G4LYH7_SCHMA Loading...

HTH psq-type domain-containing protein

AlphaFold DB , UniProt , Accession G4LYH7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 73 aa.

						>G4LYH7_SCHMA|G4LYH7
MNNSNDIDEIFYEKGENKDQSKYTHIMSQRKSYIIDIVEIQKYIQHRNNREQIAHAVKLYKIPTKLIEKYDIE
					

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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	41.6	Very low	55.9	Low	236 Å²	236	110.2 Å²	110.2	100%	1.163	58%	0.575	S	S	*	*				0	95	0	-78.3	171.7	149.5	0	0	107.3
2	N	45	Very low	56.7	Low	120 Å²	120	106.9 Å²	106.9	64%	0.642	55%	0.55	S	S	*	*			trans	-150.3	32.7	173.8	-105.6	10.2	0	0	0	111.7	S4	N2-S4 PolarHBondContact O-N 3.21Å
3	N	50.2	Low	57.5	Low	135 Å²	135	109.9 Å²	109.9	72%	0.722	56%	0.561	S	S	*	*	H	α-helix	trans	-75.2	-5.4	-171	-68.9	29	0	0	0	114.6
4	S	54.8	Low	58.1	Low	87 Å²	87	114.6 Å²	114.6	61%	0.608	58%	0.575	S	S	*	*	H	α-helix	trans	-77.1	-26.9	-179.7	58.5	0	0	0	0	113.2	N2	N2-S4 PolarHBondContact O-N 3.21Å
5	N	49.6	Very low	58.1	Low	83 Å²	83	108.7 Å²	108.7	44%	0.444	56%	0.555	S	S	.	*	H	α-helix	trans	-87.1	-28.6	-178.1	-67.4	0.2	0	0	0	112.2	I7 D8 E9	N5-I7 PolarHBondContact O-N 3.05Å; N5-D8 PolarHBondContact O-N 3.23Å; N5-E9 WeakPolarHBondContact O-CB 3.45Å; N5-E9 WeakPolarHBondContact O-CG 3.37Å; N5-E9 PolarHBondContact O-N 3.29Å
6	D	59.1	Low	58.3	Low	82 Å²	82	114.4 Å²	114.4	44%	0.439	58%	0.579	S	S	.	*	H	α-helix	trans	-61.2	-40.4	-173.6	-64.9	-15	0	0	0	113.2	I10	D6-I10 WeakPolarHBondContact O-CB 3.31Å; D6-I10 VanDerWaalsContact O-CD1 3.29Å; D6-I10 WeakPolarHBondContact O-CD1 3.26Å; D6-I10 WeakPolarHBondContact O-CG1 3.41Å; D6-I10 PolarHBondContact O-N 2.83Å
7	I	63.5	Low	58.4	Low	118 Å²	118	111.4 Å²	111.4	61%	0.605	56%	0.564	S	S	*	*	H	α-helix	trans	-72.9	-35.4	-177	-166.2	163.8	0	0	0	112.5	N5 F11	N5-I7 PolarHBondContact O-N 3.05Å; I7-F11 WeakPolarHBondContact O-CB 3.41Å; I7-F11 PolarHBondContact O-N 2.9Å
8	D	62.4	Low	58.7	Low	73 Å²	73	114.4 Å²	114.4	39%	0.39	57%	0.573	S	S	.	*	H	α-helix	trans	-68.7	-45.3	177.7	-81.1	0.9	0	0	0	109.9	N5 F11 Y12 Y23	N5-D8 PolarHBondContact O-N 3.23Å; D8-F11 PolarHBondContact O-N 3.41Å; D8-Y12 PolarHBondContact O-N 3.46Å; D8-Y23 WeakPolarHBondContact CA-OH 3.21Å; D8-Y23 WeakPolarHBondContact CB-OH 3.33Å; D8-Y23 PolarHBondContact O-OH 3.46Å; D8-Y23 VanDerWaalsContact O-OH 3.09Å
9	E	62.8	Low	59.6	Low	106 Å²	106	112.1 Å²	112.1	50%	0.495	56%	0.563	S	S	.	*	H	α-helix	trans	-61.2	-47.4	174.4	-72.4	176.9	-159	0	0	111.7	N5 F11 Y12 E13	N5-E9 WeakPolarHBondContact O-CB 3.45Å; N5-E9 WeakPolarHBondContact O-CG 3.37Å; N5-E9 PolarHBondContact O-N 3.29Å; E9-F11 VanDerWaalsContact C-N 3.27Å; E9-F11 PolarHBondContact O-N 2.84Å; E9-Y12 PolarHBondContact O-N 3.17Å; E9-E13 WeakPolarHBondContact O-CB 3.15Å; E9-E13 WeakPolarHBondContact O-CG 3.46Å; E9-E13 PolarHBondContact O-N 3.37Å
10	I	64.6	Low	60	Low	87 Å²	87	111.6 Å²	111.6	45%	0.446	56%	0.558	S	S	.	*	H	α-helix	trans	-59.8	-38.3	176.6	-70.4	164.2	0	0	0	111.5	D6 K14	D6-I10 WeakPolarHBondContact O-CB 3.31Å; D6-I10 VanDerWaalsContact O-CD1 3.29Å; D6-I10 WeakPolarHBondContact O-CD1 3.26Å; D6-I10 WeakPolarHBondContact O-CG1 3.41Å; D6-I10 PolarHBondContact O-N 2.83Å; I10-K14 HydrophobicContact CG2-CD 4.03Å; I10-K14 VanDerWaalsContact O-CB 3.31Å; I10-K14 WeakPolarHBondContact O-CB 3.49Å; I10-K14 WeakPolarHBondContact O-CG 3.36Å; I10-K14 PolarHBondContact O-N 3.31Å; I10-K14 VanDerWaalsContact O-N 3.08Å
11	F	61.5	Low	60.6	Low	85 Å²	85	110.8 Å²	110.8	37%	0.373	56%	0.563	S	S	.	*	H	α-helix	trans	-71.6	-38.1	179.9	-165.1	-88.9	0	0	0	112.3	I7 D8 E9 G15 Y23 I26 M27	I7-F11 WeakPolarHBondContact O-CB 3.41Å; I7-F11 PolarHBondContact O-N 2.9Å; D8-F11 PolarHBondContact O-N 3.41Å; E9-F11 VanDerWaalsContact C-N 3.27Å; E9-F11 PolarHBondContact O-N 2.84Å; F11-G15 WeakPolarHBondContact O-CA 3.23Å; F11-G15 PolarHBondContact O-N 2.91Å; F11-G15 VanDerWaalsContact O-N 3.1Å; F11-Y23 HydrophobicContact CB-CE2 4.4Å; F11-Y23 HydrophobicContact CD1-CD2 4.2Å; F11-Y23 AromaticContact CD1-CE2 3.84Å; F11-Y23 HydrophobicContact CD1-CE2 3.84Å; F11-I26 HydrophobicContact CE1-CG2 4.46Å; F11-M27 HydrophobicContact CB-CE 4.22Å; F11-M27 HydrophobicContact CD1-CE 3.17Å; F11-M27 HydrophobicContact CD2-CE 4.45Å; F11-M27 HydrophobicContact CE1-CE 3.51Å; F11-M27 HydrophobicContact CG-CE 3.7Å; F11-M27 HydrophobicContact CZ-CE 4.29Å
12	Y	65.4	Low	62	Low	71 Å²	71	104.9 Å²	104.9	28%	0.278	53%	0.531	S	S	.	.	H	α-helix	trans	-69.1	-47.7	174.7	-178.8	-104.8	0	0	0	112	D8 E9 K18 Y23	D8-Y12 PolarHBondContact O-N 3.46Å; E9-Y12 PolarHBondContact O-N 3.17Å; Y12-K18 PolarHBondContact OH-O 3.33Å; Y12-Y23 HydrophobicContact CD2-CD1 4.36Å; Y12-Y23 AromaticContact CD2-CD2 3.83Å; Y12-Y23 HydrophobicContact CD2-CD2 3.83Å; Y12-Y23 HydrophobicContact CD2-CE2 4.47Å; Y12-Y23 AromaticContact CD2-CG 3.77Å; Y12-Y23 HydrophobicContact CD2-CG 3.77Å; Y12-Y23 HydrophobicContact CG-CD2 4.38Å
