A0A077ZH47_TRITR Loading...

Heparan sulfate glucosamine 3-O-sulfotransferase 3A1

AlphaFold DB , UniProt , Accession A0A077ZH47, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 91 aa.

						>A0A077ZH47_TRITR|A0A077ZH47
MPKYVRLFGIFHHLILSAAFMIVRSNDDLKAKTDDDQILRKHLPRAIIIGAKKAGTRALLEYLRLHNMVKAPGPEVHFFDRYYNRGLKWYK
					

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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	62.9	Low	77.1	Confident	217 Å²	217	135.5 Å²	135.5	100%	1.069	65%	0.653	S	S	*	*				0	125.3	0	-70.2	-172.7	169.8	0	0	109.1	K3	M1-K3 PolarHBondContact O-N 2.98Å
2	P	70.7	Confident	78.2	Confident	85 Å²	85	132.3 Å²	132.3	55%	0.552	64%	0.636	S	S	*	*			trans	-66	127.3	-173.9	15.5	-15.5	0	0	0	110.1	Y4 V5	P2-Y4 HydrophobicContact CB-CD2 4.48Å; P2-Y4 PolarHBondContact O-N 3.5Å; P2-V5 HydrophobicContact CG-CG2 3.91Å; P2-V5 PolarHBondContact O-N 3.46Å
3	K	68.3	Low	79.2	Confident	190 Å²	190	132.6 Å²	132.6	83%	0.826	64%	0.635	S	S	*	*	H	α-helix	trans	-53.1	-24.6	-177.5	-68.1	177.7	176.9	177.1	0	113	M1 V5 R6 L7	M1-K3 PolarHBondContact O-N 2.98Å; K3-V5 PolarHBondContact O-N 3.21Å; K3-R6 PolarHBondContact O-N 3.48Å; K3-L7 PolarHBondContact O-N 3.43Å
4	Y	73.9	Confident	80.2	Confident	185 Å²	185	130.9 Å²	130.9	73%	0.725	63%	0.631	S	S	*	*	H	α-helix	trans	-63.4	-30.8	177.3	-59.7	-73.2	0	0	0	114.9	P2 R6 L7 F8	P2-Y4 HydrophobicContact CB-CD2 4.48Å; P2-Y4 PolarHBondContact O-N 3.5Å; Y4-R6 VanDerWaalsContact C-N 3.34Å; Y4-R6 PolarHBondContact O-N 2.97Å; Y4-L7 PolarHBondContact O-N 3.36Å; Y4-F8 PolarHBondContact O-N 3.05Å
5	V	75.1	Confident	81.2	Confident	99 Å²	99	129.6 Å²	129.6	60%	0.6	63%	0.627	S	S	*	*	H	α-helix	trans	-66.9	-38.8	-178.6	-179.7	0	0	0	0	111	P2 K3 L7 G9	P2-V5 HydrophobicContact CG-CG2 3.91Å; P2-V5 PolarHBondContact O-N 3.46Å; K3-V5 PolarHBondContact O-N 3.21Å; V5-L7 VanDerWaalsContact C-N 3.34Å; V5-G9 PolarHBondContact O-N 2.93Å
6	R	74.9	Confident	82	Confident	202 Å²	202	127.4 Å²	127.4	76%	0.762	62%	0.619	S	S	*	*	H	α-helix	trans	-67.2	-37.7	174.9	-69	-173.2	-173.5	171.4	1.1	111.7	K3 Y4 G9 I10	K3-R6 PolarHBondContact O-N 3.48Å; Y4-R6 VanDerWaalsContact C-N 3.34Å; Y4-R6 PolarHBondContact O-N 2.97Å; R6-G9 PolarHBondContact O-N 2.95Å; R6-I10 WeakPolarHBondContact O-CG1 3.44Å; R6-I10 PolarHBondContact O-N 3.38Å
7	L	77.4	Confident	82.7	Confident	93 Å²	93	123.7 Å²	123.7	49%	0.487	61%	0.609	S	S	.	*	H	α-helix	trans	-64.8	-46.3	178.7	-159.3	75	0	0	0	111	K3 Y4 V5 G9 I10 F11	K3-L7 PolarHBondContact O-N 3.43Å; Y4-L7 PolarHBondContact O-N 3.36Å; V5-L7 VanDerWaalsContact C-N 3.34Å; L7-G9 VanDerWaalsContact C-N 3.32Å; L7-G9 PolarHBondContact O-N 3.3Å; L7-I10 PolarHBondContact O-N 3.04Å; L7-F11 HydrophobicContact CD1-CE2 4.16Å; L7-F11 HydrophobicContact CD2-CE2 4.03Å; L7-F11 HydrophobicContact CG-CD2 3.93Å; L7-F11 HydrophobicContact CG-CE2 3.73Å; L7-F11 VanDerWaalsContact O-CD2 3.29Å; L7-F11 WeakPolarHBondContact O-CD2 3.42Å; L7-F11 PolarHBondContact O-N 3.18Å
