A0A077ZCM5_TRITR Loading...

Cyclin dependent kinase 2 associated protein 2

AlphaFold DB , UniProt , Accession A0A077ZCM5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 91 aa.

						>A0A077ZCM5_TRITR|A0A077ZCM5
MSNGGSVSNSKNQSSKDTASVPQYSIPTAQPQSKYSQLLAVIEELGKDIRPTYSGNKMSAERLKRSIIHARILVRECILETERAAGRGGQL
					

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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	53.8	Low	55	Low	235 Å²	235	132.6 Å²	132.6	100%	1.158	84%	0.836	S	S	*	*				0	76.4	0	-57.5	159.9	94.4	0	0	105.2
2	S	57.3	Low	54.6	Low	110 Å²	110	134.6 Å²	134.6	77%	0.769	84%	0.836	S	S	*	*				58.4	126.1	75.9	-36.9	0	0	0	0	111
3	N	57.9	Low	54.3	Low	165 Å²	165	136.9 Å²	136.9	88%	0.882	83%	0.831	S	S	*	*			cis	-160	142	-3.4	-98.3	-10.8	0	0	0	103.9
4	G	48.9	Very low	54.4	Low	77 Å²	77	134.6 Å²	134.6	79%	0.794	82%	0.823	S	S	*	*				107.8	87.2	75.2	0	0	0	0	0	110.2
5	G	51	Low	54.1	Low	81 Å²	81	132.9 Å²	132.9	84%	0.835	82%	0.82	S	S	*	*			trans	-108.6	102.1	169.9	0	0	0	0	0	109.6
6	S	60.7	Low	54.3	Low	118 Å²	118	135.6 Å²	135.6	83%	0.825	82%	0.816	S	S	*	*			trans	-94.6	120.9	174.1	-68	0	0	0	0	110.1
7	V	56.8	Low	54.6	Low	138 Å²	138	137.8 Å²	137.8	84%	0.836	82%	0.823	S	S	*	*			trans	-74.7	134	168.8	174.7	0	0	0	0	108.5
8	S	62.8	Low	55.3	Low	115 Å²	115	136.5 Å²	136.5	80%	0.804	82%	0.816	S	S	*	*			trans	-136.2	104	167.6	-57.6	0	0	0	0	109.6
9	N	51.1	Low	55.8	Low	137 Å²	137	134.8 Å²	134.8	73%	0.733	82%	0.818	S	S	*	*			trans	-72.6	132	171.3	-177.2	41.1	0	0	0	109.3
10	S	54.7	Low	56.5	Low	123 Å²	123	133.9 Å²	133.9	86%	0.86	82%	0.818	S	S	*	*			trans	-135.6	98.3	162.2	-87.4	0	0	0	0	109.9
11	K	50.3	Low	57.4	Low	160 Å²	160	132.9 Å²	132.9	70%	0.696	81%	0.812	S	S	*	*			trans	-70	119.7	168.9	-159	176.7	-168.2	177.6	0	107.3
12	N	49.7	Very low	58.4	Low	156 Å²	156	127.3 Å²	127.3	83%	0.834	79%	0.793	S	S	*	*			trans	-132.7	90.8	161.7	-149.2	21.4	0	0	0	109.1
13	Q	51.5	Low	58.9	Low	165 Å²	165	130.9 Å²	130.9	77%	0.771	80%	0.797	S	S	*	*			trans	-79.5	117	163.2	-74.1	173.2	-20.4	0	0	107
14	S	54.8	Low	59.4	Low	104 Å²	104	133.3 Å²	133.3	73%	0.727	80%	0.796	S	S	*	*			trans	-144.1	107.5	163.2	-171.1	0	0	0	0	108.9
15	S	49.8	Very low	60.5	Low	110 Å²	110	134.6 Å²	134.6	77%	0.769	79%	0.792	S	S	*	*			trans	-63.5	124.6	178.8	-45.2	0	0	0	0	111.3
16	K	57.8	Low	61.5	Low	176 Å²	176	137.6 Å²	137.6	77%	0.765	79%	0.788	S	S	*	*			trans	-151.9	92	152	-73.1	-167.4	179.4	164.4	0	108.9	T18	K16-T18 PolarHBondContact O-N 3.26Å
17	D	58.7	Low	61.6	Low	173 Å²	173	137.2 Å²	137.2	93%	0.925	78%	0.783	S	S	*	*			trans	-67.1	76	160.3	-69	-73.2	0	0	0	108.9
18	T	67.2	Low	61.5	Low	114 Å²	114	136.3 Å²	136.3	70%	0.699	78%	0.778	S	S	*	*			trans	-102.4	109.8	164.7	30	0	0	0	0	107.5	K16 S20	K16-T18 PolarHBondContact O-N 3.26Å; T18-S20 PolarHBondContact O-N 3.3Å
19	A	66.3	Low	61.5	Low	104 Å²	104	134.9 Å²	134.9	86%	0.86	77%	0.773	S	S	*	*			trans	-55.4	112.2	172.4	0	0	0	0	0	109.7	V21	A19-V21 PolarHBondContact O-N 3.36Å
20	S	69.5	Low	61.8	Low	117 Å²	117	135.5 Å²	135.5	82%	0.818	77%	0.772	S	S	*	*			trans	-75.2	112.7	174.9	-179.6	0	0	0	0	108.9	T18	T18-S20 PolarHBondContact O-N 3.3Å
21	V	74.7	Confident	62.3	Low	113 Å²	113	135.4 Å²	135.4	69%	0.685	77%	0.768	S	S	*	*			trans	-67.6	138.1	166.9	-74.2	0	0	0	0	109	A19 Q23	A19-V21 PolarHBondContact O-N 3.36Å; V21-Q23 PolarHBondContact O-N 2.84Å
22	P	75.7	Confident	63.3	Low	117 Å²	117	133.1 Å²	133.1	76%	0.76	76%	0.76	S	S	*	*			trans	-60.6	104	172.9	-18.3	29.7	0	0	0	109.7	Y24	P22-Y24 PolarHBondContact O-N 3.16Å
23	Q	67.3	Low	65	Low	185 Å²	185	128.5 Å²	128.5	86%	0.864	74%	0.74	S	S	*	*			trans	-69	99.3	166.7	-96.1	179.5	-75.3	0	0	107.9	V21 S25	V21-Q23 PolarHBondContact O-N 2.84Å; Q23-S25 VanDerWaalsContact C-N 3.3Å; Q23-S25 PolarHBondContact O-N 3.27Å
24	Y	68.8	Low	66.7	Low	216 Å²	216	123.5 Å²	123.5	85%	0.847	72%	0.715	S	S	*	*			trans	-66.8	95.1	158.7	-101.2	-97	0	0	0	107.4	P22 I26	P22-Y24 PolarHBondContact O-N 3.16Å; Y24-I26 PolarHBondContact O-N 3.3Å; Y24-I26 VanDerWaalsContact O-N 3.07Å
25	S	70.8	Confident	68.3	Low	104 Å²	104	126.1 Å²	126.1	73%	0.727	71%	0.711	S	S	*	*			trans	-68	103.2	162.8	51.9	0	0	0	0	107.1	Q23 P27	Q23-S25 VanDerWaalsContact C-N 3.3Å; Q23-S25 PolarHBondContact O-N 3.27Å; S25-P27 VanDerWaalsContact O-CD 3.26Å; S25-P27 WeakPolarHBondContact O-CD 3.24Å
26	I	72	Confident	70.2	Confident	144 Å²	144	123.3 Å²	123.3	74%	0.738	69%	0.691	S	S	*	*			trans	-61.6	117.7	163.7	-46.2	172.9	0	0	0	104.6	Y24 T28	Y24-I26 PolarHBondContact O-N 3.3Å; Y24-I26 VanDerWaalsContact O-N 3.07Å; I26-T28 PolarHBondContact O-N 3.04Å
27	P	63	Low	71.9	Confident	111 Å²	111	118 Å²	118	72%	0.721	67%	0.669	S	S	*	*			trans	-58.4	110.2	169.4	23.3	-29.2	0	0	0	105.7	S25 A29	S25-P27 VanDerWaalsContact O-CD 3.26Å; S25-P27 WeakPolarHBondContact O-CD 3.24Å; P27-A29 PolarHBondContact O-N 3.41Å
