Å; L53-L59 HydrophobicContact CD1-CD1 4.2Å; C55-L59 WeakPolarHBondContact O-CB 3.18Å; C55-L59 PolarHBondContact O-N 2.95Å; C55-L59 VanDerWaalsContact O-N 3.08Å; L59-R61 PolarHBondContact O-N 2.92Å; L59-F62 PolarHBondContact O-N 2.79Å; L59-L63 HydrophobicContact CD1-CD1 4.29Å; L59-L63 HydrophobicContact CD1-CG 4.38Å; L59-L63 HydrophobicContact CG-CD1 3.93Å; L59-L63 HydrophobicContact CG-CG 4.39Å; L59-L63 WeakPolarHBondContact O-CB 3.45Å; L59-L63 VanDerWaalsContact O-CG 3.29Å; L59-L63 WeakPolarHBondContact O-CG 3.5Å; L59-L63 PolarHBondContact O-N 2.77Å
60	R	86	Confident	79.8	Confident	196 Å²	196	89.1 Å²	89.1	74%	0.74	47%	0.473	S	S	*	.	H	α-helix	trans	-61.8	-41.5	178.5	-176	174.6	-178.7	179.9	1.7	112.5	P56 L58 F62 L63 D64	P56-R60 WeakPolarHBondContact O-CB 3.24Å; P56-R60 PolarHBondContact O-N 3.42Å; L58-R60 VanDerWaalsContact C-N 3.32Å; L58-R60 PolarHBondContact O-N 3.4Å; R60-F62 VanDerWaalsContact C-N 3.33Å; R60-L63 PolarHBondContact O-N 3.47Å; R60-D64 VanDerWaalsContact O-CB 3.24Å; R60-D64 WeakPolarHBondContact O-CB 3.29Å; R60-D64 PolarHBondContact O-N 3.07Å
61	R	87.5	Confident	78.3	Confident	166 Å²	166	90.8 Å²	90.8	63%	0.626	49%	0.491	S	S	*	.	H	α-helix	trans	-65.3	-39.2	177.4	-75.4	179.3	177.3	-170.7	0.4	112.1	V57 L58 L59 K65	V57-R61 WeakPolarHBondContact O-CG 3.45Å; V57-R61 PolarHBondContact O-N 3.25Å; V57-R61 VanDerWaalsContact O-N 3.11Å; L58-R61 PolarHBondContact O-N 3.11Å; L58-R61 VanDerWaalsContact O-N 3.15Å; L59-R61 PolarHBondContact O-N 2.92Å; R61-K65 WeakPolarHBondContact O-CG 2.96Å; R61-K65 PolarHBondContact O-N 2.78Å
62	F	87.3	Confident	76.6	Confident	14 Å²	14	91.1 Å²	91.1	6%	0.061	49%	0.488	C	S	.	.	H	α-helix	trans	-66.3	-50.4	176	-178.7	-84.2	0	0	0	110.5	I21 D23 M24 Y33 L58 L59 R60 D64 K65 H66	I21-F62 HydrophobicContact CB-CB 4.13Å; I21-F62 HydrophobicContact CB-CD2 3.77Å; I21-F62 HydrophobicContact CB-CE2 4.48Å; I21-F62 HydrophobicContact CB-CG 4.01Å; I21-F62 HydrophobicContact CD1-CB 4.18Å; I21-F62 HydrophobicContact CG2-CB 4.21Å; I21-F62 HydrophobicContact CG2-CD1 4.12Å; I21-F62 HydrophobicContact CG2-CD2 3.42Å; I21-F62 VanDerWaalsContact CG2-CD2 3.42Å; I21-F62 HydrophobicContact CG2-CE1 4.45Å; I21-F62 HydrophobicContact CG2-CE2 3.75Å; I21-F62 HydrophobicContact CG2-CG 3.61Å; I21-F62 HydrophobicContact CG2-CZ 4.26Å; I21-F62 WeakPolarHBondContact O-CD2 3.4Å; D23-F62 VanDerWaalsContact C-CZ 3.46Å; M24-F62 HydrophobicContact CB-CD1 4.25Å; M24-F62 HydrophobicContact CB-CE1 3.23Å; M24-F62 HydrophobicContact CB-CZ 3.59Å; M24-F62 HydrophobicContact CG-CE1 4.22Å; M24-F62 HydrophobicContact SD-CE1 4.16Å; Y33-F62 HydrophobicContact CD1-CD1 4.11Å; Y33-F62 HydrophobicContact CD1-CE1 4.25Å; Y33-F62 