13	E	67.3	Low	63.2	Low	146 Å²	146	100.3 Å²	100.3	68%	0.682	51%	0.505	S	S	*	.	H	α-helix	trans	-69.8	-36.2	-175.5	-72.2	-170	156.7	0	0	113.5	E9	E9-E13 WeakPolarHBondContact O-CB 3.15Å; E9-E13 WeakPolarHBondContact O-CG 3.46Å; E9-E13 PolarHBondContact O-N 3.37Å
14	K	65.7	Low	64.2	Low	175 Å²	175	97.6 Å²	97.6	76%	0.761	49%	0.494	S	S	*	.	H	α-helix	trans	-94.1	-12.6	-180	-61.9	-172	-179.4	178.1	0	114.3	I10	I10-K14 HydrophobicContact CG2-CD 4.03Å; I10-K14 VanDerWaalsContact O-CB 3.31Å; I10-K14 WeakPolarHBondContact O-CB 3.49Å; I10-K14 WeakPolarHBondContact O-CG 3.36Å; I10-K14 PolarHBondContact O-N 3.31Å; I10-K14 VanDerWaalsContact O-N 3.08Å
15	G	58	Low	65.1	Low	27 Å²	27	98.7 Å²	98.7	28%	0.278	49%	0.489	S	S	.	.	S	Bend	trans	-78.6	150.9	-179.5	0	0	0	0	0	112.6	F11 N17	F11-G15 WeakPolarHBondContact O-CA 3.23Å; F11-G15 PolarHBondContact O-N 2.91Å; F11-G15 VanDerWaalsContact O-N 3.1Å; G15-N17 PolarHBondContact O-N 3.16Å
16	E	61.4	Low	65.9	Low	199 Å²	199	97.2 Å²	97.2	93%	0.93	48%	0.48	S	S	*	.	S	Bend	trans	-61.1	-2.1	172.3	-66.2	-178.3	133.2	0	0	113.8
17	N	60.2	Low	66.3	Low	63 Å²	63	94.8 Å²	94.8	34%	0.337	47%	0.467	S	S	.	.			trans	-115.1	72.5	-169.4	-64.9	-56.2	0	0	0	112	G15 D19	G15-N17 PolarHBondContact O-N 3.16Å; N17-D19 PolarHBondContact O-N 3.03Å; N17-D19 VanDerWaalsContact O-N 3.13Å
18	K	64.2	Low	66.5	Low	166 Å²	166	92.9 Å²	92.9	72%	0.722	46%	0.464	S	S	*	.			trans	-66.1	-4.3	168.8	-62.9	-171.4	178.9	-174	0	113.7	Y12 Q20	Y12-K18 PolarHBondContact OH-O 3.33Å; K18-Q20 PolarHBondContact O-N 2.72Å
19	D	75.9	Confident	66.7	Low	71 Å²	71	94.9 Å²	94.9	38%	0.38	47%	0.471	S	S	.	.			trans	-77.3	107	175	-176.1	-30.5	0	0	0	110.1	N17 S21 K22 Y23	N17-D19 PolarHBondContact O-N 3.03Å; N17-D19 VanDerWaalsContact O-N 3.13Å; D19-S21 PolarHBondContact O-N 3.45Å; D19-S21 WeakPolarHBondContact OD1-CA 3.42Å; D19-S21 VanDerWaalsContact OD1-CB 3.27Å; D19-S21 WeakPolarHBondContact OD1-CB 3.44Å; D19-S21 PolarHBondContact OD1-N 3.15Å; D19-K22 HydrophobicContact CB-CB 4.14Å; D19-K22 HydrophobicContact CB-CD 4.02Å; D19-K22 HydrophobicContact CB-CG 4.08Å; D19-K22 PolarHBondContact O-N 3.43Å; D19-K22 VanDerWaalsContact O-N 3.15Å; D19-K22 PolarHBondContact OD1-N 2.94Å; D19-Y23 PolarHBondContact O-N 3.48Å
20	Q	67.6	Low	66.8	Low	101 Å²	101	95.6 Å²	95.6	47%	0.472	47%	0.469	S	S	.	.	H	α-helix	trans	-56.1	-33.5	-179.8	-172.2	63.4	30.4	0	0	113	K18 T24	K18-Q20 PolarHBondContact O-N 2.72Å; Q20-T24 WeakPolarHBondContact O-CB 3.17Å; Q20-T24 PolarHBondContact O-N 2.89Å; Q20-T24 PolarHBondContact O-OG1 2.79Å
21	S	72.6	Confident	66.9	Low	95 Å²	95	98.4 Å²	98.4	66%	0.664	48%	0.478	S	S	*	.	H	α-helix	trans	-69.4	-43.1	-179.9	-55.5	0	0	0	0	110.6	D19 H25	D19-S21 PolarHBondContact O-N 3.45Å; D19-S21 WeakPolarHBondContact OD1-CA 3.42Å; D19-S21 VanDerWaalsContact OD1-CB 3.27Å; D19-S21 WeakPolarHBondContact OD1-CB 3.44Å; D19-S21 PolarHBondContact OD1-N 3.15Å; S21-H25 WeakPolarHBondContact O-CB 3.46Å; S21-H25 PolarHBondContact O-N 3.15Å
22	K	69.6	Low	67	Low	113 Å²	113	97.4 Å²	97.4	49%	0.491	48%	0.482	S	S	.	.	H	α-helix	trans	-66.2	-43.4	174.7	-67.5	-178	-173.1	174.5	0	111.7	D19 H25 I26	D19-K22 HydrophobicContact CB-CB 4.14Å; D19-K22 HydrophobicContact CB-CD 4.02Å; D19-K22 HydrophobicContact CB-CG 4.08Å; D19-K22 PolarHBondContact O-N 3.43Å; D19-K22 VanDerWaalsContact O-N 3.15Å; D19-K22 PolarHBondContact OD1-N 2.94Å; K22-H25 WeakPolarHBondContact O-CB 3.36Å; K22-H25 PolarHBondContact O-N 2.93Å; K22-I26 VanDerWaalsContact O-CG1 3.28Å; K22-I26 WeakPolarHBondContact O-CG1 3.33Å; K22-I26 PolarHBondContact O-N 2.99Å
23	Y	69.9	Low	66.8	Low	23 Å²	23	97.2 Å²	97.2	9%	0.09	48%	0.481	C	S	.	.	H	α-helix	trans	-58.7	-49	176.5	175.1	-92.7	0	0	0	111.6	D8 F11 Y12 D19 H25 I26 M27	D8-Y23 WeakPolarHBondContact CA-OH 3.21Å; D8-Y23 WeakPolarHBondContact CB-OH 3.33Å; D8-Y23 PolarHBondContact O-OH 3.46Å; D8-Y23 VanDerWaalsContact O-OH 3.09Å; F11-Y23 HydrophobicContact CB-CE2 4.4Å; F11-Y23 HydrophobicContact CD1-CD2 4.2Å; F11-Y23 AromaticContact CD1-CE2 3.84Å; F11-Y23 HydrophobicContact CD1-CE2 3.84Å; Y12-Y23 HydrophobicContact CD2-CD1 4.36Å; Y12-Y23 AromaticContact CD2-CD2 3.83Å; Y12-Y23 HydrophobicContact CD2-CD2 3.83Å; Y12-Y23 HydrophobicContact CD2-CE2 4.47Å; Y12-Y23 AromaticContact CD2-CG 3.77Å; Y12-Y23 HydrophobicContact CD2-CG 3.77Å; Y12-Y23 HydrophobicContact CG-CD2 4.38Å; D19-Y23 PolarHBondContact O-N 3.48Å; Y23-H25 VanDerWaalsContact C-N 3.27Å; Y23-H25 PolarHBondContact O-N 3.31Å; Y23-I26 PolarHBondContact O-N 3.44Å; Y23-M27 HydrophobicContact CD1-CG 4.22Å; Y23-M27 HydrophobicContact CD2-CE 4.3Å; Y23-M27 HydrophobicContact CD2-CG 4.37Å; Y23-M27 HydrophobicContact CE1-CG 3.66Å; Y23-M27 HydrophobicContact CE2-CE 3.58Å; Y23-M27 HydrophobicContact CE2-CG 3.85Å; Y23-M27 HydrophobicContact CE2-SD 4.49Å; Y23-M27 VanDerWaalsContact CZ-CG 3.44Å; Y23-M27 PolarHBondContact O-N 3.04Å