8	F	82.5	Confident	83.4	Confident	157 Å²	157	119.7 Å²	119.7	69%	0.689	60%	0.598	S	S	*	*	H	α-helix	trans	-59.4	-40.2	177.4	-171.7	-96.3	0	0	0	112.7	Y4 I10 F11 H12	Y4-F8 PolarHBondContact O-N 3.05Å; F8-I10 PolarHBondContact O-N 2.97Å; F8-F11 PolarHBondContact O-N 3.24Å; F8-H12 WeakPolarHBondContact O-CB 3.29Å; F8-H12 PolarHBondContact O-N 3.44Å
9	G	84.4	Confident	84	Confident	41 Å²	41	115.9 Å²	115.9	42%	0.423	59%	0.588	S	S	.	*	H	α-helix	trans	-61.7	-41.1	175.7	0	0	0	0	0	113.4	V5 R6 L7 H13	V5-G9 PolarHBondContact O-N 2.93Å; R6-G9 PolarHBondContact O-N 2.95Å; L7-G9 VanDerWaalsContact C-N 3.32Å; L7-G9 PolarHBondContact O-N 3.3Å; G9-H13 WeakPolarHBondContact O-CB 3.27Å; G9-H13 PolarHBondContact O-N 3.45Å
10	I	88.7	Confident	84.6	Confident	102 Å²	102	116.8 Å²	116.8	52%	0.523	59%	0.588	S	S	.	*	H	α-helix	trans	-66.5	-45.4	177.1	-63.9	163.6	0	0	0	110.5	R6 L7 F8 H13 L14	R6-I10 WeakPolarHBondContact O-CG1 3.44Å; R6-I10 PolarHBondContact O-N 3.38Å; L7-I10 PolarHBondContact O-N 3.04Å; F8-I10 PolarHBondContact O-N 2.97Å; I10-H13 PolarHBondContact O-N 3.33Å; I10-L14 HydrophobicContact CG2-CD1 4.07Å; I10-L14 WeakPolarHBondContact O-CG 3.3Å; I10-L14 PolarHBondContact O-N 3.48Å
11	F	89.6	Confident	85	Confident	120 Å²	120	117.5 Å²	117.5	53%	0.526	59%	0.591	S	S	.	*	H	α-helix	trans	-61.5	-44.7	177.5	-86.7	-77.8	0	0	0	112.2	L7 F8 H13 L14 I15	L7-F11 HydrophobicContact CD1-CE2 4.16Å; L7-F11 HydrophobicContact CD2-CE2 4.03Å; L7-F11 HydrophobicContact CG-CD2 3.93Å; L7-F11 HydrophobicContact CG-CE2 3.73Å; L7-F11 VanDerWaalsContact O-CD2 3.29Å; L7-F11 WeakPolarHBondContact O-CD2 3.42Å; L7-F11 PolarHBondContact O-N 3.18Å; F8-F11 PolarHBondContact O-N 3.24Å; F11-H13 VanDerWaalsContact C-N 3.34Å; F11-H13 PolarHBondContact O-N 3.06Å; F11-L14 PolarHBondContact O-N 3.36Å; F11-I15 VanDerWaalsContact O-CG1 3.27Å; F11-I15 WeakPolarHBondContact O-CG1 3.37Å; F11-I15 PolarHBondContact O-N 3.25Å
12	H	89.9	Confident	86.5	Confident	97 Å²	97	112.3 Å²	112.3	45%	0.449	57%	0.566	S	S	.	*	H	α-helix	trans	-62.3	-41.4	177.3	-174.3	-102.5	0	0	0	112.1	F8 I15 L16	F8-H12 WeakPolarHBondContact O-CB 3.29Å; F8-H12 PolarHBondContact O-N 3.44Å; H12-I15 PolarHBondContact O-N 3.44Å; H12-L16 WeakPolarHBondContact CE1-CD1 3.32Å; H12-L16 WeakPolarHBondContact O-CB 3.43Å; H12-L16 WeakPolarHBondContact O-CG 3.38Å; H12-L16 PolarHBondContact O-N 3.4Å
13	H	90.9	Very high	87.6	Confident	136 Å²	136	112.1 Å²	112.1	63%	0.63	56%	0.563	S	S	*	*	H	α-helix	trans	-67.8	-35.2	178	-155.7	-66.5	0	0	0	112.5	G9 I10 F11 S17	G9-H13 WeakPolarHBondContact O-CB 3.27Å; G9-H13 PolarHBondContact O-N 3.45Å; I10-H13 PolarHBondContact O-N 3.33Å; F11-H13 VanDerWaalsContact C-N 3.34Å; F11-H13 PolarHBondContact O-N 3.06Å; H13-S17 WeakPolarHBondContact O-CB 3.46Å; H13-S17 PolarHBondContact O-N 2.91Å
14	L	94.1	Very high	88.8	Confident	109 Å²	109	109.8 Å²	109.8	57%	0.571	55%	0.549	S	S	*	.	H	α-helix	trans	-64.9	-44.6	172.2	-77.2	167.9	0	0	0	111.6	I10 F11 S17 A18	I10-L14 HydrophobicContact CG2-CD1 4.07Å; I10-L14 WeakPolarHBondContact O-CG 3.3Å; I10-L14 PolarHBondContact O-N 3.48Å; F11-L14 PolarHBondContact O-N 3.36Å; L14-S17 PolarHBondContact O-N 3.31Å; L14-A18 WeakPolarHBondContact O-CB 3.42Å; L14-A18 PolarHBondContact O-N 2.88Å