28	T	56	Low	73.5	Confident	118 Å²	118	111.7 Å²	111.7	72%	0.724	63%	0.634	S	S	*	*			trans	-64.6	86.6	165.5	53.6	0	0	0	0	104.6	I26 Q30	I26-T28 PolarHBondContact O-N 3.04Å; T28-Q30 VanDerWaalsContact C-N 3.29Å; T28-Q30 PolarHBondContact O-N 3.38Å
29	A	61.2	Low	74.8	Confident	86 Å²	86	109.2 Å²	109.2	71%	0.711	62%	0.617	S	S	*	*			trans	-56.3	105.3	169	0	0	0	0	0	104.4	P27	P27-A29 PolarHBondContact O-N 3.41Å
30	Q	59.1	Low	76.1	Confident	150 Å²	150	106.1 Å²	106.1	70%	0.701	59%	0.591	S	S	*	*			trans	-44.9	132.1	172.1	-74.6	-70.6	-40.7	0	0	106.5	T28 Q32	T28-Q30 VanDerWaalsContact C-N 3.29Å; T28-Q30 PolarHBondContact O-N 3.38Å; Q30-Q32 PolarHBondContact O-N 3.47Å
31	P	64.4	Low	77.3	Confident	120 Å²	120	101.1 Å²	101.1	78%	0.779	56%	0.555	S	S	*	*			trans	-50	109	-179.5	18.5	-29.6	0	0	0	107.1	S33	P31-S33 PolarHBondContact O-N 3.03Å; P31-S33 VanDerWaalsContact O-N 3.12Å
32	Q	70.9	Confident	78.3	Confident	112 Å²	112	100.3 Å²	100.3	52%	0.523	55%	0.546	S	S	.	.			trans	-58.9	126.6	-173.9	-77.9	-174.8	-31.8	0	0	106	Q30 Q37	Q30-Q32 PolarHBondContact O-N 3.47Å; Q32-Q37 HydrophobicContact CB-CG 3.67Å; Q32-Q37 PolarHBondContact O-NE2 3.24Å
33	S	85.2	Confident	79.2	Confident	60 Å²	60	100.6 Å²	100.6	42%	0.42	54%	0.538	S	S	.	.			trans	-52.2	150.2	175.6	74.1	0	0	0	0	109.2	P31 Y35 S36 Q37	P31-S33 PolarHBondContact O-N 3.03Å; P31-S33 VanDerWaalsContact O-N 3.12Å; S33-Y35 PolarHBondContact O-N 3.49Å; S33-Y35 VanDerWaalsContact O-N 3.09Å; S33-S36 WeakPolarHBondContact O-CA 3.43Å; S33-S36 WeakPolarHBondContact O-CB 3.3Å; S33-S36 PolarHBondContact O-N 2.85Å; S33-S36 WeakPolarHBondContact OG-CB 3.45Å; S33-S36 PolarHBondContact OG-N 2.91Å; S33-S36 PolarHBondContact OG-OG 3.37Å; S33-Q37 PolarHBondContact O-N 3Å
34	K	86.6	Confident	80.5	Confident	59 Å²	59	95.7 Å²	95.7	26%	0.257	52%	0.515	S	S	.	.	H	α-helix	trans	-51.8	-37.2	176.4	-71.5	-173.3	-179.8	163.3	0	111.4	Q37 L38 L73 E76 C77 E80	K34-Q37 PolarHBondContact O-N 2.92Å; K34-L38 WeakPolarHBondContact O-CB 3.41Å; K34-L38 PolarHBondContact O-N 3.45Å; K34-L73 HydrophobicContact CB-CD2 4.3Å; K34-L73 WeakPolarHBondContact O-CD2 3.22Å; K34-E76 HydrophobicContact CD-CB 4.44Å; K34-E76 PolarHBondContact NZ-O 3.35Å; K34-C77 HydrophobicContact CD-CB 4.41Å; K34-E80 WeakPolarHBondContact CD-OE2 3.24Å; K34-E80 WeakPolarHBondContact CE-OE2 3.24Å; K34-E80 IonicContact NZ-OE2 2.63Å; K34-E80 PolarHBondContact NZ-OE2 3.1Å
35	Y	88.4	Confident	81.8	Confident	160 Å²	160	86.9 Å²	86.9	63%	0.627	48%	0.482	S	S	*	.	H	α-helix	trans	-60.4	-48.7	173.2	-176.8	-104.3	0	0	0	112.9	S33 Q37 L38 L39	S33-Y35 PolarHBondContact O-N 3.49Å; S33-Y35 VanDerWaalsContact O-N 3.09Å; Y35-Q37 VanDerWaalsContact C-N 3.31Å; Y35-Q37 PolarHBondContact O-N 3.47Å; Y35-L38 WeakPolarHBondContact O-CB 3.34Å; Y35-L38 PolarHBondContact O-N 2.63Å; Y35-L38 VanDerWaalsContact O-N 3.14Å; Y35-L39 HydrophobicContact CD1-CD1 3.85Å; Y35-L39 HydrophobicContact CD2-CD1 3.88Å; Y35-L39 HydrophobicContact CE1-CD1 3.47Å; Y35-L39 VanDerWaalsContact CE1-CD1 3.47Å; Y35-L39 HydrophobicContact CE1-CD2 3.92Å; Y35-L39 HydrophobicContact CE1-CG 4.36Å; Y35-L39 HydrophobicContact CE2-CD1 3.49Å; Y35-L39 VanDerWaalsContact CE2-CD1 3.49Å; Y35-L39 HydrophobicContact CG-CD1 4.05Å; Y35-L39 VanDerWaalsContact O-CD1 3.24Å; Y35-L39 WeakPolarHBondContact O-CD1 3.38Å; Y35-L39 PolarHBondContact O-N 2.86Å
36	S	91.1	Very high	83	Confident	50 Å²	50	84.1 Å²	84.1	35%	0.35	47%	0.47	S	S	.	.	H	α-helix	trans	-59.6	-41.4	176.3	-55.8	0	0	0	0	112.3	S33 L39 A40	S33-S36 WeakPolarHBondContact O-CA 3.43Å; S33-S36 WeakPolarHBondContact O-CB 3.3Å; S33-S36 PolarHBondContact O-N 2.85Å; S33-S36 WeakPolarHBondContact OG-CB 3.45Å; S33-S36 PolarHBondContact OG-N 2.91Å; S33-S36 PolarHBondContact OG-OG 3.37Å; S36-L39 PolarHBondContact O-N 3.27Å; S36-A40 PolarHBondContact O-N 3.07Å
37	Q	92.4	Very high	84.1	Confident	66 Å²	66	83.3 Å²	83.3	31%	0.308	46%	0.461	S	S	.	.	H	α-helix	trans	-64.4	-41.3	175.1	-66	-180	35.8	0	0	111.3	Q32 S33 K34 Y35 A40 V41 L73	Q32-Q37 HydrophobicContact CB-CG 3.67Å; Q32-Q37 PolarHBondContact O-NE2 3.24Å; S33-Q37 PolarHBondContact O-N 3Å; K34-Q37 PolarHBondContact O-N 2.92Å; Y35-Q37 VanDerWaalsContact C-N 3.31Å; Y35-Q37 PolarHBondContact O-N 3.47Å; Q37-A40 PolarHBondContact O-N 3.21Å; Q37-V41 WeakPolarHBondContact O-CG2 3.32Å; Q37-V41 PolarHBondContact O-N 2.89Å; Q37-L73 HydrophobicContact CB-CD1 3.47Å; Q37-L73 VanDerWaalsContact CB-CD1 3.47Å