AromaticContact CE1-CD1 3.96Å; Y33-F62 HydrophobicContact CE1-CD1 3.96Å; Y33-F62 HydrophobicContact CE1-CE1 4.21Å; L58-F62 WeakPolarHBondContact O-CB 3.23Å; L58-F62 PolarHBondContact O-N 3.32Å; L59-F62 PolarHBondContact O-N 2.79Å; R60-F62 VanDerWaalsContact C-N 3.33Å; F62-D64 VanDerWaalsContact C-N 3.33Å; F62-D64 PolarHBondContact O-N 2.93Å; F62-K65 PolarHBondContact O-N 2.85Å; F62-H66 AromaticContact CD1-CD2 3.92Å; F62-H66 AromaticContact CD2-CD2 3.88Å; F62-H66 AromaticContact CD2-NE2 3.99Å; F62-H66 HydrophobicContact CE1-CB 4.17Å; F62-H66 AromaticContact CE1-CD2 3.45Å; F62-H66 VanDerWaalsContact CE1-CD2 3.45Å; F62-H66 WeakPolarHBondContact CE1-CD2 3.46Å; F62-H66 AromaticContact CE1-CG 3.67Å; F62-H66 AromaticContact CE1-NE2 3.91Å; F62-H66 AromaticContact CE2-CD2 3.48Å; F62-H66 VanDerWaalsContact CE2-CD2 3.48Å; F62-H66 WeakPolarHBondContact CE2-CD2 3.28Å; F62-H66 AromaticContact CE2-NE2 3.23Å; F62-H66 WeakPolarHBondContact CE2-NE2 3.24Å; F62-H66 AromaticContact CZ-CD2 3.24Å; F62-H66 WeakPolarHBondContact CZ-CD2 3.15Å; F62-H66 AromaticContact CZ-CE1 3.57Å; F62-H66 AromaticContact CZ-CG 3.71Å; F62-H66 AromaticContact CZ-ND1 3.89Å; F62-H66 AromaticContact CZ-NE2 3.18Å; F62-H66 WeakPolarHBondContact CZ-NE2 3.4Å; F62-H66 PolarHBondContact O-CD2 2.69Å; F62-H66 PolarHBondContact O-N 3.27Å
63	L	85.5	Confident	75.2	Confident	59 Å²	59	92.4 Å²	92.4	31%	0.309	50%	0.499	S	S	.	.	H	α-helix	trans	-59.7	-40.6	176.6	-72.8	176	0	0	0	112.1	M24 Y33 L59 R60 K65 H66 A67	M24-L63 HydrophobicContact SD-CD2 3.77Å; Y33-L63 HydrophobicContact CE1-CD2 4.32Å; L59-L63 HydrophobicContact CD1-CD1 4.29Å; L59-L63 HydrophobicContact CD1-CG 4.38Å; L59-L63 HydrophobicContact CG-CD1 3.93Å; L59-L63 HydrophobicContact CG-CG 4.39Å; L59-L63 WeakPolarHBondContact O-CB 3.45Å; L59-L63 VanDerWaalsContact O-CG 3.29Å; L59-L63 WeakPolarHBondContact O-CG 3.5Å; L59-L63 PolarHBondContact O-N 2.77Å; R60-L63 PolarHBondContact O-N 3.47Å; L63-K65 VanDerWaalsContact C-N 3.31Å; L63-K65 PolarHBondContact O-N 3.31Å; L63-H66 PolarHBondContact O-N 3.02Å; L63-A67 WeakPolarHBondContact O-CA 3.34Å; L63-A67 WeakPolarHBondContact O-CB 3.36Å; L63-A67 PolarHBondContact O-N 2.92Å
64	D	86.7	Confident	73.6	Confident	125 Å²	125	96.1 Å²	96.1	67%	0.668	53%	0.532	S	S	*	.	H	α-helix	trans	-60.8	-41.3	177.2	-172	-104	0	0	0	111.9	R60 F62	R60-D64 VanDerWaalsContact O-CB 3.24Å; R60-D64 WeakPolarHBondContact O-CB 3.29Å; R60-D64 PolarHBondContact O-N 3.07Å; F62-D64 VanDerWaalsContact C-N 3.33Å; F62-D64 PolarHBondContact O-N 2.93Å