15	I	94.3	Very high	89.8	Confident	111 Å²	111	104 Å²	104	57%	0.569	54%	0.536	S	S	*	.	H	α-helix	trans	-63.1	-46.8	177.7	-67.5	164.1	0	0	0	110.6	F11 H12 S17 A18 A19	F11-I15 VanDerWaalsContact O-CG1 3.27Å; F11-I15 WeakPolarHBondContact O-CG1 3.37Å; F11-I15 PolarHBondContact O-N 3.25Å; H12-I15 PolarHBondContact O-N 3.44Å; I15-S17 PolarHBondContact O-N 3.01Å; I15-A18 PolarHBondContact O-N 3.41Å; I15-A19 VanDerWaalsContact O-CB 3.32Å; I15-A19 WeakPolarHBondContact O-CB 3.3Å; I15-A19 PolarHBondContact O-N 3.32Å
16	L	93.8	Very high	90.6	Very high	95 Å²	95	103.7 Å²	103.7	50%	0.497	53%	0.531	S	S	.	.	H	α-helix	trans	-62.2	-42.4	176.7	-76.1	179.1	0	0	0	112.2	H12 A19 F20	H12-L16 WeakPolarHBondContact CE1-CD1 3.32Å; H12-L16 WeakPolarHBondContact O-CB 3.43Å; H12-L16 WeakPolarHBondContact O-CG 3.38Å; H12-L16 PolarHBondContact O-N 3.4Å; L16-A19 PolarHBondContact O-N 2.79Å; L16-F20 WeakPolarHBondContact O-CB 3.31Å; L16-F20 PolarHBondContact O-N 3.36Å
17	S	93.9	Very high	91.5	Very high	64 Å²	64	98.7 Å²	98.7	45%	0.448	52%	0.519	S	S	.	.	H	α-helix	trans	-64.3	-43.3	178	179.3	0	0	0	0	111.8	H13 L14 I15 F20 M21	H13-S17 WeakPolarHBondContact O-CB 3.46Å; H13-S17 PolarHBondContact O-N 2.91Å; L14-S17 PolarHBondContact O-N 3.31Å; I15-S17 PolarHBondContact O-N 3.01Å; S17-F20 PolarHBondContact O-N 3.38Å; S17-M21 PolarHBondContact O-N 3.46Å
18	A	95.7	Very high	92.2	Very high	51 Å²	51	98.6 Å²	98.6	42%	0.421	52%	0.519	S	S	.	.	H	α-helix	trans	-63.9	-45.3	175.1	0	0	0	0	0	111.7	L14 I15 F20 M21 I22	L14-A18 WeakPolarHBondContact O-CB 3.42Å; L14-A18 PolarHBondContact O-N 2.88Å; I15-A18 PolarHBondContact O-N 3.41Å; A18-F20 VanDerWaalsContact C-N 3.34Å; A18-F20 PolarHBondContact O-N 3.5Å; A18-M21 PolarHBondContact O-N 2.93Å; A18-I22 VanDerWaalsContact O-CG1 3.3Å; A18-I22 WeakPolarHBondContact O-CG1 3.45Å; A18-I22 PolarHBondContact O-N 2.89Å
19	A	95.3	Very high	92.5	Very high	49 Å²	49	95.9 Å²	95.9	41%	0.405	51%	0.511	S	S	.	.	H	α-helix	trans	-60.3	-43	176.5	0	0	0	0	0	111.9	I15 L16 I22 V23	I15-A19 VanDerWaalsContact O-CB 3.32Å; I15-A19 WeakPolarHBondContact O-CB 3.3Å; I15-A19 PolarHBondContact O-N 3.32Å; L16-A19 PolarHBondContact O-N 2.79Å; A19-I22 PolarHBondContact O-N 2.89Å; A19-V23 WeakPolarHBondContact O-CG2 3.4Å; A19-V23 PolarHBondContact O-N 2.99Å
20	F	94.9	Very high	92.8	Very high	132 Å²	132	100.3 Å²	100.3	58%	0.579	52%	0.519	S	S	*	.	H	α-helix	trans	-64	-42.9	176.9	-176.1	-98.1	0	0	0	112.4	L16 S17 A18 I22 V23 R24	L16-F20 WeakPolarHBondContact O-CB 3.31Å; L16-F20 PolarHBondContact O-N 3.36Å; S17-F20 PolarHBondContact O-N 3.38Å; A18-F20 VanDerWaalsContact C-N 3.34Å; A18-F20 PolarHBondContact O-N 3.5Å; F20-I22 VanDerWaalsContact C-N 3.32Å; F20-I22 PolarHBondContact O-N 3Å; F20-V23 PolarHBondContact O-N 2.91Å; F20-R24 WeakPolarHBondContact O-CB 3.22Å; F20-R24 PolarHBondContact O-N 3.08Å
21	M	94.2	Very high	92.8	Very high	133 Å²	133	97.9 Å²	97.9	66%	0.655	51%	0.514	S	S	*	.	H	α-helix	trans	-62.4	-39.3	175	-76.5	-142.1	105.4	0	0	112.3	S17 A18 S25	S17-M21 PolarHBondContact O-N 3.46Å; A18-M21 PolarHBondContact O-N 2.93Å; M21-S25 VanDerWaalsContact O-CB 3.31Å; M21-S25 WeakPolarHBondContact O-CB 3.36Å; M21-S25 PolarHBondContact O-N 3.31Å