38	L	93.1	Very high	85.7	Confident	39 Å²	39	78.6 Å²	78.6	20%	0.204	43%	0.43	C	S	.	.	H	α-helix	trans	-61.4	-44.6	175.9	-172.8	57.4	0	0	0	111.7	K34 Y35 V41 I42 A70 L73 V74	K34-L38 WeakPolarHBondContact O-CB 3.41Å; K34-L38 PolarHBondContact O-N 3.45Å; Y35-L38 WeakPolarHBondContact O-CB 3.34Å; Y35-L38 PolarHBondContact O-N 2.63Å; Y35-L38 VanDerWaalsContact O-N 3.14Å; L38-V41 PolarHBondContact O-N 2.97Å; L38-I42 HydrophobicContact CD1-CD1 4.44Å; L38-I42 HydrophobicContact CG-CD1 4.05Å; L38-I42 VanDerWaalsContact O-CG1 3.31Å; L38-I42 WeakPolarHBondContact O-CG1 3.35Å; L38-I42 PolarHBondContact O-N 3.05Å; L38-A70 HydrophobicContact CD1-CB 4.4Å; L38-L73 HydrophobicContact CB-CD2 3.76Å; L38-L73 HydrophobicContact CD1-CD2 4.19Å; L38-L73 HydrophobicContact CG-CD2 4.4Å; L38-V74 HydrophobicContact CD1-CG2 4.03Å; L38-V74 HydrophobicContact CD2-CG2 4.31Å
39	L	94.1	Very high	87.6	Confident	63 Å²	63	76.5 Å²	76.5	33%	0.33	41%	0.413	S	S	.	.	H	α-helix	trans	-59.2	-47.2	176.4	-96.6	70.3	0	0	0	111.2	Y35 S36 V41 I42 E43	Y35-L39 HydrophobicContact CD1-CD1 3.85Å; Y35-L39 HydrophobicContact CD2-CD1 3.88Å; Y35-L39 HydrophobicContact CE1-CD1 3.47Å; Y35-L39 VanDerWaalsContact CE1-CD1 3.47Å; Y35-L39 HydrophobicContact CE1-CD2 3.92Å; Y35-L39 HydrophobicContact CE1-CG 4.36Å; Y35-L39 HydrophobicContact CE2-CD1 3.49Å; Y35-L39 VanDerWaalsContact CE2-CD1 3.49Å; Y35-L39 HydrophobicContact CG-CD1 4.05Å; Y35-L39 VanDerWaalsContact O-CD1 3.24Å; Y35-L39 WeakPolarHBondContact O-CD1 3.38Å; Y35-L39 PolarHBondContact O-N 2.86Å; S36-L39 PolarHBondContact O-N 3.27Å; L39-V41 VanDerWaalsContact C-N 3.3Å; L39-V41 PolarHBondContact O-N 3.42Å; L39-I42 PolarHBondContact O-N 3.01Å; L39-I42 VanDerWaalsContact O-N 3.12Å; L39-E43 WeakPolarHBondContact O-CG 3.47Å; L39-E43 PolarHBondContact O-N 2.82Å
40	A	94	Very high	89.3	Confident	39 Å²	39	82.6 Å²	82.6	32%	0.322	42%	0.418	S	S	.	.	H	α-helix	trans	-58.7	-42.2	177.6	0	0	0	0	0	111.8	S36 Q37 I42 E43 E44	S36-A40 PolarHBondContact O-N 3.07Å; Q37-A40 PolarHBondContact O-N 3.21Å; A40-I42 PolarHBondContact O-N 3.12Å; A40-E43 PolarHBondContact O-N 3.39Å; A40-E44 WeakPolarHBondContact O-CG 3.33Å; A40-E44 PolarHBondContact O-N 3.21Å; A40-E44 VanDerWaalsContact O-N 3.1Å
41	V	95	Very high	91.1	Very high	11 Å²	11	77.5 Å²	77.5	7%	0.067	40%	0.398	C	S	.	.	H	α-helix	trans	-63.7	-41.6	176.3	176.2	0	0	0	0	111.4	Q37 L38 L39 E43 E44 L45 S66 A70	Q37-V41 WeakPolarHBondContact O-CG2 3.32Å; Q37-V41 PolarHBondContact O-N 2.89Å; L38-V41 PolarHBondContact O-N 2.97Å; L39-V41 VanDerWaalsContact C-N 3.3Å; L39-V41 PolarHBondContact O-N 3.42Å; V41-E43 VanDerWaalsContact C-N 3.35Å; V41-E43 PolarHBondContact O-N 2.94Å; V41-E44 PolarHBondContact O-N 2.81Å; V41-L45 HydrophobicContact CG1-CD1 4.33Å; V41-L45 HydrophobicContact CG1-CG 4.43Å; V41-L45 VanDerWaalsContact O-CG 3.27Å; V41-L45 WeakPolarHBondContact O-CG 3.33Å; V41-L45 PolarHBondContact O-N 3.23Å; V41-S66 VanDerWaalsContact CG1-O 3.3Å; V41-S66 WeakPolarHBondContact CG1-O 3.42Å; V41-A70 HydrophobicContact CG1-CB 3.8Å
42	I	95.2	Very high	92.6	Very high	96 Å²	96	73.5 Å²	73.5	49%	0.492	37%	0.371	S	S	.	.	H	α-helix	trans	-62.5	-41.8	177.7	-68	164.9	0	0	0	111.2	L38 L39 A40 L45 G46	L38-I42 HydrophobicContact CD1-CD1 4.44Å; L38-I42 HydrophobicContact CG-CD1 4.05Å; L38-I42 VanDerWaalsContact O-CG1 3.31Å; L38-I42 WeakPolarHBondContact O-CG1 3.35Å; L38-I42 PolarHBondContact O-N 3.05Å; L39-I42 PolarHBondContact O-N 3.01Å; L39-I42 VanDerWaalsContact O-N 3.12Å; A40-I42 PolarHBondContact O-N 3.12Å; I42-L45 WeakPolarHBondContact O-CB 3.1Å; I42-L45 PolarHBondContact O-N 3.04Å; I42-G46 PolarHBondContact O-N 3.17Å; I42-G46 VanDerWaalsContact O-N 3.13Å
43	E	95.5	Very high	93.8	Very high	124 Å²	124	78 Å²	78	58%	0.579	39%	0.385	S	S	*	.	H	α-helix	trans	-61.4	-43.8	176	-71.7	178.3	-172.6	0	0	112.1	L39 A40 V41 G46 K47	L39-E43 WeakPolarHBondContact O-CG 3.47Å; L39-E43 PolarHBondContact O-N 2.82Å; A40-E43 PolarHBondContact O-N 3.39Å; V41-E43 VanDerWaalsContact C-N 3.35Å; V41-E43 PolarHBondContact O-N 2.94Å; E43-G46 PolarHBondContact O-N 3.48Å; E43-K47 PolarHBondContact O-N 3.29Å
44	E	93.8	Very high	94.3	Very high	82 Å²	82	79.8 Å²	79.8	38%	0.383	40%	0.398	S	S	.	.	H	α-helix	trans	-63.8	-41	176.5	-68.3	-59.3	113.2	0	0	112.1	A40 V41 G46 K47 D48	A40-E44 WeakPolarHBondContact O-CG 3.33Å; A40-E44 PolarHBondContact O-N 3.21Å; A40-E44 VanDerWaalsContact O-N 3.1Å; V41-E44 PolarHBondContact O-N 2.81Å; E44-G46 VanDerWaalsContact C-N 3.26Å; E44-G46 PolarHBondContact O-N 2.89Å; E44-K47 WeakPolarHBondContact O-CB 3.19Å; E44-K47 PolarHBondContact O-N 3.48Å; E44-K47 VanDerWaalsContact O-N 3.1Å; E44-K47 IonicContact OE1-NZ 3.74Å; E44-K47 PolarHBondContact OE1-NZ 3.46Å; E44-D48 PolarHBondContact O-N 3.05Å
