A0A5K4F6J5_SCHMA Loading...

CARD domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F6J5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 90 aa.

						>A0A5K4F6J5_SCHMA|A0A5K4F6J5
MRNMEHCTKDNRNDSATKTKVMDSTLDSLLGPSEVGRTAEDPKSTAIIYLEKHGILRLMQKLVYEIALFQPDDPIQYMIDHVENIRDRID
					

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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	45.5	Very low	59.4	Low	240 Å²	240	172.1 Å²	172.1	100%	1.182	85%	0.853	S	S	*	*				0	108.3	0	-70.5	161.1	171.8	0	0	106.6
2	R	61.7	Low	60.2	Low	251 Å²	251	176.6 Å²	176.6	95%	0.947	85%	0.853	S	S	*	*			trans	-119.7	139.6	-179.9	-99.3	-171.7	-80.5	-176.1	-4.3	109.1
3	N	57.6	Low	60	Low	147 Å²	147	172.9 Å²	172.9	79%	0.786	84%	0.841	S	S	*	*			trans	-70.4	151.6	-155.7	-62.8	-13.4	0	0	0	114.3
4	M	52.7	Low	60.3	Low	191 Å²	191	172.6 Å²	172.6	94%	0.941	85%	0.845	S	S	*	*			trans	-102.3	113.1	178.2	-173.7	-172.6	-75	0	0	107
5	E	68.9	Low	59.9	Low	165 Å²	165	168.1 Å²	168.1	77%	0.771	84%	0.838	S	S	*	*			trans	-137.3	115.8	177.6	-71.8	-178.6	115.3	0	0	112.4
6	H	59.4	Low	59.4	Low	171 Å²	171	163.4 Å²	163.4	79%	0.792	83%	0.833	S	S	*	*			trans	66.3	114.2	141.1	-97.8	-80.7	0	0	0	121.9
7	C	49.6	Very low	59.3	Low	124 Å²	124	162.9 Å²	162.9	84%	0.838	84%	0.84	S	S	*	*			trans	-103.3	133.2	158.1	-169.1	0	0	0	0	108.7
8	T	71.8	Confident	59	Low	123 Å²	123	164.7 Å²	164.7	76%	0.755	84%	0.84	S	S	*	*			trans	-131.6	125.1	172.7	-34.8	0	0	0	0	109.1
9	K	57.7	Low	59	Low	198 Å²	198	163.2 Å²	163.2	86%	0.861	84%	0.84	S	S	*	*			trans	-71.8	139.7	175.2	-78.6	171.4	173.2	168.3	0	110.4
10	D	72.7	Confident	59	Low	148 Å²	148	164.5 Å²	164.5	79%	0.791	84%	0.839	S	S	*	*			trans	-125.7	124.1	155.6	-98.5	-40.7	0	0	0	109.7
11	N	55.7	Low	58.4	Low	135 Å²	135	162.6 Å²	162.6	72%	0.722	84%	0.836	S	S	*	*			trans	-109.1	118.2	177.6	-177.2	41.3	0	0	0	107.1	N13	N11-N13 PolarHBondContact ND2-OD1 3.45Å; N11-N13 PolarHBondContact OD1-OD1 3.19Å
12	R	69.1	Low	59	Low	226 Å²	226	160 Å²	160	85%	0.853	82%	0.822	S	S	*	*			trans	-132.9	118.1	167.2	-80.9	-167.5	-171.5	102.6	5.4	110.1
13	N	58.1	Low	58.6	Low	129 Å²	129	154.4 Å²	154.4	69%	0.69	81%	0.812	S	S	*	*			trans	-115	121.1	173	23.4	-46.5	0	0	0	105.7	N11	N11-N13 PolarHBondContact ND2-OD1 3.45Å; N11-N13 PolarHBondContact OD1-OD1 3.19Å
14	D	63.8	Low	58.2	Low	168 Å²	168	152.9 Å²	152.9	90%	0.898	81%	0.813	S	S	*	*			trans	-137	149.5	176.2	-135.8	-18.3	0	0	0	112
15	S	54.5	Low	58.3	Low	106 Å²	106	149.1 Å²	149.1	74%	0.741	80%	0.8	S	S	*	*			trans	-92.4	152.4	-148.2	-67.7	0	0	0	0	116
16	A	52.4	Low	57.6	Low	92 Å²	92	148.7 Å²	148.7	76%	0.76	80%	0.803	S	S	*	*			trans	54.8	117.9	137.8	0	0	0	0	0	120.6
17	T	57.1	Low	57.3	Low	155 Å²	155	147.6 Å²	147.6	95%	0.951	80%	0.803	S	S	*	*			trans	-148.5	144.2	136.2	-15.2	0	0	0	0	110.9
18	K	54.1	Low	57.6	Low	195 Å²	195	147.3 Å²	147.3	85%	0.848	80%	0.802	S	S	*	*			trans	-117.8	123.1	-155.7	167	-167.1	-175.7	-176.8	0	108.2
19	T	58.5	Low	56.7	Low	136 Å²	136	149 Å²	149	83%	0.834	81%	0.805	S	S	*	*			trans	-173.9	107.2	160.7	16.1	0	0	0	0	108.5
20	K	58.8	Low	56.3	Low	189 Å²	189	146.7 Å²	146.7	82%	0.822	80%	0.802	S	S	*	*				90.8	93.2	72.7	-164	-172.1	-178.3	-165.6	0	113
21	V	46	Very low	55.4	Low	126 Å²	126	142 Å²	142	76%	0.764	79%	0.788	S	S	*	*			trans	49.7	110.7	133.7	-156.8	0	0	0	0	119.8
22	M	59.9	Low	55.4	Low	184 Å²	184	141.7 Å²	141.7	91%	0.906	79%	0.793	S	S	*	*			trans	163	142.1	142	-110.4	139.5	60	0	0	106.8
23	D	52.5	Low	54.3	Low	135 Å²	135	135.3 Å²	135.3	72%	0.722	78%	0.783	S	S	*	*			cis	-161.3	148.9	5.6	-173.5	8	0	0	0	107	T25	D23-T25 PolarHBondContact O-N 2.85Å; D23-T25 VanDerWaalsContact O-N 3.15Å
24	S	48.1	Very low	54.1	Low	115 Å²	115	137.5 Å²	137.5	80%	0.804	79%	0.79	S	S	*	*			trans	-79	83.4	-178.1	138.2	0	0	0	0	109
25	T	56.2	Low	53.5	Low	112 Å²	112	135.5 Å²	135.5	69%	0.687	78%	0.783	S	S	*	*			trans	-158.5	53.8	170.9	-41.4	0	0	0	0	113	D23	D23-T25 PolarHBondContact O-N 2.85Å; D23-T25 VanDerWaalsContact O-N 3.15Å
26	L	54.5	Low	53	Low	156 Å²	156	133 Å²	133	82%	0.817	77%	0.774	S	S	*	*			trans	-131.2	24.9	174.5	-103.2	174.9	0	0	0	114.4
27	D	52.9	Low	53.3	Low	148 Å²	148	140.1 Å²	140.1	79%	0.791	78%	0.781	S	S	*	*	S	Bend	trans	-113.8	1.2	-176	-158.5	42.6	0	0	0	114.4
28	S	54.5	Low	53.5	Low	117 Å²	117	138.5 Å²	138.5	82%	0.818	77%	0.771	S	S	*	*	S	Bend	trans	-129.2	13	-174.4	-61.7	0	0	0	0	116.2
29	L	53.5	Low	54.1	Low	159 Å²	159	134 Å²	134	83%	0.832	77%	0.77	S	S	*	*			trans	-111.6	0.3	175.2	-65.7	179.1	0	0	0	114.3	G31	L29-G31 PolarHBondContact O-N 3.16Å
30	L	50	Low	55	Low	150 Å²	150	133.4 Å²	133.4	79%	0.785	76%	0.758	S	S	*	*			trans	-82	72.1	169.7	-66.9	167.3	0	0	0	108.6