24	T	71.7	Confident	66.7	Low	78 Å²	78	94.6 Å²	94.6	48%	0.479	47%	0.471	S	S	.	.	H	α-helix	trans	-59.4	-40.3	178	-57.2	0	0	0	0	111.2	Q20 S28	Q20-T24 WeakPolarHBondContact O-CB 3.17Å; Q20-T24 PolarHBondContact O-N 2.89Å; Q20-T24 PolarHBondContact O-OG1 2.79Å; T24-S28 VanDerWaalsContact O-CB 3.29Å; T24-S28 WeakPolarHBondContact O-CB 3.28Å; T24-S28 PolarHBondContact O-N 3.38Å
25	H	74.7	Confident	66.6	Low	111 Å²	111	90.3 Å²	90.3	51%	0.514	46%	0.455	S	S	.	.	H	α-helix	trans	-63.8	-47.7	175.5	-173.5	73.1	0	0	0	112.3	S21 K22 Y23 M27 S28 Q29	S21-H25 WeakPolarHBondContact O-CB 3.46Å; S21-H25 PolarHBondContact O-N 3.15Å; K22-H25 WeakPolarHBondContact O-CB 3.36Å; K22-H25 PolarHBondContact O-N 2.93Å; Y23-H25 VanDerWaalsContact C-N 3.27Å; Y23-H25 PolarHBondContact O-N 3.31Å; H25-M27 PolarHBondContact O-N 3.3Å; H25-S28 PolarHBondContact O-N 3.31Å; H25-Q29 PolarHBondContact NE2-NE2 3.32Å; H25-Q29 WeakPolarHBondContact O-CG 3.2Å; H25-Q29 PolarHBondContact O-N 3.17Å
26	I	66.1	Low	67	Low	51 Å²	51	91.6 Å²	91.6	26%	0.262	46%	0.456	S	S	.	.	H	α-helix	trans	-62	-43.6	178	-67.7	165	0	0	0	110.6	F11 K22 Y23 Q29 R30	F11-I26 HydrophobicContact CE1-CG2 4.46Å; K22-I26 VanDerWaalsContact O-CG1 3.28Å; K22-I26 WeakPolarHBondContact O-CG1 3.33Å; K22-I26 PolarHBondContact O-N 2.99Å; Y23-I26 PolarHBondContact O-N 3.44Å; I26-Q29 PolarHBondContact O-N 2.94Å; I26-R30 HydrophobicContact CG2-CG 4.32Å; I26-R30 WeakPolarHBondContact O-CB 3.46Å; I26-R30 VanDerWaalsContact O-CG 3.27Å; I26-R30 WeakPolarHBondContact O-CG 3.44Å; I26-R30 PolarHBondContact O-N 3.28Å
27	M	67	Low	67.3	Low	32 Å²	32	84.4 Å²	84.4	16%	0.158	42%	0.423	C	S	.	.	H	α-helix	trans	-68.8	-36.5	178.2	-71.8	-54.3	150.2	0	0	112.9	F11 Y23 H25 R30 K31	F11-M27 HydrophobicContact CB-CE 4.22Å; F11-M27 HydrophobicContact CD1-CE 3.17Å; F11-M27 HydrophobicContact CD2-CE 4.45Å; F11-M27 HydrophobicContact CE1-CE 3.51Å; F11-M27 HydrophobicContact CG-CE 3.7Å; F11-M27 HydrophobicContact CZ-CE 4.29Å; Y23-M27 HydrophobicContact CD1-CG 4.22Å; Y23-M27 HydrophobicContact CD2-CE 4.3Å; Y23-M27 HydrophobicContact CD2-CG 4.37Å; Y23-M27 HydrophobicContact CE1-CG 3.66Å; Y23-M27 HydrophobicContact CE2-CE 3.58Å; Y23-M27 HydrophobicContact CE2-CG 3.85Å; Y23-M27 HydrophobicContact CE2-SD 4.49Å; Y23-M27 VanDerWaalsContact CZ-CG 3.44Å; Y23-M27 PolarHBondContact O-N 3.04Å; H25-M27 PolarHBondContact O-N 3.3Å; M27-R30 PolarHBondContact O-N 2.88Å; M27-K31 WeakPolarHBondContact O-CB 3.46Å; M27-K31 PolarHBondContact O-N 3.29Å
28	S	68.7	Low	67.5	Low	78 Å²	78	84.1 Å²	84.1	55%	0.545	42%	0.424	S	S	.	.	H	α-helix	trans	-61.6	-46.7	172.3	-175.6	0	0	0	0	111.4	T24 H25 K31 S32	T24-S28 VanDerWaalsContact O-CB 3.29Å; T24-S28 WeakPolarHBondContact O-CB 3.28Å; T24-S28 PolarHBondContact O-N 3.38Å; H25-S28 PolarHBondContact O-N 3.31Å; S28-K31 PolarHBondContact O-N 2.93Å; S28-S32 PolarHBondContact O-N 3.33Å
29	Q	66.3	Low	67.6	Low	115 Å²	115	80.5 Å²	80.5	54%	0.537	41%	0.409	S	S	.	.	H	α-helix	trans	-62.3	-45.9	175.2	-71.4	-170.7	0.6	0	0	112.1	H25 I26 K31 S32 Y33	H25-Q29 PolarHBondContact NE2-NE2 3.32Å; H25-Q29 WeakPolarHBondContact O-CG 3.2Å; H25-Q29 PolarHBondContact O-N 3.17Å; I26-Q29 PolarHBondContact O-N 2.94Å; Q29-K31 VanDerWaalsContact C-N 3.33Å; Q29-K31 PolarHBondContact O-N 3.46Å; Q29-S32 PolarHBondContact O-N 2.94Å; Q29-Y33 VanDerWaalsContact O-CB 3.25Å; Q29-Y33 WeakPolarHBondContact O-CB 3.21Å; Q29-Y33 PolarHBondContact O-N 3.44Å
30	R	63.9	Low	67	Low	120 Å²	120	77.8 Å²	77.8	45%	0.453	40%	0.395	S	S	.	.	H	α-helix	trans	-61.3	-41.3	177.1	-75.6	176.7	68.3	122.7	2.9	111.6	I26 M27 Y33 I34	I26-R30 HydrophobicContact CG2-CG 4.32Å; I26-R30 WeakPolarHBondContact O-CB 3.46Å; I26-R30 VanDerWaalsContact O-CG 3.27Å; I26-R30 WeakPolarHBondContact O-CG 3.44Å; I26-R30 PolarHBondContact O-N 3.28Å; M27-R30 PolarHBondContact O-N 2.88Å; R30-Y33 PolarHBondContact O-N 3.15Å; R30-I34 WeakPolarHBondContact O-CB 3.25Å; R30-I34 VanDerWaalsContact O-CG1 3.23Å; R30-I34 WeakPolarHBondContact O-CG1 3.49Å; R30-I34 PolarHBondContact O-N 3.07Å