65	K	83.5	Confident	72.1	Confident	148 Å²	148	96.8 Å²	96.8	64%	0.643	54%	0.541	S	S	*	.	H	α-helix	trans	-67.8	-40.6	175.6	-71.4	175.9	178.5	-179.1	0	112.9	R61 F62 L63	R61-K65 WeakPolarHBondContact O-CG 2.96Å; R61-K65 PolarHBondContact O-N 2.78Å; F62-K65 PolarHBondContact O-N 2.85Å; L63-K65 VanDerWaalsContact C-N 3.31Å; L63-K65 PolarHBondContact O-N 3.31Å
66	H	76.6	Confident	70.8	Confident	63 Å²	63	102.7 Å²	102.7	29%	0.292	57%	0.568	S	S	.	*	H	α-helix	trans	-87.4	-29.9	-175.7	-79.3	-98.4	0	0	0	113.7	F62 L63 A68 I69 E70	F62-H66 AromaticContact CD1-CD2 3.92Å; F62-H66 AromaticContact CD2-CD2 3.88Å; F62-H66 AromaticContact CD2-NE2 3.99Å; F62-H66 HydrophobicContact CE1-CB 4.17Å; F62-H66 AromaticContact CE1-CD2 3.45Å; F62-H66 VanDerWaalsContact CE1-CD2 3.45Å; F62-H66 WeakPolarHBondContact CE1-CD2 3.46Å; F62-H66 AromaticContact CE1-CG 3.67Å; F62-H66 AromaticContact CE1-NE2 3.91Å; F62-H66 AromaticContact CE2-CD2 3.48Å; F62-H66 VanDerWaalsContact CE2-CD2 3.48Å; F62-H66 WeakPolarHBondContact CE2-CD2 3.28Å; F62-H66 AromaticContact CE2-NE2 3.23Å; F62-H66 WeakPolarHBondContact CE2-NE2 3.24Å; F62-H66 AromaticContact CZ-CD2 3.24Å; F62-H66 WeakPolarHBondContact CZ-CD2 3.15Å; F62-H66 AromaticContact CZ-CE1 3.57Å; F62-H66 AromaticContact CZ-CG 3.71Å; F62-H66 AromaticContact CZ-ND1 3.89Å; F62-H66 AromaticContact CZ-NE2 3.18Å; F62-H66 WeakPolarHBondContact CZ-NE2 3.4Å; F62-H66 PolarHBondContact O-CD2 2.69Å; F62-H66 PolarHBondContact O-N 3.27Å; L63-H66 PolarHBondContact O-N 3.02Å; H66-A68 PolarHBondContact O-N 3.48Å; H66-I69 WeakPolarHBondContact O-CA 3.4Å; H66-I69 PolarHBondContact O-N 3.15Å; H66-E70 PolarHBondContact O-N 2.9Å
67	A	70.5	Confident	69.1	Low	68 Å²	68	102.9 Å²	102.9	56%	0.562	58%	0.577	S	S	*	*	H	α-helix	trans	-67.3	-23.8	177.9	0	0	0	0	0	112.3	L63 I69	L63-A67 WeakPolarHBondContact O-CA 3.34Å; L63-A67 WeakPolarHBondContact O-CB 3.36Å; L63-A67 PolarHBondContact O-N 2.92Å; A67-I69 PolarHBondContact O-N 3.08Å
68	A	63.8	Low	67.5	Low	89 Å²	89	107.4 Å²	107.4	74%	0.736	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	-14.5	170	0	0	0	0	0	113.1	H66	H66-A68 PolarHBondContact O-N 3.48Å
69	I	59.5	Low	65.9	Low	131 Å²	131	112.2 Å²	112.2	67%	0.672	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118	-19.3	-172.5	-53.4	179.2	0	0	0	111.9	H66 A67 P71	H66-I69 WeakPolarHBondContact O-CA 3.4Å; H66-I69 PolarHBondContact O-N 3.15Å; A67-I69 PolarHBondContact O-N 3.08Å; I69-P71 WeakPolarHBondContact O-CD 3.42Å
70	E	53.4	Low	64.5	Low	110 Å²	110	123 Å²	123	51%	0.514	66%	0.658	S	S	.	*			trans	-116.1	92.9	-176.4	-73.2	-97.9	113.1	0	0	113.4	H66	H66-E70 PolarHBondContact O-N 2.9Å
71	P	51.4	Low	63.1	Low	121 Å²	121	118 Å²	118	79%	0.786	65%	0.649	S	S	*	*			trans	-99.1	13.6	163.1	35	-31.4	0	0	0	114.4	I69	I69-P71 WeakPolarHBondContact O-CD 3.42Å
72	T	50.4	Low	61.6	Low	113 Å²	113	118.1 Å²	118.1	69%	0.693	66%	0.662	S	S	*	*			trans	-123.6	9	-151.5	-12.8	0	0	0	0	119.2