31	G	54	Low	56.5	Low	49 Å²	49	128.3 Å²	128.3	51%	0.505	74%	0.74	S	S	.	*			trans	-52.6	161.8	154.4	0	0	0	0	0	109.4	L29 S33	L29-G31 PolarHBondContact O-N 3.16Å; G31-S33 VanDerWaalsContact C-N 3.34Å; G31-S33 PolarHBondContact O-N 2.83Å
32	P	55	Low	58.8	Low	128 Å²	128	127.7 Å²	127.7	83%	0.831	74%	0.739	S	S	*	*			trans	-53.3	104.5	-177.8	22.4	-30.9	0	0	0	107.8	E34	P32-E34 PolarHBondContact O-N 3Å
33	S	45.2	Very low	60.4	Low	92 Å²	92	126.7 Å²	126.7	64%	0.643	73%	0.729	S	S	*	*			trans	-67.1	95	174.9	-173.2	0	0	0	0	102.9	G31 V35	G31-S33 VanDerWaalsContact C-N 3.34Å; G31-S33 PolarHBondContact O-N 2.83Å; S33-V35 PolarHBondContact O-N 3.13Å
34	E	55.2	Low	62.3	Low	176 Å²	176	122.6 Å²	122.6	82%	0.822	71%	0.711	S	S	*	*			trans	-37.6	98.6	150.1	-65.1	-86.5	153.4	0	0	104.2	P32 G36	P32-E34 PolarHBondContact O-N 3Å; E34-G36 PolarHBondContact O-N 3.33Å
35	V	51	Low	64.5	Low	125 Å²	125	120 Å²	120	76%	0.758	69%	0.69	S	S	*	*			trans	-66	83	172.1	174.7	0	0	0	0	103.2	S33 R37	S33-V35 PolarHBondContact O-N 3.13Å; V35-R37 PolarHBondContact O-N 3.03Å
36	G	44.5	Very low	66.4	Low	53 Å²	53	117 Å²	117	55%	0.546	68%	0.676	S	S	.	*			trans	-50.5	115.3	166.2	0	0	0	0	0	103.2	E34 T38	E34-G36 PolarHBondContact O-N 3.33Å; G36-T38 PolarHBondContact O-N 3.33Å
37	R	58.7	Low	68.3	Low	243 Å²	243	113.2 Å²	113.2	92%	0.917	66%	0.656	S	S	*	*			trans	-53.9	96.2	176.3	-63.6	179.5	-173	-177.5	1.4	105	V35 A39	V35-R37 PolarHBondContact O-N 3.03Å; R37-A39 PolarHBondContact O-N 3.15Å
38	T	59.6	Low	70.3	Confident	120 Å²	120	110.3 Å²	110.3	74%	0.736	64%	0.64	S	S	*	*			trans	-54.2	116.8	174.7	45.5	0	0	0	0	103.5	G36 E40	G36-T38 PolarHBondContact O-N 3.33Å; T38-E40 PolarHBondContact O-N 3.33Å
39	A	67.8	Low	72.2	Confident	101 Å²	101	111.2 Å²	111.2	84%	0.835	63%	0.626	S	S	*	*			trans	-48.1	106.3	-176.1	0	0	0	0	0	107.6	R37 D41	R37-A39 PolarHBondContact O-N 3.15Å; A39-D41 PolarHBondContact O-N 3.4Å
40	E	77.7	Confident	74.2	Confident	124 Å²	124	106.4 Å²	106.4	58%	0.579	60%	0.602	S	S	*	*			trans	-59.5	136.1	-177.2	-68.9	178.6	-177.1	0	0	107	T38 T45	T38-E40 PolarHBondContact O-N 3.33Å; E40-T45 VanDerWaalsContact CB-OG1 3.25Å; E40-T45 WeakPolarHBondContact CB-OG1 3.25Å; E40-T45 PolarHBondContact OE2-OG1 2.95Å; E40-T45 VanDerWaalsContact OE2-OG1 3.11Å
41	D	90	Very high	76.3	Confident	81 Å²	81	105.3 Å²	105.3	43%	0.433	59%	0.592	S	S	.	*			trans	-61.4	136.7	177.9	71.1	89.7	0	0	0	108.4	A39 K43 S44 T45	A39-D41 PolarHBondContact O-N 3.4Å; D41-K43 PolarHBondContact O-N 3.38Å; D41-K43 WeakPolarHBondContact OD1-CB 3.47Å; D41-K43 PolarHBondContact OD1-N 3.2Å; D41-S44 PolarHBondContact O-N 3.29Å; D41-S44 WeakPolarHBondContact OD1-CB 3.17Å; D41-S44 PolarHBondContact OD1-N 2.96Å; D41-S44 PolarHBondContact OD1-OG 2.73Å; D41-S44 VanDerWaalsContact OD1-OG 3.09Å; D41-S44 WeakPolarHBondContact OD2-CB 3.17Å; D41-S44 PolarHBondContact OD2-OG 3.15Å; D41-T45 PolarHBondContact O-N 3.21Å; D41-T45 VanDerWaalsContact O-N 3.1Å; D41-T45 PolarHBondContact O-OG1 3.39Å
42	P	93.5	Very high	78.1	Confident	114 Å²	114	110.9 Å²	110.9	74%	0.74	60%	0.602	S	S	*	*	H	α-helix	trans	-55.4	-25.6	-173.6	-29.4	34.6	0	0	0	114.2	A46	P42-A46 WeakPolarHBondContact O-CB 3.28Å; P42-A46 PolarHBondContact O-N 3.4Å
43	K	93.2	Very high	79.8	Confident	163 Å²	163	109.3 Å²	109.3	71%	0.709	58%	0.584	S	S	*	*	H	α-helix	trans	-74.5	-44.5	-179.9	-162.9	-178	-178.1	-175.3	0	110.9	D41 A46 I47	D41-K43 PolarHBondContact O-N 3.38Å; D41-K43 WeakPolarHBondContact OD1-CB 3.47Å; D41-K43 PolarHBondContact OD1-N 3.2Å; K43-A46 PolarHBondContact O-N 3.01Å; K43-I47 HydrophobicContact CG-CD1 4.35Å; K43-I47 VanDerWaalsContact O-CG1 3.32Å; K43-I47 WeakPolarHBondContact O-CG1 3.5Å; K43-I47 PolarHBondContact O-N 3.5Å
44	S	93.6	Very high	82	Confident	48 Å²	48	105.8 Å²	105.8	34%	0.336	56%	0.562	S	S	.	*	H	α-helix	trans	-62.3	-45.9	173.8	-66.5	0	0	0	0	111.3	D41 A46 I47 I48	D41-S44 PolarHBondContact O-N 3.29Å; D41-S44 WeakPolarHBondContact OD1-CB 3.17Å; D41-S44 PolarHBondContact OD1-N 2.96Å; D41-S44 PolarHBondContact OD1-OG 2.73Å; D41-S44 VanDerWaalsContact OD1-OG 3.09Å; D41-S44 WeakPolarHBondContact OD2-CB 3.17Å; D41-S44 PolarHBondContact OD2-OG 3.15Å; S44-A46 VanDerWaalsContact C-N 3.28Å; S44-A46 PolarHBondContact O-N 3.48Å; S44-I47 PolarHBondContact O-N 2.98Å; S44-I48 VanDerWaalsContact O-CG1 3.28Å; S44-I48 WeakPolarHBondContact O-CG1 3.46Å; S44-I48 PolarHBondContact O-N 3.33Å
45	T	94.6	Very high	83.8	Confident	61 Å²	61	99.4 Å²	99.4	37%	0.374	53%	0.533	S	S	.	.	H	α-helix	trans	-59	-40.9	175.6	-55.7	0	0	0	0	111.6	E40 D41 Y49	E40-T45 VanDerWaalsContact CB-OG1 3.25Å; E40-T45 WeakPolarHBondContact CB-OG1 3.25Å; E40-T45 PolarHBondContact OE2-OG1 2.95Å; E40-T45 VanDerWaalsContact OE2-OG1 3.11Å; D41-T45 PolarHBondContact O-N 3.21Å; D41-T45 VanDerWaalsContact O-N 3.1Å; D41-T45 PolarHBondContact O-OG1 3.39Å; T45-Y49 WeakPolarHBondContact O-CB 3.48Å; T45-Y49 PolarHBondContact O-N 3.12Å