31	K	66.9	Low	66.7	Low	146 Å²	146	78 Å²	78	64%	0.635	40%	0.395	S	S	*	.	H	α-helix	trans	-66.1	-44.2	178.3	-167.9	174.7	-174.7	175.4	0	111.4	M27 S28 Q29 Y33 I34 I35	M27-K31 WeakPolarHBondContact O-CB 3.46Å; M27-K31 PolarHBondContact O-N 3.29Å; S28-K31 PolarHBondContact O-N 2.93Å; Q29-K31 VanDerWaalsContact C-N 3.33Å; Q29-K31 PolarHBondContact O-N 3.46Å; K31-Y33 VanDerWaalsContact C-N 3.31Å; K31-Y33 PolarHBondContact O-N 3.36Å; K31-I34 PolarHBondContact O-N 3.03Å; K31-I35 HydrophobicContact CG-CD1 4.21Å; K31-I35 VanDerWaalsContact O-CG1 3.25Å; K31-I35 WeakPolarHBondContact O-CG1 3.39Å; K31-I35 PolarHBondContact O-N 3.06Å
32	S	64.3	Low	66.4	Low	64 Å²	64	79.1 Å²	79.1	45%	0.448	39%	0.389	S	S	.	.	H	α-helix	trans	-56.6	-48.6	171.8	-168.8	0	0	0	0	110.6	S28 Q29 I34 I35 D36	S28-S32 PolarHBondContact O-N 3.33Å; Q29-S32 PolarHBondContact O-N 2.94Å; S32-I34 PolarHBondContact O-N 2.81Å; S32-I35 WeakPolarHBondContact O-CB 3.47Å; S32-I35 PolarHBondContact O-N 3.03Å; S32-I35 VanDerWaalsContact O-N 3.16Å; S32-D36 PolarHBondContact O-N 3.35Å
33	Y	62	Low	66	Low	67 Å²	67	76 Å²	76	26%	0.263	37%	0.374	S	S	.	.	H	α-helix	trans	-63.4	-39.1	-178.2	-172.8	-106.6	0	0	0	113.4	Q29 R30 K31 I37 L66	Q29-Y33 VanDerWaalsContact O-CB 3.25Å; Q29-Y33 WeakPolarHBondContact O-CB 3.21Å; Q29-Y33 PolarHBondContact O-N 3.44Å; R30-Y33 PolarHBondContact O-N 3.15Å; K31-Y33 VanDerWaalsContact C-N 3.31Å; K31-Y33 PolarHBondContact O-N 3.36Å; Y33-I37 HydrophobicContact CD1-CD1 3.83Å; Y33-I37 HydrophobicContact CE1-CD1 3.19Å; Y33-I37 HydrophobicContact CE1-CG1 4.09Å; Y33-I37 HydrophobicContact CE2-CD1 4.44Å; Y33-I37 WeakPolarHBondContact O-CG1 3.35Å; Y33-I37 PolarHBondContact O-N 2.85Å; Y33-I37 WeakPolarHBondContact OH-CD1 3.02Å; Y33-L66 HydrophobicContact CD2-CD1 4.27Å; Y33-L66 HydrophobicContact CE1-CD2 4.12Å; Y33-L66 HydrophobicContact CE2-CD1 3.11Å; Y33-L66 HydrophobicContact CE2-CD2 4.15Å; Y33-L66 HydrophobicContact CE2-CG 4.14Å; Y33-L66 VanDerWaalsContact CZ-CD2 3.46Å; Y33-L66 WeakPolarHBondContact OH-CD1 3.41Å; Y33-L66 WeakPolarHBondContact OH-CD2 3.44Å; Y33-L66 VanDerWaalsContact OH-CG 3.26Å; Y33-L66 WeakPolarHBondContact OH-CG 3.49Å
34	I	64	Low	65.6	Low	92 Å²	92	76.9 Å²	76.9	47%	0.472	38%	0.38	S	S	.	.	H	α-helix	trans	-67.5	-41.6	174.6	-70.2	164	0	0	0	110.8	R30 K31 S32 D36 I37 V38	R30-I34 WeakPolarHBondContact O-CB 3.25Å; R30-I34 VanDerWaalsContact O-CG1 3.23Å; R30-I34 WeakPolarHBondContact O-CG1 3.49Å; R30-I34 PolarHBondContact O-N 3.07Å; K31-I34 PolarHBondContact O-N 3.03Å; S32-I34 PolarHBondContact O-N 2.81Å; I34-D36 VanDerWaalsContact C-N 3.33Å; I34-I37 PolarHBondContact O-N 3.22Å; I34-V38 HydrophobicContact CG2-CG2 4.36Å; I34-V38 WeakPolarHBondContact O-CG2 3.39Å; I34-V38 PolarHBondContact O-N 3.32Å
35	I	63.8	Low	65.2	Low	85 Å²	85	80 Å²	80	44%	0.436	39%	0.389	S	S	.	.	H	α-helix	trans	-59.6	-48	175.9	-69.7	165	0	0	0	109.6	K31 S32 I37 V38 E39	K31-I35 HydrophobicContact CG-CD1 4.21Å; K31-I35 VanDerWaalsContact O-CG1 3.25Å; K31-I35 WeakPolarHBondContact O-CG1 3.39Å; K31-I35 PolarHBondContact O-N 3.06Å; S32-I35 WeakPolarHBondContact O-CB 3.47Å; S32-I35 PolarHBondContact O-N 3.03Å; S32-I35 VanDerWaalsContact O-N 3.16Å; I35-I37 VanDerWaalsContact C-N 3.33Å; I35-I37 PolarHBondContact O-N 2.94Å; I35-V38 PolarHBondContact O-N 3.06Å; I35-V38 VanDerWaalsContact O-N 3.15Å; I35-E39 HydrophobicContact CG2-CG 4.41Å; I35-E39 WeakPolarHBondContact O-CG 3.24Å; I35-E39 PolarHBondContact O-N 2.96Å
36	D	67	Low	64.8	Low	53 Å²	53	82.4 Å²	82.4	28%	0.283	40%	0.4	S	S	.	.	H	α-helix	trans	-55	-49.3	177.3	-63.6	-33.4	0	0	0	110.5	S32 I34 V38 E39 I40	S32-D36 PolarHBondContact O-N 3.35Å; I34-D36 VanDerWaalsContact C-N 3.33Å; D36-V38 PolarHBondContact O-N 3.3Å; D36-E39 PolarHBondContact O-N 3Å; D36-I40 WeakPolarHBondContact O-CB 3.18Å; D36-I40 WeakPolarHBondContact O-CD1 2.92Å; D36-I40 WeakPolarHBondContact O-CG1 3.23Å; D36-I40 PolarHBondContact O-N 3.16Å
37	I	66.1	Low	64.3	Low	48 Å²	48	84.6 Å²	84.6	25%	0.246	41%	0.405	C	S	.	.	H	α-helix	trans	-59.2	-46.5	177.5	-70.6	167.8	0	0	0	111.9	Y33 I34 I35 E39 I40 Q41	Y33-I37 HydrophobicContact CD1-CD1 3.83Å; Y33-I37 HydrophobicContact CE1-CD1 3.19Å; Y33-I37 HydrophobicContact CE1-CG1 4.09Å; Y33-I37 HydrophobicContact CE2-CD1 4.44Å; Y33-I37 WeakPolarHBondContact O-CG1 3.35Å; Y33-I37 PolarHBondContact O-N 2.85Å; Y33-I37 WeakPolarHBondContact OH-CD1 3.02Å; I34-I37 PolarHBondContact O-N 3.22Å; I35-I37 VanDerWaalsContact C-N 3.33Å; I35-I37 PolarHBondContact O-N 2.94Å; I37-E39 VanDerWaalsContact C-N 3.32Å; I37-E39 PolarHBondContact O-N 3.32Å; I37-I40 PolarHBondContact O-N 3.39Å; I37-Q41 HydrophobicContact CG2-CG 4.12Å; I37-Q41 WeakPolarHBondContact O-CB 3.47Å; I37-Q41 WeakPolarHBondContact O-CG 3.26Å; I37-Q41 PolarHBondContact O-N 2.86Å