45	L	95.8	Very high	94.7	Very high	30 Å²	30	79.7 Å²	79.7	16%	0.157	41%	0.413	C	S	.	.	H	α-helix	trans	-55.3	-44.5	173.8	-69.9	172.8	0	0	0	110.9	V41 I42 K47 D48 I49 L63 I67	V41-L45 HydrophobicContact CG1-CD1 4.33Å; V41-L45 HydrophobicContact CG1-CG 4.43Å; V41-L45 VanDerWaalsContact O-CG 3.27Å; V41-L45 WeakPolarHBondContact O-CG 3.33Å; V41-L45 PolarHBondContact O-N 3.23Å; I42-L45 WeakPolarHBondContact O-CB 3.1Å; I42-L45 PolarHBondContact O-N 3.04Å; L45-K47 VanDerWaalsContact C-N 3.25Å; L45-K47 PolarHBondContact O-N 2.97Å; L45-D48 PolarHBondContact O-N 2.91Å; L45-I49 VanDerWaalsContact O-CG1 3.24Å; L45-I49 WeakPolarHBondContact O-CG1 3.45Å; L45-I49 PolarHBondContact O-N 3.32Å; L45-I49 VanDerWaalsContact O-N 3.15Å; L45-L63 HydrophobicContact CB-CD1 4.45Å; L45-L63 HydrophobicContact CD2-CD1 3.54Å; L45-I67 HydrophobicContact CD2-CG1 3.69Å
46	G	95.9	Very high	95	Very high	46 Å²	46	75.4 Å²	75.4	47%	0.474	40%	0.401	S	S	.	.	H	α-helix	trans	-56	-36.5	177.4	0	0	0	0	0	114.1	I42 E43 E44	I42-G46 PolarHBondContact O-N 3.17Å; I42-G46 VanDerWaalsContact O-N 3.13Å; E43-G46 PolarHBondContact O-N 3.48Å; E44-G46 VanDerWaalsContact C-N 3.26Å; E44-G46 PolarHBondContact O-N 2.89Å
47	K	95.7	Very high	95.2	Very high	128 Å²	128	81.6 Å²	81.6	56%	0.557	42%	0.421	S	S	*	.	H	α-helix	trans	-71.2	-36.5	-179.4	-63.6	171.4	-171.6	170	0	112.4	E43 E44 L45 P51	E43-K47 PolarHBondContact O-N 3.29Å; E44-K47 WeakPolarHBondContact O-CB 3.19Å; E44-K47 PolarHBondContact O-N 3.48Å; E44-K47 VanDerWaalsContact O-N 3.1Å; E44-K47 IonicContact OE1-NZ 3.74Å; E44-K47 PolarHBondContact OE1-NZ 3.46Å; L45-K47 VanDerWaalsContact C-N 3.25Å; L45-K47 PolarHBondContact O-N 2.97Å; K47-P51 WeakPolarHBondContact O-CD 3.4Å
48	D	96.4	Very high	95.4	Very high	12 Å²	12	83.8 Å²	83.8	6%	0.064	43%	0.433	C	S	.	.	H	α-helix	trans	-89	-15.3	-176.5	-79.6	-48.1	0	0	0	114.2	E44 L45 P51 T52 S59 R62 L63	E44-D48 PolarHBondContact O-N 3.05Å; L45-D48 PolarHBondContact O-N 2.91Å; D48-P51 WeakPolarHBondContact O-CD 3.41Å; D48-T52 VanDerWaalsContact O-CB 3.24Å; D48-T52 WeakPolarHBondContact O-CB 3.47Å; D48-T52 PolarHBondContact O-N 2.84Å; D48-T52 PolarHBondContact O-OG1 3.37Å; D48-S59 WeakPolarHBondContact OD1-CA 3.45Å; D48-S59 WeakPolarHBondContact OD1-CB 3.38Å; D48-S59 PolarHBondContact OD1-OG 2.87Å; D48-R62 WeakPolarHBondContact OD2-CB 3.49Å; D48-L63 HydrophobicContact CB-CB 4.21Å; D48-L63 HydrophobicContact CB-CD1 4.49Å
49	I	96.4	Very high	95.5	Very high	73 Å²	73	82.3 Å²	82.3	37%	0.374	43%	0.426	S	S	.	.	H	α-helix	trans	-58.3	-55.4	180	-76.2	165.2	0	0	0	111.9	L45 T52 Y53 L63	L45-I49 VanDerWaalsContact O-CG1 3.24Å; L45-I49 WeakPolarHBondContact O-CG1 3.45Å; L45-I49 PolarHBondContact O-N 3.32Å; L45-I49 VanDerWaalsContact O-N 3.15Å; I49-T52 PolarHBondContact O-N 2.84Å; I49-Y53 HydrophobicContact CG2-CD2 3.91Å; I49-Y53 HydrophobicContact CG2-CE2 3.63Å; I49-Y53 WeakPolarHBondContact O-CD2 3.5Å; I49-Y53 PolarHBondContact O-N 2.82Å; I49-L63 HydrophobicContact CG1-CD1 4.18Å
50	R	95.6	Very high	95.6	Very high	215 Å²	215	80.8 Å²	80.8	81%	0.811	42%	0.423	S	S	*	.	H	α-helix	trans	-61.9	-50	-176.6	-77.5	-176.9	175.3	-123	1	112.6	T52 Y53 S54	R50-T52 PolarHBondContact O-N 2.76Å; R50-Y53 PolarHBondContact O-N 2.89Å; R50-S54 PolarHBondContact O-N 3.09Å
51	P	96.5	Very high	95.8	Very high	42 Å²	42	83 Å²	83	27%	0.273	43%	0.426	S	S	.	.	H	α-helix	trans	-64.4	-26.4	176.9	-22.6	34.4	0	0	0	113.9	K47 D48 S54 N56 S59	K47-P51 WeakPolarHBondContact O-CD 3.4Å; D48-P51 WeakPolarHBondContact O-CD 3.41Å; P51-S54 WeakPolarHBondContact CA-OG 3.31Å; P51-S54 PolarHBondContact O-N 2.74Å; P51-S54 PolarHBondContact O-OG 3.03Å; P51-N56 HydrophobicContact CB-CB 4.13Å; P51-N56 WeakPolarHBondContact O-CB 3.41Å; P51-N56 PolarHBondContact O-N 3.06Å; P51-S59 WeakPolarHBondContact CB-OG 3.46Å
52	T	96.6	Very high	95.9	Very high	36 Å²	36	89 Å²	89	22%	0.221	45%	0.448	C	S	.	.	H	α-helix	trans	-67.3	-42.4	175	-62.4	0	0	0	0	111.2	D48 I49 R50 S54 G55 A60 L63	D48-T52 VanDerWaalsContact O-CB 3.24Å; D48-T52 WeakPolarHBondContact O-CB 3.47Å; D48-T52 PolarHBondContact O-N 2.84Å; D48-T52 PolarHBondContact O-OG1 3.37Å; I49-T52 PolarHBondContact O-N 2.84Å; R50-T52 PolarHBondContact O-N 2.76Å; T52-S54 PolarHBondContact O-N 2.93Å; T52-G55 PolarHBondContact O-N 3.4Å; T52-A60 HydrophobicContact CG2-CB 3.95Å; T52-A60 PolarHBondContact OG1-N 3.44Å; T52-L63 HydrophobicContact CG2-CD2 3.9Å
53	Y	96.2	Very high	95.9	Very high	207 Å²	207	85.9 Å²	85.9	81%	0.812	43%	0.432	S	S	*	.	H	α-helix	trans	-64	-26.5	176.1	-77.6	-66.8	0	0	0	113.3	I49 R50 G55	I49-Y53 HydrophobicContact CG2-CD2 3.91Å; I49-Y53 HydrophobicContact CG2-CE2 3.63Å; I49-Y53 WeakPolarHBondContact O-CD2 3.5Å; I49-Y53 PolarHBondContact O-N 2.82Å; R50-Y53 PolarHBondContact O-N 2.89Å; Y53-G55 VanDerWaalsContact C-N 3.25Å; Y53-G55 PolarHBondContact O-N 2.63Å