22	I	93.3	Very high	92.6	Very high	107 Å²	107	98.6 Å²	98.6	55%	0.549	52%	0.517	S	S	.	.	H	α-helix	trans	-63.5	-47.4	176.3	-68	164.4	0	0	0	110.5	A18 A19 F20 S25 N26	A18-I22 VanDerWaalsContact O-CG1 3.3Å; A18-I22 WeakPolarHBondContact O-CG1 3.45Å; A18-I22 PolarHBondContact O-N 2.89Å; A19-I22 PolarHBondContact O-N 2.89Å; F20-I22 VanDerWaalsContact C-N 3.32Å; F20-I22 PolarHBondContact O-N 3Å; I22-S25 PolarHBondContact O-N 3.42Å; I22-N26 PolarHBondContact O-N 3.36Å; I22-N26 VanDerWaalsContact O-N 3.08Å; I22-N26 PolarHBondContact O-ND2 3.06Å
23	V	93.5	Very high	92.5	Very high	82 Å²	82	97.5 Å²	97.5	50%	0.497	52%	0.517	S	S	.	.	H	α-helix	trans	-60.4	-49.4	177.7	171.6	0	0	0	0	110.6	A19 F20 S25 N26 D27	A19-V23 WeakPolarHBondContact O-CG2 3.4Å; A19-V23 PolarHBondContact O-N 2.99Å; F20-V23 PolarHBondContact O-N 2.91Å; V23-S25 VanDerWaalsContact C-N 3.32Å; V23-S25 PolarHBondContact O-N 2.82Å; V23-N26 WeakPolarHBondContact O-CB 3.34Å; V23-N26 PolarHBondContact O-N 3.24Å; V23-D27 PolarHBondContact O-N 3.11Å
24	R	94.5	Very high	92.2	Very high	141 Å²	141	94.6 Å²	94.6	53%	0.532	51%	0.506	S	S	.	.	H	α-helix	trans	-59.1	-42.7	178.5	-173.4	176.3	-177.7	99.3	3.1	112.3	F20 N26 D27 D28	F20-R24 WeakPolarHBondContact O-CB 3.22Å; F20-R24 PolarHBondContact O-N 3.08Å; R24-N26 VanDerWaalsContact C-N 3.27Å; R24-N26 PolarHBondContact O-N 2.96Å; R24-D27 PolarHBondContact O-N 2.88Å; R24-D28 VanDerWaalsContact O-CG 3.28Å; R24-D28 PolarHBondContact O-N 3.5Å
25	S	94.3	Very high	91.7	Very high	63 Å²	63	93.9 Å²	93.9	44%	0.441	50%	0.503	S	S	.	.	H	α-helix	trans	-62.1	-34.9	176.6	-176.7	0	0	0	0	112.4	M21 I22 V23 L29	M21-S25 VanDerWaalsContact O-CB 3.31Å; M21-S25 WeakPolarHBondContact O-CB 3.36Å; M21-S25 PolarHBondContact O-N 3.31Å; I22-S25 PolarHBondContact O-N 3.42Å; V23-S25 VanDerWaalsContact C-N 3.32Å; V23-S25 PolarHBondContact O-N 2.82Å; S25-L29 VanDerWaalsContact O-CG 3.25Å; S25-L29 WeakPolarHBondContact O-CG 3.25Å; S25-L29 PolarHBondContact O-N 2.93Å; S25-L29 VanDerWaalsContact O-N 3.11Å
26	N	92.4	Very high	91.2	Very high	93 Å²	93	91.9 Å²	91.9	50%	0.497	49%	0.493	S	S	.	.	H	α-helix	trans	-69.9	-40.5	175.1	-76.4	-68.5	0	0	0	111.7	I22 V23 R24 L29 K30	I22-N26 PolarHBondContact O-N 3.36Å; I22-N26 VanDerWaalsContact O-N 3.08Å; I22-N26 PolarHBondContact O-ND2 3.06Å; V23-N26 WeakPolarHBondContact O-CB 3.34Å; V23-N26 PolarHBondContact O-N 3.24Å; R24-N26 VanDerWaalsContact C-N 3.27Å; R24-N26 PolarHBondContact O-N 2.96Å; N26-L29 PolarHBondContact O-N 3.05Å; N26-K30 WeakPolarHBondContact O-CB 3.49Å; N26-K30 PolarHBondContact O-N 3.2Å
27	D	93.2	Very high	90.5	Very high	96 Å²	96	93.4 Å²	93.4	51%	0.513	50%	0.498	S	S	.	.	H	α-helix	trans	-63.1	-41.8	175.9	-70.1	-27.1	0	0	0	111.5	V23 R24 L29 K30 A31	V23-D27 PolarHBondContact O-N 3.11Å; R24-D27 PolarHBondContact O-N 2.88Å; D27-L29 PolarHBondContact O-N 3.36Å; D27-K30 PolarHBondContact O-N 3.01Å; D27-A31 WeakPolarHBondContact O-CB 3.35Å; D27-A31 PolarHBondContact O-N 2.95Å