46	A	95.7	Very high	85.8	Confident	48 Å²	48	97.4 Å²	97.4	40%	0.397	52%	0.518	S	S	.	.	H	α-helix	trans	-65	-44	175.8	0	0	0	0	0	112.5	P42 K43 S44 Y49 L50	P42-A46 WeakPolarHBondContact O-CB 3.28Å; P42-A46 PolarHBondContact O-N 3.4Å; K43-A46 PolarHBondContact O-N 3.01Å; S44-A46 VanDerWaalsContact C-N 3.28Å; S44-A46 PolarHBondContact O-N 3.48Å; A46-Y49 WeakPolarHBondContact O-CB 3.21Å; A46-Y49 PolarHBondContact O-N 3.44Å; A46-L50 VanDerWaalsContact O-CG 3.24Å; A46-L50 WeakPolarHBondContact O-CG 3.43Å; A46-L50 PolarHBondContact O-N 3.47Å
47	I	94.1	Very high	88	Confident	77 Å²	77	102 Å²	102	40%	0.395	52%	0.519	S	S	.	.	H	α-helix	trans	-61.9	-47.3	178	-69.6	165.1	0	0	0	110.5	K43 S44 Y49 L50 E51	K43-I47 HydrophobicContact CG-CD1 4.35Å; K43-I47 VanDerWaalsContact O-CG1 3.32Å; K43-I47 WeakPolarHBondContact O-CG1 3.5Å; K43-I47 PolarHBondContact O-N 3.5Å; S44-I47 PolarHBondContact O-N 2.98Å; I47-Y49 VanDerWaalsContact C-N 3.27Å; I47-Y49 PolarHBondContact O-N 3.35Å; I47-L50 PolarHBondContact O-N 3.28Å; I47-L50 VanDerWaalsContact O-N 3.13Å; I47-E51 HydrophobicContact CG2-CG 4.35Å; I47-E51 WeakPolarHBondContact O-CG 3.44Å; I47-E51 PolarHBondContact O-N 2.92Å
48	I	94.6	Very high	89.6	Confident	88 Å²	88	91.6 Å²	91.6	45%	0.451	48%	0.481	S	S	.	.	H	α-helix	trans	-57.5	-43.3	177.3	-68.1	165	0	0	0	110.4	S44 K52	S44-I48 VanDerWaalsContact O-CG1 3.28Å; S44-I48 WeakPolarHBondContact O-CG1 3.46Å; S44-I48 PolarHBondContact O-N 3.33Å; I48-K52 WeakPolarHBondContact O-CB 3Å; I48-K52 PolarHBondContact O-N 2.94Å
49	Y	95.8	Very high	91.2	Very high	135 Å²	135	90.2 Å²	90.2	53%	0.529	47%	0.467	S	S	.	.	H	α-helix	trans	-61.3	-48.3	176.2	178.7	-90.1	0	0	0	111.9	T45 A46 I47 E51 K52 H53	T45-Y49 WeakPolarHBondContact O-CB 3.48Å; T45-Y49 PolarHBondContact O-N 3.12Å; A46-Y49 WeakPolarHBondContact O-CB 3.21Å; A46-Y49 PolarHBondContact O-N 3.44Å; I47-Y49 VanDerWaalsContact C-N 3.27Å; I47-Y49 PolarHBondContact O-N 3.35Å; Y49-E51 VanDerWaalsContact C-N 3.34Å; Y49-E51 PolarHBondContact O-N 3.3Å; Y49-K52 PolarHBondContact O-N 3.19Å; Y49-H53 AromaticContact CD2-CD2 3.62Å; Y49-H53 AromaticContact CD2-NE2 3.95Å; Y49-H53 AromaticContact CE2-CD2 3.53Å; Y49-H53 AromaticContact CE2-NE2 3.71Å; Y49-H53 AromaticContact CZ-CD2 3.98Å; Y49-H53 WeakPolarHBondContact O-CB 3.49Å; Y49-H53 PolarHBondContact O-CD2 3.38Å; Y49-H53 VanDerWaalsContact O-CD2 3.32Å; Y49-H53 PolarHBondContact O-N 3.44Å; Y49-H53 VanDerWaalsContact O-N 3.09Å
50	L	95.5	Very high	92.4	Very high	59 Å²	59	92 Å²	92	31%	0.309	46%	0.458	S	S	.	.	H	α-helix	trans	-62	-40.9	-179.1	-68.4	172.6	0	0	0	112.2	A46 I47 G54 I55 L56	A46-L50 VanDerWaalsContact O-CG 3.24Å; A46-L50 WeakPolarHBondContact O-CG 3.43Å; A46-L50 PolarHBondContact O-N 3.47Å; I47-L50 PolarHBondContact O-N 3.28Å; I47-L50 VanDerWaalsContact O-N 3.13Å; L50-G54 PolarHBondContact O-N 3.43Å; L50-I55 HydrophobicContact CB-CB 4.45Å; L50-I55 HydrophobicContact CD2-CB 3.75Å; L50-I55 HydrophobicContact CD2-CG1 4.28Å; L50-I55 HydrophobicContact CD2-CG2 3.58Å; L50-I55 PolarHBondContact O-N 3.48Å; L50-L56 HydrophobicContact CB-CD2 4.23Å; L50-L56 HydrophobicContact CB-CG 4.06Å; L50-L56 HydrophobicContact CD1-CD2 4.14Å
51	E	92.2	Very high	93.1	Very high	127 Å²	127	88.4 Å²	88.4	59%	0.593	44%	0.441	S	S	*	.	H	α-helix	trans	-69.8	-50.7	177.7	-71.5	-179.1	163.1	0	0	111.6	I47 Y49 H53 G54 L56	I47-E51 HydrophobicContact CG2-CG 4.35Å; I47-E51 WeakPolarHBondContact O-CG 3.44Å; I47-E51 PolarHBondContact O-N 2.92Å; Y49-E51 VanDerWaalsContact C-N 3.34Å; Y49-E51 PolarHBondContact O-N 3.3Å; E51-H53 PolarHBondContact O-N 3.27Å; E51-G54 PolarHBondContact O-N 3Å; E51-L56 HydrophobicContact CG-CD1 4.2Å
52	K	92.8	Very high	93.2	Very high	165 Å²	165	84.7 Å²	84.7	72%	0.717	42%	0.421	S	S	*	.	H	α-helix	trans	-55.6	-39	-179.3	178.3	-177	175.8	-174	0	112.5	I48 Y49	I48-K52 WeakPolarHBondContact O-CB 3Å; I48-K52 PolarHBondContact O-N 2.94Å; Y49-K52 PolarHBondContact O-N 3.19Å
53	H	90.9	Very high	93.2	Very high	96 Å²	96	83.9 Å²	83.9	44%	0.444	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	10.5	-177.7	-70.7	-81.2	0	0	0	113.2	Y49 E51 I55	Y49-H53 AromaticContact CD2-CD2 3.62Å; Y49-H53 AromaticContact CD2-NE2 3.95Å; Y49-H53 AromaticContact CE2-CD2 3.53Å; Y49-H53 AromaticContact CE2-NE2 3.71Å; Y49-H53 AromaticContact CZ-CD2 3.98Å; Y49-H53 WeakPolarHBondContact O-CB 3.49Å; Y49-H53 PolarHBondContact O-CD2 3.38Å; Y49-H53 VanDerWaalsContact O-CD2 3.32Å; Y49-H53 PolarHBondContact O-N 3.44Å; Y49-H53 VanDerWaalsContact O-N 3.09Å; E51-H53 PolarHBondContact O-N 3.27Å; H53-I55 HydrophobicContact CB-CD1 4Å; H53-I55 HydrophobicContact CB-CG1 3.77Å; H53-I55 PolarHBondContact O-N 2.96Å