38	V	66.2	Low	64.1	Low	58 Å²	58	91.5 Å²	91.5	35%	0.352	44%	0.443	S	S	.	.	H	α-helix	trans	-64.5	-39.2	-178	170.7	0	0	0	0	110.8	I34 I35 D36 Q41 K42	I34-V38 HydrophobicContact CG2-CG2 4.36Å; I34-V38 WeakPolarHBondContact O-CG2 3.39Å; I34-V38 PolarHBondContact O-N 3.32Å; I35-V38 PolarHBondContact O-N 3.06Å; I35-V38 VanDerWaalsContact O-N 3.15Å; D36-V38 PolarHBondContact O-N 3.3Å; V38-Q41 PolarHBondContact O-N 3.4Å; V38-K42 HydrophobicContact CG1-CD 4.34Å; V38-K42 WeakPolarHBondContact O-CB 3.2Å; V38-K42 VanDerWaalsContact O-CG 3.31Å; V38-K42 WeakPolarHBondContact O-CG 3.25Å; V38-K42 PolarHBondContact O-N 2.88Å
39	E	64.7	Low	63.9	Low	89 Å²	89	90.8 Å²	90.8	42%	0.416	43%	0.433	S	S	.	.	H	α-helix	trans	-66	-41.5	175.2	-69.2	-166.8	115.7	0	0	111.9	I35 D36 I37 K42 Y43 Y60	I35-E39 HydrophobicContact CG2-CG 4.41Å; I35-E39 WeakPolarHBondContact O-CG 3.24Å; I35-E39 PolarHBondContact O-N 2.96Å; D36-E39 PolarHBondContact O-N 3Å; I37-E39 VanDerWaalsContact C-N 3.32Å; I37-E39 PolarHBondContact O-N 3.32Å; E39-K42 PolarHBondContact O-N 2.97Å; E39-Y43 WeakPolarHBondContact O-CB 3.29Å; E39-Y43 PolarHBondContact O-N 3.18Å; E39-Y60 HydrophobicContact CB-CE1 4.45Å
40	I	63.5	Low	63.8	Low	14 Å²	14	93 Å²	93	7%	0.072	44%	0.436	C	S	.	.	H	α-helix	trans	-62.8	-45.3	173.9	-68.5	155.1	0	0	0	110.7	D36 I37 K42 Y43 I44 Y60 I62	D36-I40 WeakPolarHBondContact O-CB 3.18Å; D36-I40 WeakPolarHBondContact O-CD1 2.92Å; D36-I40 WeakPolarHBondContact O-CG1 3.23Å; D36-I40 PolarHBondContact O-N 3.16Å; I37-I40 PolarHBondContact O-N 3.39Å; I40-K42 PolarHBondContact O-N 3.32Å; I40-Y43 WeakPolarHBondContact O-CB 3.39Å; I40-Y43 PolarHBondContact O-N 3.33Å; I40-Y43 VanDerWaalsContact O-N 3.15Å; I40-I44 HydrophobicContact CG2-CD1 3.6Å; I40-I44 HydrophobicContact CG2-CG1 4.21Å; I40-I44 VanDerWaalsContact O-CG1 3.23Å; I40-I44 WeakPolarHBondContact O-CG1 3.12Å; I40-I44 PolarHBondContact O-N 3Å; I40-Y60 HydrophobicContact CD1-CD2 4.36Å; I40-Y60 HydrophobicContact CD1-CG 4.25Å; I40-Y60 HydrophobicContact CG1-CD2 3.57Å; I40-Y60 HydrophobicContact CG1-CE2 4.16Å; I40-Y60 HydrophobicContact CG1-CG 3.87Å; I40-I62 HydrophobicContact CD1-CD1 3.24Å; I40-I62 HydrophobicContact CD1-CG1 3.48Å; I40-I62 VanDerWaalsContact CD1-CG1 3.48Å; I40-I62 HydrophobicContact CG1-CD1 4.05Å; I40-I62 HydrophobicContact CG2-CD1 4.19Å
41	Q	62	Low	64.2	Low	105 Å²	105	94.2 Å²	94.2	49%	0.491	45%	0.447	S	S	.	.	H	α-helix	trans	-62.3	-44.3	177.9	-77.1	179.4	-27.8	0	0	111.7	I37 V38 Y43 I44 Q45	I37-Q41 HydrophobicContact CG2-CG 4.12Å; I37-Q41 WeakPolarHBondContact O-CB 3.47Å; I37-Q41 WeakPolarHBondContact O-CG 3.26Å; I37-Q41 PolarHBondContact O-N 2.86Å; V38-Q41 PolarHBondContact O-N 3.4Å; Q41-Y43 VanDerWaalsContact C-N 3.31Å; Q41-Y43 PolarHBondContact O-N 2.85Å; Q41-I44 PolarHBondContact O-N 3.47Å; Q41-Q45 WeakPolarHBondContact O-CB 3.2Å; Q41-Q45 WeakPolarHBondContact O-CG 3.27Å; Q41-Q45 PolarHBondContact O-N 3.18Å
42	K	65.9	Low	63.9	Low	120 Å²	120	89.9 Å²	89.9	52%	0.522	43%	0.429	S	S	.	.	H	α-helix	trans	-58.1	-45.6	172.4	-74.8	173.5	-179.6	177.5	0	110.9	V38 E39 I40 I44 Q45 H46	V38-K42 HydrophobicContact CG1-CD 4.34Å; V38-K42 WeakPolarHBondContact O-CB 3.2Å; V38-K42 VanDerWaalsContact O-CG 3.31Å; V38-K42 WeakPolarHBondContact O-CG 3.25Å; V38-K42 PolarHBondContact O-N 2.88Å; E39-K42 PolarHBondContact O-N 2.97Å; I40-K42 PolarHBondContact O-N 3.32Å; K42-I44 PolarHBondContact O-N 2.91Å; K42-Q45 PolarHBondContact O-N 3.16Å; K42-H46 PolarHBondContact O-CD2 3.19Å; K42-H46 PolarHBondContact O-N 3.22Å
43	Y	62.4	Low	63.8	Low	46 Å²	46	88.5 Å²	88.5	18%	0.18	42%	0.416	C	S	.	.	H	α-helix	trans	-60.1	-44.2	178.6	-174	-81.6	0	0	0	112.1	E39 I40 Q41 R47 Q52 A56	E39-Y43 WeakPolarHBondContact O-CB 3.29Å; E39-Y43 PolarHBondContact O-N 3.18Å; I40-Y43 WeakPolarHBondContact O-CB 3.39Å; I40-Y43 PolarHBondContact O-N 3.33Å; I40-Y43 VanDerWaalsContact O-N 3.15Å; Q41-Y43 VanDerWaalsContact C-N 3.31Å; Q41-Y43 PolarHBondContact O-N 2.85Å; Y43-R47 WeakPolarHBondContact O-CB 3.39Å; Y43-R47 PolarHBondContact OH-NH1 2.81Å; Y43-Q52 HydrophobicContact CE1-CB 4.09Å; Y43-Q52 VanDerWaalsContact CE1-O 3.26Å; Y43-Q52 WeakPolarHBondContact CE1-O 3.49Å; Y43-A56 HydrophobicContact CD1-CB 3.46Å; Y43-A56 VanDerWaalsContact CD1-CB 3.46Å; Y43-A56 HydrophobicContact CE1-CB 3.62Å; Y43-A56 HydrophobicContact CG-CB 4.07Å