54	S	95.1	Very high	96	Very high	98 Å²	98	85.2 Å²	85.2	69%	0.685	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	7.1	173	63.1	0	0	0	0	114.2	R50 P51 T52	R50-S54 PolarHBondContact O-N 3.09Å; P51-S54 WeakPolarHBondContact CA-OG 3.31Å; P51-S54 PolarHBondContact O-N 2.74Å; P51-S54 PolarHBondContact O-OG 3.03Å; T52-S54 PolarHBondContact O-N 2.93Å
55	G	94.8	Very high	96.1	Very high	56 Å²	56	89.5 Å²	89.5	58%	0.577	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.6	15.2	175.1	0	0	0	0	0	115	T52 Y53 K57	T52-G55 PolarHBondContact O-N 3.4Å; Y53-G55 VanDerWaalsContact C-N 3.25Å; Y53-G55 PolarHBondContact O-N 2.63Å; G55-K57 PolarHBondContact O-N 3.1Å; G55-K57 VanDerWaalsContact O-N 3.09Å
56	N	95.8	Very high	96.1	Very high	70 Å²	70	89.2 Å²	89.2	37%	0.374	44%	0.44	S	S	.	.			trans	-70.1	107.4	177	-173.4	27.1	0	0	0	111.4	P51 M58 S59 A60	P51-N56 HydrophobicContact CB-CB 4.13Å; P51-N56 WeakPolarHBondContact O-CB 3.41Å; P51-N56 PolarHBondContact O-N 3.06Å; N56-M58 VanDerWaalsContact C-N 3.3Å; N56-M58 PolarHBondContact O-N 3.25Å; N56-S59 WeakPolarHBondContact ND2-CB 3.48Å; N56-S59 PolarHBondContact ND2-N 3.34Å; N56-S59 PolarHBondContact ND2-OG 3.12Å; N56-S59 PolarHBondContact O-N 2.9Å; N56-A60 PolarHBondContact O-N 3.42Å
57	K	95.9	Very high	96.2	Very high	180 Å²	180	91.4 Å²	91.4	78%	0.783	44%	0.44	S	S	*	.	H	α-helix	trans	-57.9	-39.9	-178.2	-63.7	-177.9	-178.5	175.2	0	112.8	G55 A60 E61	G55-K57 PolarHBondContact O-N 3.1Å; G55-K57 VanDerWaalsContact O-N 3.09Å; K57-A60 PolarHBondContact O-N 3.43Å; K57-E61 WeakPolarHBondContact O-CG 3.26Å; K57-E61 PolarHBondContact O-N 3.14Å
58	M	95.8	Very high	96.2	Very high	113 Å²	113	90.3 Å²	90.3	56%	0.557	44%	0.439	S	S	*	.	H	α-helix	trans	-66.2	-45.3	-179.3	-175.7	64.4	68.9	0	0	111.7	N56 A60 E61 R62	N56-M58 VanDerWaalsContact C-N 3.3Å; N56-M58 PolarHBondContact O-N 3.25Å; M58-A60 VanDerWaalsContact C-N 3.31Å; M58-A60 PolarHBondContact O-N 3.44Å; M58-E61 PolarHBondContact O-N 2.98Å; M58-R62 WeakPolarHBondContact O-CG 3.38Å; M58-R62 PolarHBondContact O-N 3.03Å
59	S	96.2	Very high	96.2	Very high	8 Å²	8	94.1 Å²	94.1	6%	0.056	46%	0.456	C	S	.	.	H	α-helix	trans	-64.1	-37.6	175.3	-71.8	0	0	0	0	111.8	D48 P51 N56 E61 R62 L63	D48-S59 WeakPolarHBondContact OD1-CA 3.45Å; D48-S59 WeakPolarHBondContact OD1-CB 3.38Å; D48-S59 PolarHBondContact OD1-OG 2.87Å; P51-S59 WeakPolarHBondContact CB-OG 3.46Å; N56-S59 WeakPolarHBondContact ND2-CB 3.48Å; N56-S59 PolarHBondContact ND2-N 3.34Å; N56-S59 PolarHBondContact ND2-OG 3.12Å; N56-S59 PolarHBondContact O-N 2.9Å; S59-E61 PolarHBondContact O-N 2.88Å; S59-R62 PolarHBondContact O-N 3.35Å; S59-L63 WeakPolarHBondContact O-CB 3.4Å; S59-L63 PolarHBondContact O-N 2.92Å
60	A	96.3	Very high	96.2	Very high	31 Å²	31	91.4 Å²	91.4	26%	0.256	45%	0.445	S	S	.	.	H	α-helix	trans	-62	-42.6	175.4	0	0	0	0	0	112.3	T52 N56 K57 M58 K64	T52-A60 HydrophobicContact CG2-CB 3.95Å; T52-A60 PolarHBondContact OG1-N 3.44Å; N56-A60 PolarHBondContact O-N 3.42Å; K57-A60 PolarHBondContact O-N 3.43Å; M58-A60 VanDerWaalsContact C-N 3.31Å; M58-A60 PolarHBondContact O-N 3.44Å; A60-K64 WeakPolarHBondContact O-CG 3.45Å; A60-K64 PolarHBondContact O-N 3.37Å
61	E	96.9	Very high	96.3	Very high	84 Å²	84	88.7 Å²	88.7	39%	0.393	43%	0.434	S	S	.	.	H	α-helix	trans	-63.3	-45.1	174.6	-71.7	-58.5	118	0	0	112.1	K57 M58 S59 K64 R65	K57-E61 WeakPolarHBondContact O-CG 3.26Å; K57-E61 PolarHBondContact O-N 3.14Å; M58-E61 PolarHBondContact O-N 2.98Å; S59-E61 PolarHBondContact O-N 2.88Å; E61-K64 PolarHBondContact O-N 2.88Å; E61-K64 WeakPolarHBondContact OE1-CE 3.11Å; E61-K64 IonicContact OE1-NZ 2.63Å; E61-K64 PolarHBondContact OE1-NZ 3Å; E61-K64 IonicContact OE2-NZ 2.65Å; E61-R65 WeakPolarHBondContact O-CG 3.4Å; E61-R65 PolarHBondContact O-N 3.3Å
62	R	96.7	Very high	96.2	Very high	138 Å²	138	90.5 Å²	90.5	52%	0.521	44%	0.441	S	S	.	.	H	α-helix	trans	-61.7	-46	176.9	-71.9	176.7	177.7	-164	-2.8	111.6	D48 M58 S59 K64 R65 S66	D48-R62 WeakPolarHBondContact OD2-CB 3.49Å; M58-R62 WeakPolarHBondContact O-CG 3.38Å; M58-R62 PolarHBondContact O-N 3.03Å; S59-R62 PolarHBondContact O-N 3.35Å; R62-K64 VanDerWaalsContact C-N 3.35Å; R62-K64 PolarHBondContact O-N 3.03Å; R62-R65 PolarHBondContact O-N 3.05Å; R62-R65 VanDerWaalsContact O-N 3.12Å; R62-S66 PolarHBondContact O-N 3.04Å; R62-S66 PolarHBondContact O-OG 3.06Å
63	L	96.6	Very high	96	Very high	31 Å²	31	88.9 Å²	88.9	16%	0.162	43%	0.431	C	S	.	.	H	α-helix	trans	-56.2	-48.7	177	-175.6	64.2	0	0	0	111	L45 D48 I49 T52 S59 R65 S66 I67	L45-L63 HydrophobicContact CB-CD1 4.45Å; L45-L63 HydrophobicContact CD2-CD1 3.54Å; D48-L63 HydrophobicContact CB-CB 4.21Å; D48-L63 HydrophobicContact CB-CD1 4.49Å; I49-L63 HydrophobicContact CG1-CD1 4.18Å; T52-L63 HydrophobicContact CG2-CD2 3.9Å; S59-L63 WeakPolarHBondContact O-CB 3.4Å; S59-L63 PolarHBondContact O-N 2.92Å; L63-R65 PolarHBondContact O-N 3.41Å; L63-S66 PolarHBondContact O-N 3.46Å; L63-I67 HydrophobicContact CD1-CD1 4.33Å; L63-I67 HydrophobicContact CG-CD1 4.05Å; L63-I67 VanDerWaalsContact O-CG1 3.24Å; L63-I67 WeakPolarHBondContact O-CG1 3.5Å; L63-I67 PolarHBondContact O-N 3.4Å