28	D	91.8	Very high	89.8	Confident	92 Å²	92	95.2 Å²	95.2	49%	0.492	50%	0.502	S	S	.	.	H	α-helix	trans	-64	-40.2	176.3	-67.8	-31.1	0	0	0	111.7	R24 K30 A31 K32	R24-D28 VanDerWaalsContact O-CG 3.28Å; R24-D28 PolarHBondContact O-N 3.5Å; D28-K30 VanDerWaalsContact C-N 3.34Å; D28-A31 PolarHBondContact O-N 3.33Å; D28-K32 WeakPolarHBondContact O-CB 3.44Å; D28-K32 PolarHBondContact O-N 2.97Å
29	L	89.2	Confident	89.1	Confident	99 Å²	99	99.3 Å²	99.3	52%	0.518	52%	0.516	S	S	.	.	H	α-helix	trans	-64.6	-38.5	174.6	-75.2	170.7	0	0	0	112.1	S25 N26 D27 T33	S25-L29 VanDerWaalsContact O-CG 3.25Å; S25-L29 WeakPolarHBondContact O-CG 3.25Å; S25-L29 PolarHBondContact O-N 2.93Å; S25-L29 VanDerWaalsContact O-N 3.11Å; N26-L29 PolarHBondContact O-N 3.05Å; D27-L29 PolarHBondContact O-N 3.36Å; L29-T33 PolarHBondContact O-N 3.35Å; L29-T33 PolarHBondContact O-OG1 2.93Å
30	K	90.7	Very high	88.6	Confident	135 Å²	135	105 Å²	105	59%	0.587	53%	0.527	S	S	*	.	H	α-helix	trans	-67.8	-47.1	176.4	-171.6	178.5	179.2	-174	0	111.2	N26 D27 D28 K32 T33 D34	N26-K30 WeakPolarHBondContact O-CB 3.49Å; N26-K30 PolarHBondContact O-N 3.2Å; D27-K30 PolarHBondContact O-N 3.01Å; D28-K30 VanDerWaalsContact C-N 3.34Å; K30-K32 VanDerWaalsContact C-N 3.3Å; K30-K32 PolarHBondContact O-N 3.4Å; K30-T33 WeakPolarHBondContact O-CB 3.41Å; K30-T33 PolarHBondContact O-N 3.05Å; K30-D34 PolarHBondContact O-N 3.48Å
31	A	88.2	Confident	88.2	Confident	50 Å²	50	106.1 Å²	106.1	41%	0.413	53%	0.531	S	S	.	.	H	α-helix	trans	-57	-44.7	176	0	0	0	0	0	111.5	D27 D28 T33 D34 D35	D27-A31 WeakPolarHBondContact O-CB 3.35Å; D27-A31 PolarHBondContact O-N 2.95Å; D28-A31 PolarHBondContact O-N 3.33Å; A31-T33 VanDerWaalsContact C-N 3.31Å; A31-T33 PolarHBondContact O-N 2.94Å; A31-D34 PolarHBondContact O-N 2.86Å; A31-D35 WeakPolarHBondContact O-CB 3.37Å; A31-D35 PolarHBondContact O-N 3.31Å
32	K	86.8	Confident	88	Confident	136 Å²	136	105.2 Å²	105.2	59%	0.591	53%	0.525	S	S	*	.	H	α-helix	trans	-61.3	-38.7	175.1	-173.1	175.6	-179.6	178.9	0	112.8	D28 K30 D36	D28-K32 WeakPolarHBondContact O-CB 3.44Å; D28-K32 PolarHBondContact O-N 2.97Å; K30-K32 VanDerWaalsContact C-N 3.3Å; K30-K32 PolarHBondContact O-N 3.4Å; K32-D36 WeakPolarHBondContact O-CB 3.44Å; K32-D36 PolarHBondContact O-N 3.39Å
33	T	86.5	Confident	88	Confident	74 Å²	74	104 Å²	104	45%	0.454	52%	0.519	S	S	.	.	H	α-helix	trans	-67.4	-42.7	178.4	-57.3	0	0	0	0	111.4	L29 K30 A31 D36 Q37	L29-T33 PolarHBondContact O-N 3.35Å; L29-T33 PolarHBondContact O-OG1 2.93Å; K30-T33 WeakPolarHBondContact O-CB 3.41Å; K30-T33 PolarHBondContact O-N 3.05Å; A31-T33 VanDerWaalsContact C-N 3.31Å; A31-T33 PolarHBondContact O-N 2.94Å; T33-D36 PolarHBondContact O-N 3.38Å; T33-Q37 WeakPolarHBondContact O-CG 3.36Å; T33-Q37 PolarHBondContact O-N 2.98Å
34	D	85.1	Confident	88	Confident	75 Å²	75	102.6 Å²	102.6	40%	0.401	51%	0.512	S	S	.	.	H	α-helix	trans	-67.4	-42.2	178.8	-71	-14.1	0	0	0	111.2	K30 A31 Q37 I38	K30-D34 PolarHBondContact O-N 3.48Å; A31-D34 PolarHBondContact O-N 2.86Å; D34-Q37 WeakPolarHBondContact O-CB 2.9Å; D34-Q37 PolarHBondContact O-N 3.02Å; D34-Q37 VanDerWaalsContact O-N 3.12Å; D34-I38 VanDerWaalsContact O-CG1 3.3Å; D34-I38 WeakPolarHBondContact O-CG1 3.46Å; D34-I38 PolarHBondContact O-N 2.89Å