54	G	91.2	Very high	93.3	Very high	18 Å²	18	83.3 Å²	83.3	19%	0.186	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	17.5	178.1	0	0	0	0	0	114.3	L50 E51 L56 R57 L58	L50-G54 PolarHBondContact O-N 3.43Å; E51-G54 PolarHBondContact O-N 3Å; G54-L56 VanDerWaalsContact C-N 3.3Å; G54-L56 PolarHBondContact O-N 2.95Å; G54-R57 WeakPolarHBondContact O-CB 3.34Å; G54-R57 PolarHBondContact O-N 3.42Å; G54-R57 VanDerWaalsContact O-N 3.09Å; G54-L58 PolarHBondContact O-N 3.22Å
55	I	93	Very high	93.3	Very high	42 Å²	42	82.2 Å²	82.2	22%	0.215	40%	0.398	C	S	.	.	H	α-helix	trans	-64	-37.8	-172.5	-56.7	-60.2	0	0	0	110.6	L50 H53 R57 L58 M59	L50-I55 HydrophobicContact CB-CB 4.45Å; L50-I55 HydrophobicContact CD2-CB 3.75Å; L50-I55 HydrophobicContact CD2-CG1 4.28Å; L50-I55 HydrophobicContact CD2-CG2 3.58Å; L50-I55 PolarHBondContact O-N 3.48Å; H53-I55 HydrophobicContact CB-CD1 4Å; H53-I55 HydrophobicContact CB-CG1 3.77Å; H53-I55 PolarHBondContact O-N 2.96Å; I55-R57 VanDerWaalsContact C-N 3.31Å; I55-R57 PolarHBondContact O-N 3.04Å; I55-L58 PolarHBondContact O-N 3.02Å; I55-M59 HydrophobicContact CG2-CE 4.23Å; I55-M59 HydrophobicContact CG2-CG 4.18Å; I55-M59 WeakPolarHBondContact O-CB 3.41Å; I55-M59 VanDerWaalsContact O-CG 3.24Å; I55-M59 WeakPolarHBondContact O-CG 3.41Å; I55-M59 PolarHBondContact O-N 2.96Å
56	L	92.2	Very high	93.4	Very high	83 Å²	83	81 Å²	81	44%	0.435	39%	0.389	S	S	.	.	H	α-helix	trans	-59.8	-43.4	175.7	-63	-179.7	0	0	0	111.6	L50 E51 G54 M59 Q60	L50-L56 HydrophobicContact CB-CD2 4.23Å; L50-L56 HydrophobicContact CB-CG 4.06Å; L50-L56 HydrophobicContact CD1-CD2 4.14Å; E51-L56 HydrophobicContact CG-CD1 4.2Å; G54-L56 VanDerWaalsContact C-N 3.3Å; G54-L56 PolarHBondContact O-N 2.95Å; L56-M59 PolarHBondContact O-N 2.91Å; L56-Q60 WeakPolarHBondContact O-CB 3.46Å; L56-Q60 VanDerWaalsContact O-CG 3.24Å; L56-Q60 WeakPolarHBondContact O-CG 3.5Å; L56-Q60 PolarHBondContact O-N 2.97Å
57	R	91.7	Very high	93.4	Very high	148 Å²	148	82 Å²	82	56%	0.558	40%	0.397	S	S	*	.	H	α-helix	trans	-68.7	-40.3	179.2	-171.9	173.5	-178.9	-164.3	1.1	111.6	G54 I55 Q60 K61 I89	G54-R57 WeakPolarHBondContact O-CB 3.34Å; G54-R57 PolarHBondContact O-N 3.42Å; G54-R57 VanDerWaalsContact O-N 3.09Å; I55-R57 VanDerWaalsContact C-N 3.31Å; I55-R57 PolarHBondContact O-N 3.04Å; R57-Q60 PolarHBondContact O-N 3.34Å; R57-K61 PolarHBondContact O-N 3.08Å; R57-K61 VanDerWaalsContact O-N 3.08Å; R57-I89 HydrophobicContact CB-CD1 4.43Å; R57-I89 HydrophobicContact CG-CD1 4.24Å; R57-I89 HydrophobicContact CG-CG1 4.37Å; R57-I89 PolarHBondContact NH1-O 3.15Å
58	L	91.6	Very high	93.5	Very high	25 Å²	25	82.8 Å²	82.8	13%	0.131	40%	0.401	C	S	.	.	H	α-helix	trans	-57.8	-51.1	173.2	171.6	63	0	0	0	111	G54 I55 Q60 K61 L62 I85 I89	G54-L58 PolarHBondContact O-N 3.22Å; I55-L58 PolarHBondContact O-N 3.02Å; L58-Q60 PolarHBondContact O-N 2.97Å; L58-K61 PolarHBondContact O-N 3.08Å; L58-L62 HydrophobicContact CD1-CD1 3.92Å; L58-L62 HydrophobicContact CD1-CG 4.26Å; L58-L62 HydrophobicContact CG-CD1 4.05Å; L58-L62 WeakPolarHBondContact O-CG 3.25Å; L58-L62 PolarHBondContact O-N 3.33Å; L58-I85 HydrophobicContact CD1-CB 3.78Å; L58-I85 HydrophobicContact CD1-CD1 4.47Å; L58-I85 HydrophobicContact CD1-CG2 3.36Å; L58-I89 VanDerWaalsContact CA-CD1 3.46Å; L58-I89 HydrophobicContact CB-CD1 3.8Å; L58-I89 HydrophobicContact CD1-CD1 4.36Å
59	M	92.8	Very high	93.6	Very high	91 Å²	91	84.3 Å²	84.3	45%	0.448	41%	0.405	S	S	.	.	H	α-helix	trans	-64.9	-41.6	-178.7	-67.4	-62.4	159.6	0	0	112.2	I55 L56 K61 L62 V63	I55-M59 HydrophobicContact CG2-CE 4.23Å; I55-M59 HydrophobicContact CG2-CG 4.18Å; I55-M59 WeakPolarHBondContact O-CB 3.41Å; I55-M59 VanDerWaalsContact O-CG 3.24Å; I55-M59 WeakPolarHBondContact O-CG 3.41Å; I55-M59 PolarHBondContact O-N 2.96Å; L56-M59 PolarHBondContact O-N 2.91Å; M59-K61 VanDerWaalsContact C-N 3.32Å; M59-K61 PolarHBondContact O-N 3.28Å; M59-L62 PolarHBondContact O-N 3.4Å; M59-L62 HydrophobicContact SD-CD1 4.38Å; M59-V63 WeakPolarHBondContact O-CB 3.39Å; M59-V63 VanDerWaalsContact O-CG2 3.29Å; M59-V63 WeakPolarHBondContact O-CG2 3.12Å; M59-V63 PolarHBondContact O-N 3.45Å
60	Q	93.7	Very high	93.7	Very high	138 Å²	138	85.3 Å²	85.3	65%	0.645	41%	0.414	S	S	*	.	H	α-helix	trans	-58	-44.6	174.8	-76.7	170.9	-4	0	0	112	L56 R57 L58 Y64	L56-Q60 WeakPolarHBondContact O-CB 3.46Å; L56-Q60 VanDerWaalsContact O-CG 3.24Å; L56-Q60 WeakPolarHBondContact O-CG 3.5Å; L56-Q60 PolarHBondContact O-N 2.97Å; R57-Q60 PolarHBondContact O-N 3.34Å; L58-Q60 PolarHBondContact O-N 2.97Å; Q60-Y64 WeakPolarHBondContact O-CB 3.46Å; Q60-Y64 PolarHBondContact O-N 3.42Å