64	K	96.3	Very high	96	Very high	110 Å²	110	81.9 Å²	81.9	48%	0.478	41%	0.41	S	S	.	.	H	α-helix	trans	-58.1	-45.1	175.7	-74.1	-174.7	-62.1	178.6	0	112.4	A60 E61 R62 I67 I68	A60-K64 WeakPolarHBondContact O-CG 3.45Å; A60-K64 PolarHBondContact O-N 3.37Å; E61-K64 PolarHBondContact O-N 2.88Å; E61-K64 WeakPolarHBondContact OE1-CE 3.11Å; E61-K64 IonicContact OE1-NZ 2.63Å; E61-K64 PolarHBondContact OE1-NZ 3Å; E61-K64 IonicContact OE2-NZ 2.65Å; R62-K64 VanDerWaalsContact C-N 3.35Å; R62-K64 PolarHBondContact O-N 3.03Å; K64-I67 PolarHBondContact O-N 3Å; K64-I68 VanDerWaalsContact O-CG1 3.31Å; K64-I68 WeakPolarHBondContact O-CG1 3.38Å; K64-I68 PolarHBondContact O-N 3.07Å; K64-I68 VanDerWaalsContact O-N 3.1Å
65	R	96.5	Very high	96	Very high	172 Å²	172	83.6 Å²	83.6	65%	0.649	40%	0.401	S	S	*	.	H	α-helix	trans	-63.2	-45.9	178.6	-70.6	176.8	-169.2	-174.6	2.8	111.7	E61 R62 L63 I67 I68 H69	E61-R65 WeakPolarHBondContact O-CG 3.4Å; E61-R65 PolarHBondContact O-N 3.3Å; R62-R65 PolarHBondContact O-N 3.05Å; R62-R65 VanDerWaalsContact O-N 3.12Å; L63-R65 PolarHBondContact O-N 3.41Å; R65-I67 VanDerWaalsContact C-N 3.33Å; R65-I67 PolarHBondContact O-N 2.79Å; R65-I68 PolarHBondContact O-N 3.23Å; R65-H69 WeakPolarHBondContact O-CB 3.41Å; R65-H69 PolarHBondContact O-N 3.49Å
66	S	96.4	Very high	95.8	Very high	23 Å²	23	85.4 Å²	85.4	16%	0.161	40%	0.395	C	S	.	.	H	α-helix	trans	-63.2	-37.3	178.7	-65.4	0	0	0	0	112.1	V41 R62 L63 H69 A70	V41-S66 VanDerWaalsContact CG1-O 3.3Å; V41-S66 WeakPolarHBondContact CG1-O 3.42Å; R62-S66 PolarHBondContact O-N 3.04Å; R62-S66 PolarHBondContact O-OG 3.06Å; L63-S66 PolarHBondContact O-N 3.46Å; S66-H69 PolarHBondContact O-N 3.12Å; S66-A70 WeakPolarHBondContact O-CB 3.44Å; S66-A70 PolarHBondContact O-N 3.4Å
67	I	96.8	Very high	95.6	Very high	93 Å²	93	84.5 Å²	84.5	48%	0.477	39%	0.393	S	S	.	.	H	α-helix	trans	-64.7	-45.4	174.6	-67.7	165.9	0	0	0	111.1	L45 L63 K64 R65 H69 A70 R71	L45-I67 HydrophobicContact CD2-CG1 3.69Å; L63-I67 HydrophobicContact CD1-CD1 4.33Å; L63-I67 HydrophobicContact CG-CD1 4.05Å; L63-I67 VanDerWaalsContact O-CG1 3.24Å; L63-I67 WeakPolarHBondContact O-CG1 3.5Å; L63-I67 PolarHBondContact O-N 3.4Å; K64-I67 PolarHBondContact O-N 3Å; R65-I67 VanDerWaalsContact C-N 3.33Å; R65-I67 PolarHBondContact O-N 2.79Å; I67-H69 VanDerWaalsContact C-N 3.32Å; I67-H69 PolarHBondContact O-N 3Å; I67-A70 PolarHBondContact O-N 3.48Å; I67-R71 PolarHBondContact O-N 2.96Å
68	I	97.2	Very high	95.3	Very high	104 Å²	104	80 Å²	80	53%	0.533	38%	0.377	S	S	.	.	H	α-helix	trans	-62	-44	177.3	-66.5	164.2	0	0	0	110.2	K64 R65 R71 I72	K64-I68 VanDerWaalsContact O-CG1 3.31Å; K64-I68 WeakPolarHBondContact O-CG1 3.38Å; K64-I68 PolarHBondContact O-N 3.07Å; K64-I68 VanDerWaalsContact O-N 3.1Å; R65-I68 PolarHBondContact O-N 3.23Å; I68-R71 WeakPolarHBondContact O-CB 3.3Å; I68-R71 PolarHBondContact O-N 2.97Å; I68-I72 HydrophobicContact CG2-CD1 4Å; I68-I72 WeakPolarHBondContact O-CG1 3.18Å; I68-I72 PolarHBondContact O-N 3.34Å
69	H	95.9	Very high	95.1	Very high	92 Å²	92	78.4 Å²	78.4	43%	0.426	37%	0.37	S	S	.	.	H	α-helix	trans	-61.3	-48.3	178.5	-173.7	-157.6	0	0	0	111.7	R65 S66 I67 R71 I72 L73	R65-H69 WeakPolarHBondContact O-CB 3.41Å; R65-H69 PolarHBondContact O-N 3.49Å; S66-H69 PolarHBondContact O-N 3.12Å; I67-H69 VanDerWaalsContact C-N 3.32Å; I67-H69 PolarHBondContact O-N 3Å; H69-R71 VanDerWaalsContact C-N 3.27Å; H69-R71 PolarHBondContact O-N 3.32Å; H69-I72 PolarHBondContact O-N 3.36Å; H69-I72 VanDerWaalsContact O-N 3.17Å; H69-L73 WeakPolarHBondContact O-CB 3.44Å; H69-L73 PolarHBondContact O-N 3.29Å
70	A	96.4	Very high	94.6	Very high	16 Å²	16	83 Å²	83	13%	0.132	39%	0.391	C	S	.	.	H	α-helix	trans	-54.7	-43.8	174.5	0	0	0	0	0	111.7	L38 V41 S66 I67 I72 L73 V74	L38-A70 HydrophobicContact CD1-CB 4.4Å; V41-A70 HydrophobicContact CG1-CB 3.8Å; S66-A70 WeakPolarHBondContact O-CB 3.44Å; S66-A70 PolarHBondContact O-N 3.4Å; I67-A70 PolarHBondContact O-N 3.48Å; A70-I72 PolarHBondContact O-N 3.26Å; A70-L73 PolarHBondContact O-N 3.4Å; A70-V74 WeakPolarHBondContact O-CB 3.24Å; A70-V74 VanDerWaalsContact O-CG2 3.26Å; A70-V74 WeakPolarHBondContact O-CG2 3.26Å; A70-V74 PolarHBondContact O-N 3.36Å
71	R	96.6	Very high	94.1	Very high	158 Å²	158	85.6 Å²	85.6	60%	0.596	40%	0.404	S	S	*	.	H	α-helix	trans	-63.6	-41.1	179.4	-175.3	-177	175.3	-160.5	4.8	112.6	I67 I68 H69 R75	I67-R71 PolarHBondContact O-N 2.96Å; I68-R71 WeakPolarHBondContact O-CB 3.3Å; I68-R71 PolarHBondContact O-N 2.97Å; H69-R71 VanDerWaalsContact C-N 3.27Å; H69-R71 PolarHBondContact O-N 3.32Å; R71-R75 WeakPolarHBondContact O-CG 3.48Å; R71-R75 PolarHBondContact O-N 3.49Å