44	I	61.4	Low	64.1	Low	43 Å²	43	88.2 Å²	88.2	22%	0.221	43%	0.428	C	S	.	.	H	α-helix	trans	-70	-43.4	179.3	-64.4	172.4	0	0	0	111.4	I40 Q41 K42 H46 R47 I53	I40-I44 HydrophobicContact CG2-CD1 3.6Å; I40-I44 HydrophobicContact CG2-CG1 4.21Å; I40-I44 VanDerWaalsContact O-CG1 3.23Å; I40-I44 WeakPolarHBondContact O-CG1 3.12Å; I40-I44 PolarHBondContact O-N 3Å; Q41-I44 PolarHBondContact O-N 3.47Å; K42-I44 PolarHBondContact O-N 2.91Å; I44-H46 PolarHBondContact O-N 2.98Å; I44-H46 VanDerWaalsContact O-N 3.17Å; I44-R47 CarbonylContact O-C 3.4Å; I44-R47 PolarHBondContact O-N 3.42Å; I44-I53 HydrophobicContact CD1-CG1 4.48Å; I44-I53 HydrophobicContact CD1-CG2 3.83Å; I44-I53 HydrophobicContact CG1-CB 4.46Å; I44-I53 HydrophobicContact CG1-CG1 4.03Å; I44-I53 HydrophobicContact CG1-CG2 4.18Å; I44-I53 HydrophobicContact CG2-CD1 3.82Å; I44-I53 HydrophobicContact CG2-CG1 4.08Å
45	Q	63.4	Low	64.4	Low	144 Å²	144	88.8 Å²	88.8	67%	0.673	43%	0.428	S	S	*	.	H	α-helix	trans	-59	-30.9	-178.1	-80.1	175	-15.1	0	0	113.4	Q41 K42 R47	Q41-Q45 WeakPolarHBondContact O-CB 3.2Å; Q41-Q45 WeakPolarHBondContact O-CG 3.27Å; Q41-Q45 PolarHBondContact O-N 3.18Å; K42-Q45 PolarHBondContact O-N 3.16Å; Q45-R47 VanDerWaalsContact C-N 3.29Å
46	H	65.5	Low	64.3	Low	161 Å²	161	84.8 Å²	84.8	75%	0.745	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	3.5	177.1	-65.6	-59.3	0	0	0	113.5	K42 I44	K42-H46 PolarHBondContact O-CD2 3.19Å; K42-H46 PolarHBondContact O-N 3.22Å; I44-H46 PolarHBondContact O-N 2.98Å; I44-H46 VanDerWaalsContact O-N 3.17Å
47	R	55.3	Low	64.2	Low	97 Å²	97	83.4 Å²	83.4	37%	0.366	40%	0.401	S	S	.	.			trans	-145.1	103.8	-166.1	-77.1	-171.9	-176.4	-133.6	9.5	112.2	Y43 I44 Q45 N49 Q52	Y43-R47 WeakPolarHBondContact O-CB 3.39Å; Y43-R47 PolarHBondContact OH-NH1 2.81Å; I44-R47 CarbonylContact O-C 3.4Å; I44-R47 PolarHBondContact O-N 3.42Å; Q45-R47 VanDerWaalsContact C-N 3.29Å; R47-N49 PolarHBondContact O-N 3.36Å; R47-Q52 HydrophobicContact CB-CB 4.21Å; R47-Q52 VanDerWaalsContact CD-CD 3.47Å; R47-Q52 VanDerWaalsContact CD-OE1 3.23Å
48	N	62.3	Low	64.5	Low	176 Å²	176	89.1 Å²	89.1	94%	0.941	42%	0.424	S	S	*	.			trans	-81.3	17.5	177.3	-70.5	-22	0	0	0	114.4
49	N	65.8	Low	64.4	Low	63 Å²	63	91.2 Å²	91.2	34%	0.337	43%	0.433	S	S	.	.			trans	-110.2	121.8	-178.4	-175	-4.2	0	0	0	111.3	R47 E51 Q52 I53	R47-N49 PolarHBondContact O-N 3.36Å; N49-E51 PolarHBondContact ND2-OE2 3.34Å; N49-E51 PolarHBondContact O-N 2.94Å; N49-E51 VanDerWaalsContact O-N 3.16Å; N49-E51 PolarHBondContact OD1-N 3.32Å; N49-Q52 HydrophobicContact CB-CG 4.01Å; N49-Q52 WeakPolarHBondContact O-CB 3.09Å; N49-Q52 PolarHBondContact O-N 3.09Å; N49-I53 PolarHBondContact O-N 3.45Å
50	R	63.9	Low	64.5	Low	163 Å²	163	90.4 Å²	90.4	62%	0.615	43%	0.427	S	S	*	.	H	α-helix	trans	-51.4	-35.7	176	-65.8	-175.7	73.7	138.7	2.4	112.8	Q52 I53 A54 E73	R50-Q52 VanDerWaalsContact C-N 3.25Å; R50-Q52 PolarHBondContact O-N 2.97Å; R50-I53 PolarHBondContact O-N 3.28Å; R50-A54 PolarHBondContact O-N 2.95Å; R50-E73 PolarHBondContact NH2-OXT 3.01Å
51	E	71.4	Confident	64.5	Low	145 Å²	145	98.2 Å²	98.2	68%	0.678	46%	0.46	S	S	*	.	H	α-helix	trans	-63.2	-33.1	177.7	-64.7	179.4	150.2	0	0	112.5	N49 H55	N49-E51 PolarHBondContact ND2-OE2 3.34Å; N49-E51 PolarHBondContact O-N 2.94Å; N49-E51 VanDerWaalsContact O-N 3.16Å; N49-E51 PolarHBondContact OD1-N 3.32Å; E51-H55 WeakPolarHBondContact O-CB 3.5Å; E51-H55 PolarHBondContact O-N 3.02Å
52	Q	61.5	Low	64.5	Low	55 Å²	55	94.3 Å²	94.3	26%	0.257	44%	0.442	S	S	.	.	H	α-helix	trans	-75.2	-37.8	-179.8	-63	175.7	-31.7	0	0	110.5	Y43 R47 N49 R50 H55 A56	Y43-Q52 HydrophobicContact CE1-CB 4.09Å; Y43-Q52 VanDerWaalsContact CE1-O 3.26Å; Y43-Q52 WeakPolarHBondContact CE1-O 3.49Å; R47-Q52 HydrophobicContact CB-CB 4.21Å; R47-Q52 VanDerWaalsContact CD-CD 3.47Å; R47-Q52 VanDerWaalsContact CD-OE1 3.23Å; N49-Q52 HydrophobicContact CB-CG 4.01Å; N49-Q52 WeakPolarHBondContact O-CB 3.09Å; N49-Q52 PolarHBondContact O-N 3.09Å; R50-Q52 VanDerWaalsContact C-N 3.25Å; R50-Q52 PolarHBondContact O-N 2.97Å; Q52-H55 PolarHBondContact O-N 3.3Å; Q52-A56 PolarHBondContact O-N 2.9Å
53	I	62.8	Low	64.1	Low	34 Å²	34	92.2 Å²	92.2	17%	0.174	44%	0.441	C	S	.	.	H	α-helix	trans	-58.9	-51.6	171.9	-53.2	-174.5	0	0	0	109.8	I44 N49 R50 H55 A56 V57 I72	I44-I53 HydrophobicContact CD1-CG1 4.48Å; I44-I53 HydrophobicContact CD1-CG2 3.83Å; I44-I53 HydrophobicContact CG1-CB 4.46Å; I44-I53 HydrophobicContact CG1-CG1 4.03Å; I44-I53 HydrophobicContact CG1-CG2 4.18Å; I44-I53 HydrophobicContact CG2-CD1 3.82Å; I44-I53 HydrophobicContact CG2-CG1 4.08Å; N49-I53 PolarHBondContact O-N 3.45Å; R50-I53 PolarHBondContact O-N 3.28Å; I53-H55 VanDerWaalsContact C-N 3.28Å; I53-H55 PolarHBondContact O-N 3.08Å; I53-A56 PolarHBondContact O-N 3.34Å; I53-A56 VanDerWaalsContact O-N 3.15Å; I53-V57 HydrophobicContact CG2-CG2 4.24Å; I53-V57 WeakPolarHBondContact O-CB 3.35Å; I53-V57 WeakPolarHBondContact O-CG2 3.38Å; I53-V57 PolarHBondContact O-N 2.84Å; I53-I72 HydrophobicContact CG2-CG2 4.42Å