61	K	92.3	Very high	93.7	Very high	50 Å²	50	84 Å²	84	22%	0.217	41%	0.409	C	S	.	.	H	α-helix	trans	-67.8	-44.6	179.4	-178	168.7	166.2	-161.3	0	112.3	R57 L58 M59 V63 Y64 E65 I85	R57-K61 PolarHBondContact O-N 3.08Å; R57-K61 VanDerWaalsContact O-N 3.08Å; L58-K61 PolarHBondContact O-N 3.08Å; M59-K61 VanDerWaalsContact C-N 3.32Å; M59-K61 PolarHBondContact O-N 3.28Å; K61-V63 PolarHBondContact O-N 3.5Å; K61-Y64 PolarHBondContact O-N 3.08Å; K61-E65 WeakPolarHBondContact CE-OE1 3.29Å; K61-E65 HydrophobicContact CG-CG 4.46Å; K61-E65 WeakPolarHBondContact O-CG 3.25Å; K61-E65 PolarHBondContact O-N 3.5Å; K61-I85 HydrophobicContact CB-CG2 4.47Å; K61-I85 HydrophobicContact CD-CD1 4.48Å; K61-I85 HydrophobicContact CD-CG1 4.19Å; K61-I85 HydrophobicContact CD-CG2 3.72Å; K61-I85 HydrophobicContact CG-CD1 4.29Å; K61-I85 HydrophobicContact CG-CG2 4.35Å
62	L	92.5	Very high	94	Very high	2 Å²	2	86.4 Å²	86.4	1%	0.01	43%	0.426	C	S	.	.	H	α-helix	trans	-58.1	-48.8	176	-78	168.1	0	0	0	111.6	L58 M59 Y64 E65 I66 M78 H81 V82 I85	L58-L62 HydrophobicContact CD1-CD1 3.92Å; L58-L62 HydrophobicContact CD1-CG 4.26Å; L58-L62 HydrophobicContact CG-CD1 4.05Å; L58-L62 WeakPolarHBondContact O-CG 3.25Å; L58-L62 PolarHBondContact O-N 3.33Å; M59-L62 PolarHBondContact O-N 3.4Å; M59-L62 HydrophobicContact SD-CD1 4.38Å; L62-Y64 VanDerWaalsContact C-N 3.33Å; L62-Y64 PolarHBondContact O-N 2.97Å; L62-E65 PolarHBondContact O-N 3.32Å; L62-I66 VanDerWaalsContact O-CG1 3.25Å; L62-I66 WeakPolarHBondContact O-CG1 3.35Å; L62-I66 PolarHBondContact O-N 3.09Å; L62-M78 HydrophobicContact CD1-CE 4.33Å; L62-M78 HydrophobicContact CD2-CG 4.35Å; L62-H81 HydrophobicContact CD2-CB 4.45Å; L62-V82 HydrophobicContact CD1-CG2 3.79Å; L62-V82 HydrophobicContact CD2-CG2 4.19Å; L62-I85 HydrophobicContact CD2-CD1 3.36Å; L62-I85 HydrophobicContact CG-CD1 3.7Å
63	V	94.1	Very high	94.2	Very high	98 Å²	98	82.7 Å²	82.7	59%	0.594	41%	0.414	S	S	*	.	H	α-helix	trans	-62.3	-41.7	179.2	171.7	0	0	0	0	111.2	M59 K61 A67	M59-V63 WeakPolarHBondContact O-CB 3.39Å; M59-V63 VanDerWaalsContact O-CG2 3.29Å; M59-V63 WeakPolarHBondContact O-CG2 3.12Å; M59-V63 PolarHBondContact O-N 3.45Å; K61-V63 PolarHBondContact O-N 3.5Å; V63-A67 WeakPolarHBondContact O-CB 3.24Å; V63-A67 PolarHBondContact O-N 2.89Å
64	Y	95	Very high	94.4	Very high	150 Å²	150	80.6 Å²	80.6	59%	0.588	41%	0.409	S	S	*	.	H	α-helix	trans	-60	-47.7	175.4	174.6	-99.1	0	0	0	112	Q60 K61 L62 A67 L68	Q60-Y64 WeakPolarHBondContact O-CB 3.46Å; Q60-Y64 PolarHBondContact O-N 3.42Å; K61-Y64 PolarHBondContact O-N 3.08Å; L62-Y64 VanDerWaalsContact C-N 3.33Å; L62-Y64 PolarHBondContact O-N 2.97Å; Y64-A67 PolarHBondContact O-N 2.97Å; Y64-L68 HydrophobicContact CE1-CD2 3.97Å; Y64-L68 VanDerWaalsContact O-CB 3.28Å; Y64-L68 WeakPolarHBondContact O-CB 3.46Å; Y64-L68 PolarHBondContact O-N 3.03Å
65	E	94.1	Very high	94.5	Very high	25 Å²	25	85.1 Å²	85.1	12%	0.117	43%	0.428	C	S	.	.	H	α-helix	trans	-65.3	-43.3	-179.6	-73.2	-176.7	-169.8	0	0	112.1	K61 L62 A67 L68 F69 Y77 H81	K61-E65 WeakPolarHBondContact CE-OE1 3.29Å; K61-E65 HydrophobicContact CG-CG 4.46Å; K61-E65 WeakPolarHBondContact O-CG 3.25Å; K61-E65 PolarHBondContact O-N 3.5Å; L62-E65 PolarHBondContact O-N 3.32Å; E65-A67 VanDerWaalsContact C-N 3.34Å; E65-A67 PolarHBondContact O-N 3.03Å; E65-L68 PolarHBondContact O-N 3.22Å; E65-F69 HydrophobicContact CB-CD2 4.06Å; E65-F69 HydrophobicContact CB-CE2 4.16Å; E65-F69 HydrophobicContact CG-CE2 4.15Å; E65-F69 WeakPolarHBondContact O-CB 3.47Å; E65-F69 WeakPolarHBondContact O-CD2 3.24Å; E65-F69 PolarHBondContact O-N 3.34Å; E65-Y77 HydrophobicContact CB-CE1 4Å; E65-Y77 PolarHBondContact OE2-OH 3.33Å; E65-H81 IonicContact OE2-CD2 3.95Å
66	I	95.7	Very high	94.6	Very high	37 Å²	37	87.1 Å²	87.1	19%	0.19	44%	0.437	C	S	.	.	H	α-helix	trans	-60.4	-45.2	176	-66.6	164.1	0	0	0	110.9	L62 L68 Q70 P74 Y77 M78	L62-I66 VanDerWaalsContact O-CG1 3.25Å; L62-I66 WeakPolarHBondContact O-CG1 3.35Å; L62-I66 PolarHBondContact O-N 3.09Å; I66-L68 VanDerWaalsContact C-N 3.27Å; I66-L68 PolarHBondContact O-N 3.41Å; I66-Q70 WeakPolarHBondContact O-CA 3.47Å; I66-Q70 PolarHBondContact O-N 3.09Å; I66-P74 HydrophobicContact CG2-CB 4.07Å; I66-Y77 HydrophobicContact CG1-CD1 4.1Å; I66-M78 HydrophobicContact CD1-CG 3.4Å; I66-M78 HydrophobicContact CD1-SD 3.56Å; I66-M78 VanDerWaalsContact CD1-SD 3.56Å; I66-M78 HydrophobicContact CG1-CG 4.24Å