72	I	95.2	Very high	93.8	Very high	80 Å²	80	87.1 Å²	87.1	41%	0.41	41%	0.411	S	S	.	.	H	α-helix	trans	-63.3	-48.9	176.2	-67.1	165.6	0	0	0	109.3	I68 H69 A70 V74 R75 E76	I68-I72 HydrophobicContact CG2-CD1 4Å; I68-I72 WeakPolarHBondContact O-CG1 3.18Å; I68-I72 PolarHBondContact O-N 3.34Å; H69-I72 PolarHBondContact O-N 3.36Å; H69-I72 VanDerWaalsContact O-N 3.17Å; A70-I72 PolarHBondContact O-N 3.26Å; I72-V74 VanDerWaalsContact C-N 3.34Å; I72-V74 PolarHBondContact O-N 3.1Å; I72-R75 WeakPolarHBondContact O-CB 3.48Å; I72-R75 PolarHBondContact O-N 2.86Å; I72-E76 WeakPolarHBondContact O-CG 3.36Å; I72-E76 PolarHBondContact O-N 3.06Å
73	L	93.6	Very high	93.2	Very high	2 Å²	2	88.9 Å²	88.9	1%	0.01	42%	0.417	C	S	.	.	H	α-helix	trans	-62.7	-40.9	-176.7	-165.8	149.8	0	0	0	112.4	K34 Q37 L38 H69 A70 R75 E76 C77	K34-L73 HydrophobicContact CB-CD2 4.3Å; K34-L73 WeakPolarHBondContact O-CD2 3.22Å; Q37-L73 HydrophobicContact CB-CD1 3.47Å; Q37-L73 VanDerWaalsContact CB-CD1 3.47Å; L38-L73 HydrophobicContact CB-CD2 3.76Å; L38-L73 HydrophobicContact CD1-CD2 4.19Å; L38-L73 HydrophobicContact CG-CD2 4.4Å; H69-L73 WeakPolarHBondContact O-CB 3.44Å; H69-L73 PolarHBondContact O-N 3.29Å; A70-L73 PolarHBondContact O-N 3.4Å; L73-R75 VanDerWaalsContact C-N 3.34Å; L73-R75 PolarHBondContact O-N 3.27Å; L73-E76 PolarHBondContact O-N 3.32Å; L73-C77 WeakPolarHBondContact O-CB 3.41Å; L73-C77 PolarHBondContact O-N 3.09Å
74	V	94.7	Very high	92.4	Very high	61 Å²	61	90.6 Å²	90.6	37%	0.37	44%	0.436	S	S	.	.	H	α-helix	trans	-61.4	-42.1	174.2	169.9	0	0	0	0	111.1	L38 A70 I72 E76 C77 I78	L38-V74 HydrophobicContact CD1-CG2 4.03Å; L38-V74 HydrophobicContact CD2-CG2 4.31Å; A70-V74 WeakPolarHBondContact O-CB 3.24Å; A70-V74 VanDerWaalsContact O-CG2 3.26Å; A70-V74 WeakPolarHBondContact O-CG2 3.26Å; A70-V74 PolarHBondContact O-N 3.36Å; I72-V74 VanDerWaalsContact C-N 3.34Å; I72-V74 PolarHBondContact O-N 3.1Å; V74-E76 VanDerWaalsContact C-N 3.32Å; V74-E76 PolarHBondContact O-N 2.65Å; V74-C77 WeakPolarHBondContact O-CB 3.24Å; V74-C77 PolarHBondContact O-N 3Å; V74-I78 HydrophobicContact CG1-CD1 3.91Å; V74-I78 HydrophobicContact CG1-CG1 4.46Å; V74-I78 WeakPolarHBondContact O-CG1 3.27Å; V74-I78 PolarHBondContact O-N 2.82Å
75	R	94.6	Very high	91.4	Very high	133 Å²	133	88.7 Å²	88.7	50%	0.502	44%	0.44	S	S	.	.	H	α-helix	trans	-61	-42.4	175.3	-72	167.9	167.6	-172.1	-9.6	111.8	R71 I72 L73 C77 I78 L79	R71-R75 WeakPolarHBondContact O-CG 3.48Å; R71-R75 PolarHBondContact O-N 3.49Å; I72-R75 WeakPolarHBondContact O-CB 3.48Å; I72-R75 PolarHBondContact O-N 2.86Å; L73-R75 VanDerWaalsContact C-N 3.34Å; L73-R75 PolarHBondContact O-N 3.27Å; R75-C77 VanDerWaalsContact C-N 3.3Å; R75-C77 PolarHBondContact O-N 3.41Å; R75-I78 PolarHBondContact O-N 2.65Å; R75-L79 WeakPolarHBondContact O-CB 3.2Å; R75-L79 VanDerWaalsContact O-CG 3.3Å; R75-L79 WeakPolarHBondContact O-CG 3.4Å; R75-L79 PolarHBondContact O-N 3.02Å
76	E	91.9	Very high	90.3	Very high	94 Å²	94	83.2 Å²	83.2	44%	0.439	44%	0.438	S	S	.	.	H	α-helix	trans	-66	-33.8	177	-66.4	177.7	141.9	0	0	112.5	K34 I72 L73 V74 E80	K34-E76 HydrophobicContact CD-CB 4.44Å; K34-E76 PolarHBondContact NZ-O 3.35Å; I72-E76 WeakPolarHBondContact O-CG 3.36Å; I72-E76 PolarHBondContact O-N 3.06Å; L73-E76 PolarHBondContact O-N 3.32Å; V74-E76 VanDerWaalsContact C-N 3.32Å; V74-E76 PolarHBondContact O-N 2.65Å; E76-E80 WeakPolarHBondContact O-CB 3.31Å; E76-E80 PolarHBondContact O-N 3.22Å
77	C	90.5	Very high	88.5	Confident	51 Å²	51	92.7 Å²	92.7	35%	0.345	47%	0.47	S	S	.	.	H	α-helix	trans	-68.5	-44.6	175.8	-170.9	0	0	0	0	111.5	K34 L73 V74 R75 E80 T81	K34-C77 HydrophobicContact CD-CB 4.41Å; L73-C77 WeakPolarHBondContact O-CB 3.41Å; L73-C77 PolarHBondContact O-N 3.09Å; V74-C77 WeakPolarHBondContact O-CB 3.24Å; V74-C77 PolarHBondContact O-N 3Å; R75-C77 VanDerWaalsContact C-N 3.3Å; R75-C77 PolarHBondContact O-N 3.41Å; C77-E80 PolarHBondContact O-N 3.34Å; C77-T81 WeakPolarHBondContact O-CB 3.47Å; C77-T81 PolarHBondContact O-N 3.33Å; C77-T81 PolarHBondContact O-OG1 3.24Å
78	I	91.1	Very high	86.6	Confident	86 Å²	86	91.4 Å²	91.4	44%	0.441	48%	0.48	S	S	.	.	H	α-helix	trans	-59.5	-52.5	174.2	-66.6	165.7	0	0	0	110	V74 R75 E80 T81 E82	V74-I78 HydrophobicContact CG1-CD1 3.91Å; V74-I78 HydrophobicContact CG1-CG1 4.46Å; V74-I78 WeakPolarHBondContact O-CG1 3.27Å; V74-I78 PolarHBondContact O-N 2.82Å; R75-I78 PolarHBondContact O-N 2.65Å; I78-E80 VanDerWaalsContact C-N 3.3Å; I78-E80 PolarHBondContact O-N 3.15Å; I78-T81 WeakPolarHBondContact O-CA 3.47Å; I78-T81 WeakPolarHBondContact O-CB 3.45Å; I78-T81 PolarHBondContact O-N 3.39Å; I78-E82 HydrophobicContact CG2-CG 4.24Å; I78-E82 WeakPolarHBondContact O-CG 3.46Å; I78-E82 PolarHBondContact O-N 3.13Å