54	A	67.9	Low	63.9	Low	61 Å²	61	94.5 Å²	94.5	50%	0.504	46%	0.459	S	S	.	.	H	α-helix	trans	-59.5	-38.1	177.8	0	0	0	0	0	112.7	R50 K58	R50-A54 PolarHBondContact O-N 2.95Å; A54-K58 WeakPolarHBondContact O-CB 3.31Å; A54-K58 PolarHBondContact O-N 2.84Å
55	H	69.5	Low	63.6	Low	105 Å²	105	100.1 Å²	100.1	49%	0.486	48%	0.482	S	S	.	.	H	α-helix	trans	-65.2	-44.2	175.1	-174.4	66.8	0	0	0	112.4	E51 Q52 I53 K58 L59	E51-H55 WeakPolarHBondContact O-CB 3.5Å; E51-H55 PolarHBondContact O-N 3.02Å; Q52-H55 PolarHBondContact O-N 3.3Å; I53-H55 VanDerWaalsContact C-N 3.28Å; I53-H55 PolarHBondContact O-N 3.08Å; H55-K58 PolarHBondContact O-N 3.18Å; H55-L59 VanDerWaalsContact O-CB 3.28Å; H55-L59 WeakPolarHBondContact O-CB 3.29Å; H55-L59 PolarHBondContact O-N 2.86Å
56	A	61.9	Low	63.1	Low	0 Å²	0	94.5 Å²	94.5	0%	0	46%	0.457	C	S	.	.	H	α-helix	trans	-63	-47.2	175.4	0	0	0	0	0	111.5	Y43 Q52 I53 K58 L59 Y60	Y43-A56 HydrophobicContact CD1-CB 3.46Å; Y43-A56 VanDerWaalsContact CD1-CB 3.46Å; Y43-A56 HydrophobicContact CE1-CB 3.62Å; Y43-A56 HydrophobicContact CG-CB 4.07Å; Q52-A56 PolarHBondContact O-N 2.9Å; I53-A56 PolarHBondContact O-N 3.34Å; I53-A56 VanDerWaalsContact O-N 3.15Å; A56-K58 PolarHBondContact O-N 2.9Å; A56-L59 PolarHBondContact O-N 2.86Å; A56-Y60 HydrophobicContact CB-CD2 4.11Å; A56-Y60 HydrophobicContact CB-CE2 4.19Å; A56-Y60 WeakPolarHBondContact O-CD2 3.43Å; A56-Y60 PolarHBondContact O-N 2.97Å
57	V	65.7	Low	62.4	Low	24 Å²	24	89.1 Å²	89.1	15%	0.145	43%	0.433	C	S	.	.	H	α-helix	trans	-51.3	-44.5	175.5	169.3	0	0	0	0	111.2	I53 K61 I62 I67	I53-V57 HydrophobicContact CG2-CG2 4.24Å; I53-V57 WeakPolarHBondContact O-CB 3.35Å; I53-V57 WeakPolarHBondContact O-CG2 3.38Å; I53-V57 PolarHBondContact O-N 2.84Å; V57-K61 PolarHBondContact O-N 3.39Å; V57-I62 HydrophobicContact CB-CD1 4.03Å; V57-I62 HydrophobicContact CG1-CB 4.24Å; V57-I62 HydrophobicContact CG1-CD1 4.21Å; V57-I62 HydrophobicContact CG2-CD1 3.78Å; V57-I62 PolarHBondContact O-N 3.48Å; V57-I67 HydrophobicContact CG1-CD1 3.35Å; V57-I67 HydrophobicContact CG1-CG1 4.19Å
58	K	70.7	Confident	62.2	Low	169 Å²	169	91.5 Å²	91.5	74%	0.735	45%	0.449	S	S	*	.	H	α-helix	trans	-69.6	-43.9	175.4	-170.2	178.2	-178.1	177.5	0	112.9	A54 H55 A56 K61	A54-K58 WeakPolarHBondContact O-CB 3.31Å; A54-K58 PolarHBondContact O-N 2.84Å; H55-K58 PolarHBondContact O-N 3.18Å; A56-K58 PolarHBondContact O-N 2.9Å; K58-K61 PolarHBondContact O-N 2.74Å
59	L	64.5	Low	61.6	Low	102 Å²	102	90.4 Å²	90.4	53%	0.534	44%	0.435	S	S	.	.	H	α-helix	trans	-62.4	-47.8	-177.6	-178.4	67.4	0	0	0	111.6	H55 A56 K61	H55-L59 VanDerWaalsContact O-CB 3.28Å; H55-L59 WeakPolarHBondContact O-CB 3.29Å; H55-L59 PolarHBondContact O-N 2.86Å; A56-L59 PolarHBondContact O-N 2.86Å; L59-K61 PolarHBondContact O-N 3.24Å
60	Y	66.6	Low	60.9	Low	72 Å²	72	93.6 Å²	93.6	28%	0.282	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	4.2	179.1	-65.2	-75.3	0	0	0	112.8	E39 I40 A56 I62	E39-Y60 HydrophobicContact CB-CE1 4.45Å; I40-Y60 HydrophobicContact CD1-CD2 4.36Å; I40-Y60 HydrophobicContact CD1-CG 4.25Å; I40-Y60 HydrophobicContact CG1-CD2 3.57Å; I40-Y60 HydrophobicContact CG1-CE2 4.16Å; I40-Y60 HydrophobicContact CG1-CG 3.87Å; A56-Y60 HydrophobicContact CB-CD2 4.11Å; A56-Y60 HydrophobicContact CB-CE2 4.19Å; A56-Y60 WeakPolarHBondContact O-CD2 3.43Å; A56-Y60 PolarHBondContact O-N 2.97Å; Y60-I62 PolarHBondContact O-N 3.1Å; Y60-I62 VanDerWaalsContact O-N 3.16Å
61	K	64.7	Low	60.1	Low	178 Å²	178	92 Å²	92	77%	0.774	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	42.3	-179.5	-58.1	178.1	-179.3	175.9	0	112	V57 K58 L59 P63	V57-K61 PolarHBondContact O-N 3.39Å; K58-K61 PolarHBondContact O-N 2.74Å; L59-K61 PolarHBondContact O-N 3.24Å; K61-P63 WeakPolarHBondContact O-CD 3.28Å; K61-P63 VanDerWaalsContact O-N 3.08Å
62	I	60.5	Low	59.2	Low	23 Å²	23	88.4 Å²	88.4	12%	0.118	43%	0.432	C	S	.	.			trans	-57.1	121.6	-178.8	-56.5	178	0	0	0	107.4	I40 V57 Y60 T64 L66 I67	I40-I62 HydrophobicContact CD1-CD1 3.24Å; I40-I62 HydrophobicContact CD1-CG1 3.48Å; I40-I62 VanDerWaalsContact CD1-CG1 3.48Å; I40-I62 HydrophobicContact CG1-CD1 4.05Å; I40-I62 HydrophobicContact CG2-CD1 4.19Å; V57-I62 HydrophobicContact CB-CD1 4.03Å; V57-I62 HydrophobicContact CG1-CB 4.24Å; V57-I62 HydrophobicContact CG1-CD1 4.21Å; V57-I62 HydrophobicContact CG2-CD1 3.78Å; V57-I62 PolarHBondContact O-N 3.48Å; Y60-I62 PolarHBondContact O-N 3.1Å; Y60-I62 VanDerWaalsContact O-N 3.16Å; I62-T64 PolarHBondContact O-N 3.33Å; I62-L66 HydrophobicContact CG2-CB 3.98Å; I62-L66 HydrophobicContact CG2-CD1 4.03Å; I62-I67 HydrophobicContact CG2-CG1 4.32Å