35	D	83.7	Confident	88	Confident	94 Å²	94	107.7 Å²	107.7	50%	0.503	53%	0.531	S	S	.	.	H	α-helix	trans	-60.6	-46.2	173	-78.1	-15.6	0	0	0	111.2	A31 Q37 I38 L39	A31-D35 WeakPolarHBondContact O-CB 3.37Å; A31-D35 PolarHBondContact O-N 3.31Å; D35-Q37 PolarHBondContact O-N 3.06Å; D35-I38 CarbonylContact O-C 3.58Å; D35-I38 PolarHBondContact O-N 3.28Å; D35-L39 WeakPolarHBondContact O-CB 3.1Å; D35-L39 WeakPolarHBondContact O-CG 3.47Å; D35-L39 PolarHBondContact O-N 3.45Å
36	D	84.8	Confident	88.1	Confident	69 Å²	69	108.8 Å²	108.8	37%	0.369	54%	0.544	S	S	.	.	H	α-helix	trans	-58.4	-36.9	174.4	-84.4	-8.8	0	0	0	111.5	K32 T33 R40	K32-D36 WeakPolarHBondContact O-CB 3.44Å; K32-D36 PolarHBondContact O-N 3.39Å; T33-D36 PolarHBondContact O-N 3.38Å; D36-R40 WeakPolarHBondContact O-CB 3.45Å; D36-R40 WeakPolarHBondContact O-CD 3.48Å; D36-R40 WeakPolarHBondContact O-CG 3.3Å; D36-R40 PolarHBondContact O-N 3.12Å
37	Q	79.3	Confident	88.2	Confident	126 Å²	126	108.4 Å²	108.4	59%	0.589	54%	0.541	S	S	*	.	H	α-helix	trans	-68.6	-39.1	174.5	-70.6	-160.7	6.6	0	0	112.5	T33 D34 D35 L39 R40	T33-Q37 WeakPolarHBondContact O-CG 3.36Å; T33-Q37 PolarHBondContact O-N 2.98Å; D34-Q37 WeakPolarHBondContact O-CB 2.9Å; D34-Q37 PolarHBondContact O-N 3.02Å; D34-Q37 VanDerWaalsContact O-N 3.12Å; D35-Q37 PolarHBondContact O-N 3.06Å; Q37-L39 VanDerWaalsContact C-N 3.33Å; Q37-R40 PolarHBondContact O-N 2.81Å
38	I	79.1	Confident	88.4	Confident	103 Å²	103	107 Å²	107	53%	0.528	53%	0.533	S	S	.	.	H	α-helix	trans	-67.8	-34.4	176.5	-68.4	165.3	0	0	0	111.4	D34 D35	D34-I38 VanDerWaalsContact O-CG1 3.3Å; D34-I38 WeakPolarHBondContact O-CG1 3.46Å; D34-I38 PolarHBondContact O-N 2.89Å; D35-I38 CarbonylContact O-C 3.58Å; D35-I38 PolarHBondContact O-N 3.28Å
39	L	80.1	Confident	88.5	Confident	137 Å²	137	110.4 Å²	110.4	72%	0.717	55%	0.549	S	S	*	.	H	α-helix	trans	-80.4	-22	179.5	-67.2	175.1	0	0	0	112.9	D35 Q37 K41	D35-L39 WeakPolarHBondContact O-CB 3.1Å; D35-L39 WeakPolarHBondContact O-CG 3.47Å; D35-L39 PolarHBondContact O-N 3.45Å; Q37-L39 VanDerWaalsContact C-N 3.33Å; L39-K41 PolarHBondContact O-N 3.5Å
40	R	85.2	Confident	88.7	Confident	168 Å²	168	107.8 Å²	107.8	63%	0.634	55%	0.546	S	S	*	.	S	Bend	trans	-69.7	125.9	174.5	-79.4	164.9	-165.2	-150.5	3.5	110.3	D36 Q37 H42	D36-R40 WeakPolarHBondContact O-CB 3.45Å; D36-R40 WeakPolarHBondContact O-CD 3.48Å; D36-R40 WeakPolarHBondContact O-CG 3.3Å; D36-R40 PolarHBondContact O-N 3.12Å; Q37-R40 PolarHBondContact O-N 2.81Å; R40-H42 PolarHBondContact O-N 3.07Å
41	K	87.3	Confident	88.8	Confident	155 Å²	155	104.5 Å²	104.5	67%	0.674	54%	0.544	S	S	*	.			trans	-60.2	135.2	170.3	-56.9	-177.4	177.4	179.2	0	110.3	L39 K91	L39-K41 PolarHBondContact O-N 3.5Å; K41-K91 HydrophobicContact CB-CG 4.49Å; K41-K91 WeakPolarHBondContact CB-O 3.47Å; K41-K91 WeakPolarHBondContact O-CE 3.33Å
42	H	89.3	Confident	89.1	Confident	115 Å²	115	111.5 Å²	111.5	53%	0.532	57%	0.565	S	S	.	*			trans	-124.6	157.7	178.9	58.6	74.7	0	0	0	109.9	R40	R40-H42 PolarHBondContact O-N 3.07Å