67	A	96.2	Very high	94.7	Very high	67 Å²	67	84.8 Å²	84.8	55%	0.554	42%	0.422	S	S	*	.	H	α-helix	trans	-64.8	-34.2	178.8	0	0	0	0	0	112.2	V63 Y64 E65	V63-A67 WeakPolarHBondContact O-CB 3.24Å; V63-A67 PolarHBondContact O-N 2.89Å; Y64-A67 PolarHBondContact O-N 2.97Å; E65-A67 VanDerWaalsContact C-N 3.34Å; E65-A67 PolarHBondContact O-N 3.03Å
68	L	96.7	Very high	94.7	Very high	94 Å²	94	80.5 Å²	80.5	49%	0.492	41%	0.409	S	S	.	.	H	α-helix	trans	-75.5	-49.5	-179.7	-179.2	63.1	0	0	0	112.6	Y64 E65 I66	Y64-L68 HydrophobicContact CE1-CD2 3.97Å; Y64-L68 VanDerWaalsContact O-CB 3.28Å; Y64-L68 WeakPolarHBondContact O-CB 3.46Å; Y64-L68 PolarHBondContact O-N 3.03Å; E65-L68 PolarHBondContact O-N 3.22Å; I66-L68 VanDerWaalsContact C-N 3.27Å; I66-L68 PolarHBondContact O-N 3.41Å
69	F	95.7	Very high	94.7	Very high	121 Å²	121	84.1 Å²	84.1	53%	0.531	43%	0.428	S	S	.	.	H	α-helix	trans	-90	-21.6	-171.8	-64.7	-63.8	0	0	0	113.9	E65 Y77	E65-F69 HydrophobicContact CB-CD2 4.06Å; E65-F69 HydrophobicContact CB-CE2 4.16Å; E65-F69 HydrophobicContact CG-CE2 4.15Å; E65-F69 WeakPolarHBondContact O-CB 3.47Å; E65-F69 WeakPolarHBondContact O-CD2 3.24Å; E65-F69 PolarHBondContact O-N 3.34Å; F69-Y77 HydrophobicContact CB-CE2 4.49Å; F69-Y77 HydrophobicContact CD2-CE2 4.34Å; F69-Y77 AromaticContact CD2-CZ 3.9Å; F69-Y77 WeakPolarHBondContact CD2-OH 3.44Å; F69-Y77 WeakPolarHBondContact CE2-OH 3.47Å
70	Q	97	Very high	94.5	Very high	155 Å²	155	84 Å²	84	72%	0.724	43%	0.429	S	S	*	.			trans	46.5	57.9	-180	-58.2	-175.3	8	0	0	112.9	I66	I66-Q70 WeakPolarHBondContact O-CA 3.47Å; I66-Q70 PolarHBondContact O-N 3.09Å
71	P	96.6	Very high	94.1	Very high	32 Å²	32	79.9 Å²	79.9	21%	0.208	41%	0.41	C	S	.	.			trans	-62.6	148	179.1	30.2	-38	0	0	0	111.3	D73 P74 Y77	P71-D73 PolarHBondContact O-N 3.32Å; P71-P74 HydrophobicContact CG-CB 4.34Å; P71-P74 HydrophobicContact CG-CG 4.34Å; P71-P74 WeakPolarHBondContact O-CD 3.5Å; P71-Y77 HydrophobicContact CB-CD2 3.87Å; P71-Y77 HydrophobicContact CB-CG 4.09Å; P71-Y77 HydrophobicContact CG-CD1 4.45Å; P71-Y77 HydrophobicContact CG-CD2 3.95Å; P71-Y77 HydrophobicContact CG-CG 3.75Å
72	D	97.9	Very high	93.7	Very high	177 Å²	177	80.3 Å²	80.3	95%	0.947	42%	0.416	S	S	*	.	S	Bend	trans	-61.2	-30.8	176.2	-67.9	-33.5	0	0	0	112.2
73	D	96.9	Very high	92.9	Very high	87 Å²	87	86.7 Å²	86.7	47%	0.465	45%	0.446	S	S	.	.			trans	-123.1	92.5	171.1	-170.2	-21.2	0	0	0	110.8	P71 I75 Q76 Y77	P71-D73 PolarHBondContact O-N 3.32Å; D73-I75 VanDerWaalsContact C-N 3.27Å; D73-I75 PolarHBondContact O-N 3.49Å; D73-I75 PolarHBondContact OD1-N 3.43Å; D73-I75 VanDerWaalsContact OD1-N 3.08Å; D73-Q76 HydrophobicContact CB-CB 3.98Å; D73-Q76 VanDerWaalsContact CG-CB 3.47Å; D73-Q76 PolarHBondContact O-N 2.9Å; D73-Q76 PolarHBondContact OD1-N 2.92Å; D73-Y77 WeakPolarHBondContact O-CB 3.11Å; D73-Y77 PolarHBondContact O-N 3.02Å
74	P	95.8	Very high	92	Very high	53 Å²	53	86.8 Å²	86.8	34%	0.344	44%	0.443	S	S	.	.	H	α-helix	trans	-62	-31.2	178.6	-24.8	34.8	0	0	0	114.2	I66 P71 M78	I66-P74 HydrophobicContact CG2-CB 4.07Å; P71-P74 HydrophobicContact CG-CB 4.34Å; P71-P74 HydrophobicContact CG-CG 4.34Å; P71-P74 WeakPolarHBondContact O-CD 3.5Å; P74-M78 VanDerWaalsContact O-CG 3.25Å; P74-M78 WeakPolarHBondContact O-CG 3.45Å; P74-M78 PolarHBondContact O-N 3.05Å
75	I	93.7	Very high	90.7	Very high	113 Å²	113	79.8 Å²	79.8	58%	0.579	42%	0.416	S	S	*	.	H	α-helix	trans	-73.3	-45.1	-178.4	-58.9	-58.9	0	0	0	109.5	D73 Y77 M78 I79	D73-I75 VanDerWaalsContact C-N 3.27Å; D73-I75 PolarHBondContact O-N 3.49Å; D73-I75 PolarHBondContact OD1-N 3.43Å; D73-I75 VanDerWaalsContact OD1-N 3.08Å; I75-Y77 VanDerWaalsContact C-N 3.33Å; I75-Y77 PolarHBondContact O-N 3.32Å; I75-M78 WeakPolarHBondContact O-CB 3.24Å; I75-M78 PolarHBondContact O-N 3.3Å; I75-I79 HydrophobicContact CG2-CD1 4.25Å; I75-I79 WeakPolarHBondContact O-CG1 3.32Å; I75-I79 PolarHBondContact O-N 2.92Å; I75-I79 VanDerWaalsContact O-N 3.08Å
76	Q	94.6	Very high	89.4	Confident	84 Å²	84	85.6 Å²	85.6	39%	0.393	44%	0.437	S	S	.	.	H	α-helix	trans	-63.1	-42.1	174.7	-170.6	59.1	53.2	0	0	111.3	D73 M78 I79 D80	D73-Q76 HydrophobicContact CB-CB 3.98Å; D73-Q76 VanDerWaalsContact CG-CB 3.47Å; D73-Q76 PolarHBondContact O-N 2.9Å; D73-Q76 PolarHBondContact OD1-N 2.92Å; Q76-M78 VanDerWaalsContact C-N 3.29Å; Q76-M78 PolarHBondContact O-N 3.13Å; Q76-I79 PolarHBondContact O-N 2.94Å; Q76-I79 VanDerWaalsContact O-N 3.12Å; Q76-D80 PolarHBondContact NE2-OD1 2.56Å; Q76-D80 VanDerWaalsContact O-CG 3.31Å; Q76-D80 PolarHBondContact O-N 2.92Å