79	L	89.9	Confident	84.5	Confident	79 Å²	79	89.5 Å²	89.5	41%	0.414	49%	0.486	S	S	.	.	H	α-helix	trans	-60.1	-37.3	-179.5	-74.3	170.2	0	0	0	113.1	R75 R83	R75-L79 WeakPolarHBondContact O-CB 3.2Å; R75-L79 VanDerWaalsContact O-CG 3.3Å; R75-L79 WeakPolarHBondContact O-CG 3.4Å; R75-L79 PolarHBondContact O-N 3.02Å; L79-R83 WeakPolarHBondContact O-CB 3.46Å; L79-R83 VanDerWaalsContact O-CG 3.24Å; L79-R83 WeakPolarHBondContact O-CG 3.2Å; L79-R83 PolarHBondContact O-N 3.3Å
80	E	86.1	Confident	82.1	Confident	105 Å²	105	93.4 Å²	93.4	49%	0.491	50%	0.504	S	S	.	.	H	α-helix	trans	-66.7	-40.8	175.2	-177.6	172.6	-161.8	0	0	111.6	K34 E76 C77 I78 R83 A84	K34-E80 WeakPolarHBondContact CD-OE2 3.24Å; K34-E80 WeakPolarHBondContact CE-OE2 3.24Å; K34-E80 IonicContact NZ-OE2 2.63Å; K34-E80 PolarHBondContact NZ-OE2 3.1Å; E76-E80 WeakPolarHBondContact O-CB 3.31Å; E76-E80 PolarHBondContact O-N 3.22Å; C77-E80 PolarHBondContact O-N 3.34Å; I78-E80 VanDerWaalsContact C-N 3.3Å; I78-E80 PolarHBondContact O-N 3.15Å; E80-R83 PolarHBondContact O-N 2.89Å; E80-A84 WeakPolarHBondContact O-CB 3.49Å; E80-A84 PolarHBondContact O-N 3.25Å
81	T	87.2	Confident	79.5	Confident	86 Å²	86	104.2 Å²	104.2	53%	0.528	56%	0.559	S	S	.	*	H	α-helix	trans	-65.7	-43.9	177.1	-54.6	0	0	0	0	111.2	C77 I78 R83 A84 A85	C77-T81 WeakPolarHBondContact O-CB 3.47Å; C77-T81 PolarHBondContact O-N 3.33Å; C77-T81 PolarHBondContact O-OG1 3.24Å; I78-T81 WeakPolarHBondContact O-CA 3.47Å; I78-T81 WeakPolarHBondContact O-CB 3.45Å; I78-T81 PolarHBondContact O-N 3.39Å; T81-R83 PolarHBondContact O-N 3.02Å; T81-A84 PolarHBondContact O-N 2.94Å; T81-A85 WeakPolarHBondContact O-CB 3.13Å; T81-A85 PolarHBondContact O-N 3.33Å
82	E	88.9	Confident	78.7	Confident	116 Å²	116	101.6 Å²	101.6	54%	0.542	56%	0.557	S	S	.	*	H	α-helix	trans	-61.4	-41.4	175.2	-71.4	176.4	157.2	0	0	112	I78 A85 G86	I78-E82 HydrophobicContact CG2-CG 4.24Å; I78-E82 WeakPolarHBondContact O-CG 3.46Å; I78-E82 PolarHBondContact O-N 3.13Å; E82-A85 PolarHBondContact O-N 3Å; E82-G86 PolarHBondContact O-N 3.25Å
83	R	84.7	Confident	77.8	Confident	175 Å²	175	102.7 Å²	102.7	66%	0.66	57%	0.565	S	S	*	*	H	α-helix	trans	-67.7	-37.3	175.3	-74.5	172.6	-176.3	158.1	2.1	112.8	L79 E80 T81 R87	L79-R83 WeakPolarHBondContact O-CB 3.46Å; L79-R83 VanDerWaalsContact O-CG 3.24Å; L79-R83 WeakPolarHBondContact O-CG 3.2Å; L79-R83 PolarHBondContact O-N 3.3Å; E80-R83 PolarHBondContact O-N 2.89Å; T81-R83 PolarHBondContact O-N 3.02Å; R83-R87 WeakPolarHBondContact O-CG 3.22Å; R83-R87 PolarHBondContact O-N 3.4Å
84	A	80.6	Confident	76.9	Confident	67 Å²	67	108.3 Å²	108.3	55%	0.554	60%	0.595	S	S	*	*	H	α-helix	trans	-67.2	-44.7	175.5	0	0	0	0	0	111	E80 T81 R87 G88	E80-A84 WeakPolarHBondContact O-CB 3.49Å; E80-A84 PolarHBondContact O-N 3.25Å; T81-A84 PolarHBondContact O-N 2.94Å; A84-R87 PolarHBondContact O-N 3.45Å; A84-G88 PolarHBondContact O-N 3.25Å
85	A	75.4	Confident	75.9	Confident	69 Å²	69	111.1 Å²	111.1	57%	0.57	61%	0.609	S	S	*	*	H	α-helix	trans	-64.9	-42.3	176.7	0	0	0	0	0	112.2	T81 E82 R87 G88	T81-A85 WeakPolarHBondContact O-CB 3.13Å; T81-A85 PolarHBondContact O-N 3.33Å; E82-A85 PolarHBondContact O-N 3Å; A85-R87 VanDerWaalsContact C-N 3.26Å; A85-R87 PolarHBondContact O-N 3.4Å; A85-G88 PolarHBondContact O-N 3.2Å; A85-G88 VanDerWaalsContact O-N 3.16Å
86	G	71.9	Confident	74.7	Confident	58 Å²	58	109.7 Å²	109.7	60%	0.598	62%	0.615	S	S	*	*	H	α-helix	trans	-66.8	-21.6	178.3	0	0	0	0	0	114.5	E82	E82-G86 PolarHBondContact O-N 3.25Å
87	R	60.2	Low	73.6	Confident	221 Å²	221	110.7 Å²	110.7	83%	0.834	63%	0.627	S	S	*	*	H	α-helix	trans	-89.9	-16.8	173.8	-69.8	178.2	100.5	172.3	5.8	113.3	R83 A84 A85	R83-R87 WeakPolarHBondContact O-CG 3.22Å; R83-R87 PolarHBondContact O-N 3.4Å; A84-R87 PolarHBondContact O-N 3.45Å; A85-R87 VanDerWaalsContact C-N 3.26Å; A85-R87 PolarHBondContact O-N 3.4Å
88	G	55.6	Low	72.4	Confident	67 Å²	67	115 Å²	115	69%	0.691	65%	0.647	S	S	*	*	S	Bend	trans	-88	-4.7	-179.2	0	0	0	0	0	115.5	A84 A85	A84-G88 PolarHBondContact O-N 3.25Å; A85-G88 PolarHBondContact O-N 3.2Å; A85-G88 VanDerWaalsContact O-N 3.16Å
89	G	53.2	Low	70.9	Confident	63 Å²	63	117.2 Å²	117.2	65%	0.649	66%	0.663	S	S	*	*			trans	-100.1	21.7	-177.1	0	0	0	0	0	116.1
90	Q	45	Very low	69.4	Low	174 Å²	174	120.4 Å²	120.4	81%	0.813	68%	0.684	S	S	*	*			trans	-115.3	70.9	172	-82	-178.3	68.9	0	0	110.6
91	L	43.5	Very low	67.8	Low	244 Å²	244	121.8 Å²	121.8	100%	1.277	70%	0.702	S	S	*	*			trans	-151.7	0	159.4	-81.3	172.1	0	0	0	106.9

Retrieved 91 of 91 residues in 34.9 ms (Link to these results)

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