43	L	93	Very high	89.4	Confident	81 Å²	81	114.1 Å²	114.1	42%	0.424	58%	0.577	S	S	.	*			trans	-62.9	149.3	170.2	-68.2	172.1	0	0	0	109.7	R45 L87 Y90 K91	L43-R45 PolarHBondContact O-N 3.42Å; L43-L87 HydrophobicContact CD2-CD2 4.48Å; L43-Y90 HydrophobicContact CD2-CD1 3.8Å; L43-Y90 HydrophobicContact CD2-CE1 4.43Å; L43-K91 HydrophobicContact CD2-CB 4.12Å
44	P	93.9	Very high	89.8	Confident	52 Å²	52	114.1 Å²	114.1	34%	0.338	58%	0.584	S	S	.	*			trans	-65.6	133.7	177.9	22.6	-28	0	0	0	110.5	I47 Y90	P44-I47 HydrophobicContact CB-CG1 4.19Å; P44-I47 HydrophobicContact CG-CD1 4.28Å; P44-I47 HydrophobicContact CG-CG1 4.04Å; P44-Y90 HydrophobicContact CG-CE1 3.63Å; P44-Y90 WeakPolarHBondContact CG-OH 3.23Å
45	R	94.5	Very high	90.3	Very high	249 Å²	249	112.3 Å²	112.3	94%	0.94	58%	0.583	S	S	*	*	S	Bend	trans	-77.9	-25.4	174	-67.2	-175.8	178.8	160.5	-0.1	112.7	L43	L43-R45 PolarHBondContact O-N 3.42Å
46	A	95.5	Very high	90.9	Very high	86 Å²	86	109.2 Å²	109.2	71%	0.711	57%	0.568	S	S	*	*	S	Bend	trans	-141.2	146.8	178.6	0	0	0	0	0	109.5
47	I	95.8	Very high	91.4	Very high	85 Å²	85	112.6 Å²	112.6	44%	0.436	58%	0.575	S	S	.	*			trans	-133.1	132	-177.3	-59.5	164.7	0	0	0	108.5	P44 I49 F79	P44-I47 HydrophobicContact CB-CG1 4.19Å; P44-I47 HydrophobicContact CG-CD1 4.28Å; P44-I47 HydrophobicContact CG-CG1 4.04Å; I47-I49 HydrophobicContact CB-CG2 4.33Å; I47-I49 HydrophobicContact CG2-CG2 3.79Å; I47-F79 HydrophobicContact CD1-CE2 3.76Å; I47-F79 HydrophobicContact CD1-CZ 4.27Å
48	I	96	Very high	92.2	Very high	66 Å²	66	108.7 Å²	108.7	34%	0.338	57%	0.565	S	S	.	*			trans	-86	108.6	168.5	-59.6	173	0	0	0	107.4	T56 L59 L60 L63	I48-T56 HydrophobicContact CG2-CG2 3.73Å; I48-L59 HydrophobicContact CD1-CD2 4.03Å; I48-L59 HydrophobicContact CD1-CG 4.14Å; I48-L59 HydrophobicContact CG1-CD2 4.45Å; I48-L60 HydrophobicContact CD1-CB 4.22Å; I48-L60 HydrophobicContact CD1-CD1 4.02Å; I48-L63 HydrophobicContact CD1-CD1 4.27Å
49	I	95.6	Very high	93	Very high	163 Å²	163	107.9 Å²	107.9	84%	0.836	56%	0.561	S	S	*	*			trans	-93.5	-11	-172.5	58.2	171.9	0	0	0	114.4	I47	I47-I49 HydrophobicContact CB-CG2 4.33Å; I47-I49 HydrophobicContact CG2-CG2 3.79Å
50	G	92.2	Very high	93.7	Very high	44 Å²	44	103.2 Å²	103.2	45%	0.454	54%	0.537	S	S	.	.			trans	148.3	-168.7	-177.9	0	0	0	0	0	113.5
51	A	93.7	Very high	94.2	Very high	66 Å²	66	98.8 Å²	98.8	55%	0.545	52%	0.523	S	S	.	.			cis	-89.7	163.3	1.3	0	0	0	0	0	113.4	K53 A54	A51-K53 PolarHBondContact O-N 3.08Å; A51-A54 HydrophobicContact CB-CB 4.36Å; A51-A54 VanDerWaalsContact O-CB 3.23Å; A51-A54 WeakPolarHBondContact O-CB 3.49Å; A51-A54 PolarHBondContact O-N 3.21Å
52	K	93.2	Very high	94.6	Very high	197 Å²	197	99.5 Å²	99.5	86%	0.857	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	132.5	173.4	-168.1	-174.4	176.8	176.7	0	109.2	A54	K52-A54 PolarHBondContact O-N 3.47Å
53	K	94.1	Very high	94.9	Very high	192 Å²	192	97.6 Å²	97.6	84%	0.835	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	3.9	-177.5	-47.7	-56.3	-63.4	-176	0	116.3	A51 G55	A51-K53 PolarHBondContact O-N 3.08Å; K53-G55 PolarHBondContact O-N 3.09Å