77	Y	94.2	Very high	88.1	Confident	33 Å²	33	88.9 Å²	88.9	13%	0.129	46%	0.455	C	S	.	.	H	α-helix	trans	-55.2	-45.3	173.8	-176.6	-81.5	0	0	0	111.5	E65 I66 F69 P71 D73 I75 I79 D80 H81	E65-Y77 HydrophobicContact CB-CE1 4Å; E65-Y77 PolarHBondContact OE2-OH 3.33Å; I66-Y77 HydrophobicContact CG1-CD1 4.1Å; F69-Y77 HydrophobicContact CB-CE2 4.49Å; F69-Y77 HydrophobicContact CD2-CE2 4.34Å; F69-Y77 AromaticContact CD2-CZ 3.9Å; F69-Y77 WeakPolarHBondContact CD2-OH 3.44Å; F69-Y77 WeakPolarHBondContact CE2-OH 3.47Å; P71-Y77 HydrophobicContact CB-CD2 3.87Å; P71-Y77 HydrophobicContact CB-CG 4.09Å; P71-Y77 HydrophobicContact CG-CD1 4.45Å; P71-Y77 HydrophobicContact CG-CD2 3.95Å; P71-Y77 HydrophobicContact CG-CG 3.75Å; D73-Y77 WeakPolarHBondContact O-CB 3.11Å; D73-Y77 PolarHBondContact O-N 3.02Å; I75-Y77 VanDerWaalsContact C-N 3.33Å; I75-Y77 PolarHBondContact O-N 3.32Å; Y77-I79 PolarHBondContact O-N 3.28Å; Y77-D80 PolarHBondContact O-N 3.11Å; Y77-H81 AromaticContact CD1-ND1 3.77Å; Y77-H81 AromaticContact CD2-CE1 3.52Å; Y77-H81 AromaticContact CD2-ND1 3.82Å; Y77-H81 HydrophobicContact CE1-CB 4.29Å; Y77-H81 AromaticContact CE1-CE1 3.98Å; Y77-H81 AromaticContact CE1-CG 3.76Å; Y77-H81 AromaticContact CE1-ND1 3.69Å; Y77-H81 AromaticContact CE2-CE1 3.25Å; Y77-H81 WeakPolarHBondContact CE2-CE1 3.25Å; Y77-H81 AromaticContact CE2-ND1 3.78Å; Y77-H81 AromaticContact CE2-NE2 3.59Å; Y77-H81 AromaticContact CG-CE1 4Å; Y77-H81 AromaticContact CG-ND1 3.81Å; Y77-H81 AromaticContact CZ-CD2 3.72Å; Y77-H81 AromaticContact CZ-CE1 3.47Å; Y77-H81 VanDerWaalsContact CZ-CE1 3.47Å; Y77-H81 AromaticContact CZ-CG 3.84Å; Y77-H81 AromaticContact CZ-ND1 3.68Å; Y77-H81 AromaticContact CZ-NE2 3.51Å; Y77-H81 WeakPolarHBondContact O-CB 3.28Å; Y77-H81 PolarHBondContact O-N 3.09Å; Y77-H81 VanDerWaalsContact O-N 3.15Å; Y77-H81 PolarHBondContact O-ND1 3.02Å; Y77-H81 PolarHBondContact OH-NE2 3.3Å
78	M	91.2	Very high	86.6	Confident	59 Å²	59	94.4 Å²	94.4	29%	0.291	46%	0.461	S	S	.	.	H	α-helix	trans	-59.7	-46.6	176.3	-72.1	173.1	73.9	0	0	112.1	L62 I66 P74 I75 Q76 D80 H81 V82	L62-M78 HydrophobicContact CD1-CE 4.33Å; L62-M78 HydrophobicContact CD2-CG 4.35Å; I66-M78 HydrophobicContact CD1-CG 3.4Å; I66-M78 HydrophobicContact CD1-SD 3.56Å; I66-M78 VanDerWaalsContact CD1-SD 3.56Å; I66-M78 HydrophobicContact CG1-CG 4.24Å; P74-M78 VanDerWaalsContact O-CG 3.25Å; P74-M78 WeakPolarHBondContact O-CG 3.45Å; P74-M78 PolarHBondContact O-N 3.05Å; I75-M78 WeakPolarHBondContact O-CB 3.24Å; I75-M78 PolarHBondContact O-N 3.3Å; Q76-M78 VanDerWaalsContact C-N 3.29Å; Q76-M78 PolarHBondContact O-N 3.13Å; M78-D80 VanDerWaalsContact C-N 3.31Å; M78-D80 PolarHBondContact O-N 3.5Å; M78-H81 PolarHBondContact O-N 2.79Å; M78-V82 WeakPolarHBondContact O-CG2 3.13Å; M78-V82 PolarHBondContact O-N 2.94Å
79	I	91.9	Very high	84.9	Confident	101 Å²	101	91.2 Å²	91.2	52%	0.518	45%	0.445	S	S	.	.	H	α-helix	trans	-57.2	-46.5	179.9	-68	166.2	0	0	0	110.6	I75 Q76 Y77 H81	I75-I79 HydrophobicContact CG2-CD1 4.25Å; I75-I79 WeakPolarHBondContact O-CG1 3.32Å; I75-I79 PolarHBondContact O-N 2.92Å; I75-I79 VanDerWaalsContact O-N 3.08Å; Q76-I79 PolarHBondContact O-N 2.94Å; Q76-I79 VanDerWaalsContact O-N 3.12Å; Y77-I79 PolarHBondContact O-N 3.28Å; I79-H81 VanDerWaalsContact C-N 3.28Å; I79-H81 PolarHBondContact O-N 3.18Å
80	D	89.7	Confident	82.9	Confident	87 Å²	87	95 Å²	95	47%	0.465	47%	0.47	S	S	.	.	H	α-helix	trans	-69.5	-24.3	-177.4	-62.2	-17.4	0	0	0	113.1	Q76 Y77 M78 N84	Q76-D80 PolarHBondContact NE2-OD1 2.56Å; Q76-D80 VanDerWaalsContact O-CG 3.31Å; Q76-D80 PolarHBondContact O-N 2.92Å; Y77-D80 PolarHBondContact O-N 3.11Å; M78-D80 VanDerWaalsContact C-N 3.31Å; M78-D80 PolarHBondContact O-N 3.5Å; D80-N84 PolarHBondContact O-ND2 3.1Å; D80-N84 VanDerWaalsContact O-ND2 3.16Å
81	H	84.6	Confident	82.2	Confident	53 Å²	53	92 Å²	92	25%	0.245	46%	0.457	C	S	.	.	H	α-helix	trans	-103.7	-20.3	-173	-68.3	76	0	0	0	114.3	L62 E65 Y77 M78 I79 E83 N84 I85	L62-H81 HydrophobicContact CD2-CB 4.45Å; E65-H81 IonicContact OE2-CD2 3.95Å; Y77-H81 AromaticContact CD1-ND1 3.77Å; Y77-H81 AromaticContact CD2-CE1 3.52Å; Y77-H81 AromaticContact CD2-ND1 3.82Å; Y77-H81 HydrophobicContact CE1-CB 4.29Å; Y77-H81 AromaticContact CE1-CE1 3.98Å; Y77-H81 AromaticContact CE1-CG 3.76Å; Y77-H81 AromaticContact CE1-ND1 3.69Å; Y77-H81 AromaticContact CE2-CE1 3.25Å; Y77-H81 WeakPolarHBondContact CE2-CE1 3.25Å; Y77-H81 AromaticContact CE2-ND1 3.78Å; Y77-H81 AromaticContact CE2-NE2 3.59Å; Y77-H81 AromaticContact CG-CE1 4Å; Y77-H81 AromaticContact CG-ND1 3.81Å; Y77-H81 AromaticContact CZ-CD2 3.72Å; Y77-H81 AromaticContact CZ-CE1 3.47Å; Y77-H81 VanDerWaalsContact CZ-CE1 3.47Å; Y77-H81 AromaticContact CZ-CG 3.84Å; Y77-H81 AromaticContact CZ-ND1 3.68Å; Y77-H81 AromaticContact CZ-NE2 3.51Å; Y77-H81 WeakPolarHBondContact O-CB 3.28Å; Y77-H81 PolarHBondContact O-N 3.09Å; Y77-H81 VanDerWaalsContact O-N 3.15Å; Y77-H81 PolarHBondContact O-ND1 3.02Å; Y77-H81 PolarHBondContact OH-NE2 3.3Å; M78-H81 PolarHBondContact O-N 2.79Å; I79-H81 VanDerWaalsContact C-N 3.28Å; I79-H81 PolarHBondContact O-N 3.18Å; H81-E83 VanDerWaalsContact C-N 3.31Å; H81-E83 PolarHBondContact O-N 3.47Å; H81-N84 PolarHBondContact O-N 2.76Å; H81-I85 HydrophobicContact CB-CD1 4.16Å; H81-I85 WeakPolarHBondContact O-CG1 3.32Å; H81-I85 PolarHBondContact O-N 2.64Å