73	V	52.6	Low	59.9	Low	107 Å²	107	124.3 Å²	124.3	65%	0.648	70%	0.695	S	S	*	*	S	Bend	trans	-132.6	91	177.5	174.7	0	0	0	0	111.8
74	A	49.3	Very low	59	Low	95 Å²	95	128.8 Å²	128.8	79%	0.785	72%	0.718	S	S	*	*			trans	-178.4	14.8	147.8	0	0	0	0	0	114.3	I76	A74-I76 PolarHBondContact O-N 3.26Å
75	T	49.1	Very low	57.4	Low	141 Å²	141	129.7 Å²	129.7	87%	0.865	73%	0.728	S	S	*	*			trans	-76.6	6	172.7	-55.3	0	0	0	0	113.5
76	I	52.5	Low	56.8	Low	163 Å²	163	132.1 Å²	132.1	84%	0.836	75%	0.754	S	S	*	*			trans	-108.7	70.8	-171.3	-40.9	176.5	0	0	0	111.4	A74	A74-I76 PolarHBondContact O-N 3.26Å
77	A	48.7	Very low	55.8	Low	97 Å²	97	135.6 Å²	135.6	80%	0.802	78%	0.777	S	S	*	*			trans	-174	46.5	154.6	0	0	0	0	0	113.2
78	Q	52	Low	55.1	Low	192 Å²	192	139.2 Å²	139.2	90%	0.897	79%	0.789	S	S	*	*			trans	-113.7	57.2	165.4	-75	-167.1	-25	0	0	110.4
79	N	52.2	Low	54.6	Low	140 Å²	140	141.9 Å²	141.9	75%	0.749	79%	0.792	S	S	*	*			trans	-163.2	63	168.5	-149.1	83.4	0	0	0	114.4
80	R	55.3	Low	54.3	Low	245 Å²	245	142.6 Å²	142.6	93%	0.925	80%	0.799	S	S	*	*			trans	-112.8	96.4	156.3	-147.1	178.9	176.3	165.7	-0.8	109.1	D82	R80-D82 PolarHBondContact O-N 3.24Å
81	T	57.7	Low	54.4	Low	92 Å²	92	144.6 Å²	144.6	56%	0.564	82%	0.817	S	S	*	*			trans	-55.5	107.8	179.4	-48.7	0	0	0	0	111.3	L83	T81-L83 VanDerWaalsContact C-N 3.34Å; T81-L83 HydrophobicContact CG2-CB 3.96Å; T81-L83 HydrophobicContact CG2-CD1 3.53Å; T81-L83 HydrophobicContact CG2-CG 3.58Å; T81-L83 PolarHBondContact O-N 3.09Å; T81-L83 VanDerWaalsContact O-N 3.09Å
82	D	55.8	Low	54.5	Low	168 Å²	168	146.2 Å²	146.2	90%	0.898	82%	0.819	S	S	*	*			trans	-65.1	95.6	153.9	-88.4	-73.5	0	0	0	108.2	R80	R80-D82 PolarHBondContact O-N 3.24Å
83	L	51.2	Low	54.8	Low	143 Å²	143	148.6 Å²	148.6	75%	0.749	83%	0.828	S	S	*	*			trans	-129.7	87.6	166.2	-94	174	0	0	0	107.7	T81	T81-L83 VanDerWaalsContact C-N 3.34Å; T81-L83 HydrophobicContact CG2-CB 3.96Å; T81-L83 HydrophobicContact CG2-CD1 3.53Å; T81-L83 HydrophobicContact CG2-CG 3.58Å; T81-L83 PolarHBondContact O-N 3.09Å; T81-L83 VanDerWaalsContact O-N 3.09Å
84	I	67.9	Low	55	Low	154 Å²	154	151.8 Å²	151.8	79%	0.79	84%	0.841	S	S	*	*			trans	-152.3	108.6	137.9	-25.7	165.4	0	0	0	108.7	V86	I84-V86 HydrophobicContact CG2-CG1 4.39Å
85	V	52.7	Low	55.5	Low	144 Å²	144	156.5 Å²	156.5	87%	0.873	85%	0.846	S	S	*	*			trans	-81	120.5	153.3	177.2	0	0	0	0	105.5
86	V	70.9	Confident	56.1	Low	199 Å²	199	157.9 Å²	157.9	100%	1.206	84%	0.844	S	S	*	*			trans	-112.5	0	161.6	-95.2	0	0	0	0	109	I84	I84-V86 HydrophobicContact CG2-CG1 4.39Å

Retrieved 86 of 86 residues in 81.6 ms (Link to these results)

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