63	P	58.6	Low	58.5	Low	75 Å²	75	94.3 Å²	94.3	49%	0.487	46%	0.46	S	S	.	.			trans	-53.1	125.8	173	-23.5	28.4	0	0	0	109.9	K61 K65 L66	K61-P63 WeakPolarHBondContact O-CD 3.28Å; K61-P63 VanDerWaalsContact O-N 3.08Å; P63-K65 PolarHBondContact O-N 3.06Å; P63-L66 HydrophobicContact CB-CD1 3.93Å; P63-L66 HydrophobicContact CG-CD1 3.79Å; P63-L66 WeakPolarHBondContact O-CB 3.4Å; P63-L66 PolarHBondContact O-N 3.26Å
64	T	58.7	Low	58.3	Low	94 Å²	94	97.4 Å²	97.4	58%	0.577	47%	0.474	S	S	*	.	H	α-helix	trans	-50.4	-32.7	-179.9	44.7	0	0	0	0	112.9	I62 L66 I67 E68	I62-T64 PolarHBondContact O-N 3.33Å; T64-L66 PolarHBondContact O-N 2.93Å; T64-I67 WeakPolarHBondContact O-CB 3.33Å; T64-I67 PolarHBondContact O-N 3.15Å; T64-E68 WeakPolarHBondContact O-CG 3.39Å; T64-E68 PolarHBondContact O-N 3.21Å
65	K	55.5	Low	57.8	Low	161 Å²	161	99.3 Å²	99.3	70%	0.7	47%	0.472	S	S	*	.	H	α-helix	trans	-51.2	-23.4	172.8	-63.7	-174	177.5	-177	0	114.7	P63 K69	P63-K65 PolarHBondContact O-N 3.06Å; K65-K69 VanDerWaalsContact O-CB 3.24Å; K65-K69 WeakPolarHBondContact O-CB 3.45Å; K65-K69 PolarHBondContact O-N 2.71Å
66	L	52.3	Low	57.1	Low	27 Å²	27	98.9 Å²	98.9	14%	0.141	47%	0.471	C	S	.	.	H	α-helix	trans	-92.3	-34.8	-179.5	-66.9	155.4	0	0	0	112.5	Y33 I62 P63 T64 E68 K69 Y70	Y33-L66 HydrophobicContact CD2-CD1 4.27Å; Y33-L66 HydrophobicContact CE1-CD2 4.12Å; Y33-L66 HydrophobicContact CE2-CD1 3.11Å; Y33-L66 HydrophobicContact CE2-CD2 4.15Å; Y33-L66 HydrophobicContact CE2-CG 4.14Å; Y33-L66 VanDerWaalsContact CZ-CD2 3.46Å; Y33-L66 WeakPolarHBondContact OH-CD1 3.41Å; Y33-L66 WeakPolarHBondContact OH-CD2 3.44Å; Y33-L66 VanDerWaalsContact OH-CG 3.26Å; Y33-L66 WeakPolarHBondContact OH-CG 3.49Å; I62-L66 HydrophobicContact CG2-CB 3.98Å; I62-L66 HydrophobicContact CG2-CD1 4.03Å; P63-L66 HydrophobicContact CB-CD1 3.93Å; P63-L66 HydrophobicContact CG-CD1 3.79Å; P63-L66 WeakPolarHBondContact O-CB 3.4Å; P63-L66 PolarHBondContact O-N 3.26Å; T64-L66 PolarHBondContact O-N 2.93Å; L66-E68 VanDerWaalsContact C-N 3.27Å; L66-K69 PolarHBondContact O-N 3.28Å; L66-Y70 HydrophobicContact CD2-CE2 4.1Å; L66-Y70 WeakPolarHBondContact O-CB 3.46Å; L66-Y70 WeakPolarHBondContact O-CD2 3.46Å; L66-Y70 PolarHBondContact O-N 2.95Å
67	I	51.3	Low	56.8	Low	47 Å²	47	104.8 Å²	104.8	24%	0.241	50%	0.499	C	S	.	.	H	α-helix	trans	-59.8	-46.1	169	-55.2	170.2	0	0	0	108.4	V57 I62 T64 D71 I72	V57-I67 HydrophobicContact CG1-CD1 3.35Å; V57-I67 HydrophobicContact CG1-CG1 4.19Å; I62-I67 HydrophobicContact CG2-CG1 4.32Å; T64-I67 WeakPolarHBondContact O-CB 3.33Å; T64-I67 PolarHBondContact O-N 3.15Å; I67-D71 WeakPolarHBondContact O-CA 3.44Å; I67-D71 PolarHBondContact O-N 3.25Å; I67-I72 HydrophobicContact CG2-CB 4.4Å; I67-I72 WeakPolarHBondContact CG2-O 3.27Å; I67-I72 PolarHBondContact O-N 3.13Å
68	E	50.2	Low	56.3	Low	148 Å²	148	109.8 Å²	109.8	69%	0.692	52%	0.521	S	S	*	.	H	α-helix	trans	-64.5	-37.8	175.9	-68.5	170.9	175.6	0	0	112.9	T64 L66	T64-E68 WeakPolarHBondContact O-CG 3.39Å; T64-E68 PolarHBondContact O-N 3.21Å; L66-E68 VanDerWaalsContact C-N 3.27Å
69	K	49.4	Very low	55.3	Low	152 Å²	152	105.9 Å²	105.9	66%	0.661	51%	0.507	S	S	*	.	H	α-helix	trans	-73.4	-35.3	-178.9	-177.3	175.9	180	-179.3	0	113.2	K65 L66	K65-K69 VanDerWaalsContact O-CB 3.24Å; K65-K69 WeakPolarHBondContact O-CB 3.45Å; K65-K69 PolarHBondContact O-N 2.71Å; L66-K69 PolarHBondContact O-N 3.28Å
70	Y	52.1	Low	54.6	Low	131 Å²	131	106.1 Å²	106.1	51%	0.514	51%	0.505	S	S	.	.	H	α-helix	trans	-105.4	2.7	-175.1	-69.5	-70.3	0	0	0	113.9	L66 I72	L66-Y70 HydrophobicContact CD2-CE2 4.1Å; L66-Y70 WeakPolarHBondContact O-CB 3.46Å; L66-Y70 WeakPolarHBondContact O-CD2 3.46Å; L66-Y70 PolarHBondContact O-N 2.95Å; Y70-I72 VanDerWaalsContact C-N 3.33Å; Y70-I72 PolarHBondContact O-N 2.9Å
71	D	47.4	Very low	53.7	Low	128 Å²	128	108.8 Å²	108.8	68%	0.684	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	51.1	179.1	-157.9	29.3	0	0	0	112.5	I67 E73	I67-D71 WeakPolarHBondContact O-CA 3.44Å; I67-D71 PolarHBondContact O-N 3.25Å; D71-E73 PolarHBondContact O-N 2.89Å
72	I	51.6	Low	52.8	Low	70 Å²	70	103 Å²	103	36%	0.359	50%	0.501	S	S	.	.			trans	-84.4	85.6	177.6	-52.1	176	0	0	0	107.9	I53 I67 Y70	I53-I72 HydrophobicContact CG2-CG2 4.42Å; I67-I72 HydrophobicContact CG2-CB 4.4Å; I67-I72 WeakPolarHBondContact CG2-O 3.27Å; I67-I72 PolarHBondContact O-N 3.13Å; Y70-I72 VanDerWaalsContact C-N 3.33Å; Y70-I72 PolarHBondContact O-N 2.9Å
73	E	46.2	Very low	52.1	Low	180 Å²	180	110.3 Å²	110.3	84%	0.841	54%	0.536	S	S	*	.			trans	-71.4	0	172.8	-71.9	-165.6	115.6	0	0	114.9	R50 D71	R50-E73 PolarHBondContact NH2-OXT 3.01Å; D71-E73 PolarHBondContact O-N 2.89Å

Retrieved 73 of 73 residues in 17.8 ms (Link to these results)

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