82	V	83.7	Confident	81.5	Confident	58 Å²	58	95.2 Å²	95.2	35%	0.352	47%	0.471	S	S	.	.	H	α-helix	trans	-56.4	-42.8	-178.4	163.3	0	0	0	0	112.3	L62 M78 I85 R86	L62-V82 HydrophobicContact CD1-CG2 3.79Å; L62-V82 HydrophobicContact CD2-CG2 4.19Å; M78-V82 WeakPolarHBondContact O-CG2 3.13Å; M78-V82 PolarHBondContact O-N 2.94Å; V82-I85 PolarHBondContact O-N 2.97Å; V82-R86 PolarHBondContact O-N 2.77Å; V82-R86 VanDerWaalsContact O-N 3.15Å
83	E	76.5	Confident	80.6	Confident	137 Å²	137	90.6 Å²	90.6	64%	0.64	44%	0.444	S	S	*	.	H	α-helix	trans	-66.2	-44	179.1	-63.4	-170.8	156.5	0	0	111.9	H81 I85 R86	H81-E83 VanDerWaalsContact C-N 3.31Å; H81-E83 PolarHBondContact O-N 3.47Å; E83-I85 VanDerWaalsContact C-N 3.25Å; E83-I85 PolarHBondContact O-N 3.26Å; E83-R86 WeakPolarHBondContact O-CB 3.49Å; E83-R86 PolarHBondContact O-N 3.38Å
84	N	73.8	Confident	79.6	Confident	100 Å²	100	90.8 Å²	90.8	54%	0.535	44%	0.443	S	S	.	.	H	α-helix	trans	-66.4	-27.3	178.5	-70	-50	0	0	0	112.9	D80 H81	D80-N84 PolarHBondContact O-ND2 3.1Å; D80-N84 VanDerWaalsContact O-ND2 3.16Å; H81-N84 PolarHBondContact O-N 2.76Å
85	I	68.7	Low	78.6	Confident	3 Å²	3	93.2 Å²	93.2	2%	0.015	45%	0.449	C	S	.	.	H	α-helix	trans	-79.8	-36.7	178.7	-66.4	167.5	0	0	0	111.3	L58 K61 L62 H81 V82 E83 D87 R88 I89	L58-I85 HydrophobicContact CD1-CB 3.78Å; L58-I85 HydrophobicContact CD1-CD1 4.47Å; L58-I85 HydrophobicContact CD1-CG2 3.36Å; K61-I85 HydrophobicContact CB-CG2 4.47Å; K61-I85 HydrophobicContact CD-CD1 4.48Å; K61-I85 HydrophobicContact CD-CG1 4.19Å; K61-I85 HydrophobicContact CD-CG2 3.72Å; K61-I85 HydrophobicContact CG-CD1 4.29Å; K61-I85 HydrophobicContact CG-CG2 4.35Å; L62-I85 HydrophobicContact CD2-CD1 3.36Å; L62-I85 HydrophobicContact CG-CD1 3.7Å; H81-I85 HydrophobicContact CB-CD1 4.16Å; H81-I85 WeakPolarHBondContact O-CG1 3.32Å; H81-I85 PolarHBondContact O-N 2.64Å; V82-I85 PolarHBondContact O-N 2.97Å; E83-I85 VanDerWaalsContact C-N 3.25Å; E83-I85 PolarHBondContact O-N 3.26Å; I85-D87 VanDerWaalsContact C-N 3.26Å; I85-D87 PolarHBondContact O-N 3Å; I85-R88 PolarHBondContact O-N 2.79Å; I85-I89 HydrophobicContact CG2-CD1 3.45Å; I85-I89 VanDerWaalsContact CG2-CD1 3.45Å; I85-I89 HydrophobicContact CG2-CG1 4.11Å; I85-I89 WeakPolarHBondContact O-CG1 3.36Å; I85-I89 PolarHBondContact O-N 2.66Å
86	R	67	Low	77.6	Confident	146 Å²	146	91.9 Å²	91.9	55%	0.551	44%	0.44	S	S	*	.	H	α-helix	trans	-52.7	-47.2	176.2	-176.3	-166.8	65.9	-154.5	-6.9	111	V82 E83 R88 I89	V82-R86 PolarHBondContact O-N 2.77Å; V82-R86 VanDerWaalsContact O-N 3.15Å; E83-R86 WeakPolarHBondContact O-CB 3.49Å; E83-R86 PolarHBondContact O-N 3.38Å; R86-R88 PolarHBondContact O-N 2.99Å; R86-I89 PolarHBondContact O-N 2.69Å; R86-I89 VanDerWaalsContact O-N 3.13Å
87	D	67.8	Low	76.4	Confident	107 Å²	107	92.4 Å²	92.4	57%	0.572	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-2.7	-177	-59.5	-8.1	0	0	0	113.7	I85	I85-D87 VanDerWaalsContact C-N 3.26Å; I85-D87 PolarHBondContact O-N 3Å
88	R	64.2	Low	75	Confident	182 Å²	182	97 Å²	97	69%	0.687	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.8	0.4	177.8	-66.5	179.3	168.9	-174.6	0.4	113.5	I85 R86	I85-R88 PolarHBondContact O-N 2.79Å; R86-R88 PolarHBondContact O-N 2.99Å
89	I	62.2	Low	73.7	Confident	28 Å²	28	100.2 Å²	100.2	14%	0.144	48%	0.483	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-24.8	-176.9	-72.7	178.1	0	0	0	112.4	R57 L58 I85 R86	R57-I89 HydrophobicContact CB-CD1 4.43Å; R57-I89 HydrophobicContact CG-CD1 4.24Å; R57-I89 HydrophobicContact CG-CG1 4.37Å; R57-I89 PolarHBondContact NH1-O 3.15Å; L58-I89 VanDerWaalsContact CA-CD1 3.46Å; L58-I89 HydrophobicContact CB-CD1 3.8Å; L58-I89 HydrophobicContact CD1-CD1 4.36Å; I85-I89 HydrophobicContact CG2-CD1 3.45Å; I85-I89 VanDerWaalsContact CG2-CD1 3.45Å; I85-I89 HydrophobicContact CG2-CG1 4.11Å; I85-I89 WeakPolarHBondContact O-CG1 3.36Å; I85-I89 PolarHBondContact O-N 2.66Å; R86-I89 PolarHBondContact O-N 2.69Å; R86-I89 VanDerWaalsContact O-N 3.13Å
90	D	53.8	Low	72	Confident	200 Å²	200	100.1 Å²	100.1	100%	1.07	48%	0.48	S	S	*	.			trans	-80.7	0	165.8	-64.3	-29.7	0	0	0	111.9

Retrieved 90 of 90 residues in 40.4 ms (Link to these results)

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