54	A	95.2	Very high	95	Very high	74 Å²	74	97 Å²	97	61%	0.612	51%	0.508	S	S	*	.	S	Bend	trans	-76.6	3.4	175.7	0	0	0	0	0	114.5	A51 K52	A51-A54 HydrophobicContact CB-CB 4.36Å; A51-A54 VanDerWaalsContact O-CB 3.23Å; A51-A54 WeakPolarHBondContact O-CB 3.49Å; A51-A54 PolarHBondContact O-N 3.21Å; K52-A54 PolarHBondContact O-N 3.47Å
55	G	95.2	Very high	95.1	Very high	37 Å²	37	101.2 Å²	101.2	38%	0.381	53%	0.527	S	S	.	.	S	Bend	trans	86.5	23.1	-177.3	0	0	0	0	0	114.8	K53 R57 A58 L59	K53-G55 PolarHBondContact O-N 3.09Å; G55-R57 PolarHBondContact O-N 3.43Å; G55-A58 WeakPolarHBondContact O-CB 3.17Å; G55-A58 PolarHBondContact O-N 3.2Å; G55-L59 PolarHBondContact O-N 3Å
56	T	96.4	Very high	95.1	Very high	29 Å²	29	94.4 Å²	94.4	18%	0.178	51%	0.506	C	S	.	.	H	α-helix	trans	-52.7	-39.3	178.8	54.5	0	0	0	0	113.2	I48 L59 L60	I48-T56 HydrophobicContact CG2-CG2 3.73Å; T56-L59 PolarHBondContact O-N 3.4Å; T56-L60 WeakPolarHBondContact O-CB 3.36Å; T56-L60 PolarHBondContact O-N 3.41Å
57	R	94.9	Very high	95	Very high	139 Å²	139	98.1 Å²	98.1	53%	0.525	51%	0.514	S	S	.	.	H	α-helix	trans	-63.8	-41.8	176.1	-176	62.4	160.6	89.9	2.5	112.4	G55 L60 E61	G55-R57 PolarHBondContact O-N 3.43Å; R57-L60 PolarHBondContact O-N 2.94Å; R57-E61 IonicContact CZ-OE1 2.7Å; R57-E61 IonicContact NH1-OE1 2.98Å; R57-E61 PolarHBondContact NH1-OE1 3.36Å; R57-E61 IonicContact NH1-OE2 3.47Å; R57-E61 PolarHBondContact NH1-OE2 3.13Å; R57-E61 WeakPolarHBondContact O-CG 3.47Å; R57-E61 PolarHBondContact O-N 3.23Å
58	A	95.5	Very high	94.8	Very high	44 Å²	44	101.9 Å²	101.9	36%	0.364	53%	0.532	S	S	.	.	H	α-helix	trans	-66.6	-44.5	178.1	0	0	0	0	0	110.9	G55 L60 E61 Y62	G55-A58 WeakPolarHBondContact O-CB 3.17Å; G55-A58 PolarHBondContact O-N 3.2Å; A58-L60 VanDerWaalsContact C-N 3.32Å; A58-L60 PolarHBondContact O-N 2.88Å; A58-E61 PolarHBondContact O-N 3.15Å; A58-Y62 HydrophobicContact CB-CE2 4.37Å; A58-Y62 WeakPolarHBondContact O-CD2 3.19Å; A58-Y62 PolarHBondContact O-N 3.21Å
59	L	95.8	Very high	94.7	Very high	87 Å²	87	101.4 Å²	101.4	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-56.5	-46.4	173.5	176.6	61.6	0	0	0	111.7	I48 G55 T56 E61 Y62 L63	I48-L59 HydrophobicContact CD1-CD2 4.03Å; I48-L59 HydrophobicContact CD1-CG 4.14Å; I48-L59 HydrophobicContact CG1-CD2 4.45Å; G55-L59 PolarHBondContact O-N 3Å; T56-L59 PolarHBondContact O-N 3.4Å; L59-E61 VanDerWaalsContact C-N 3.32Å; L59-E61 PolarHBondContact O-N 3.03Å; L59-Y62 PolarHBondContact O-N 3.22Å; L59-L63 HydrophobicContact CD1-CD1 4.17Å; L59-L63 HydrophobicContact CD1-CG 4.23Å; L59-L63 HydrophobicContact CG-CD1 4.09Å; L59-L63 VanDerWaalsContact O-CG 3.31Å; L59-L63 WeakPolarHBondContact O-CG 3.41Å; L59-L63 PolarHBondContact O-N 2.85Å
60	L	95.6	Very high	94.5	Very high	39 Å²	39	101.2 Å²	101.2	20%	0.204	53%	0.525	C	S	.	.	H	α-helix	trans	-60.4	-40.9	178.2	-170.5	63	0	0	0	112.2	I48 T56 R57 A58 L63 R64 A71	I48-L60 HydrophobicContact CD1-CB 4.22Å; I48-L60 HydrophobicContact CD1-CD1 4.02Å; T56-L60 WeakPolarHBondContact O-CB 3.36Å; T56-L60 PolarHBondContact O-N 3.41Å; R57-L60 PolarHBondContact O-N 2.94Å; A58-L60 VanDerWaalsContact C-N 3.32Å; A58-L60 PolarHBondContact O-N 2.88Å; L60-L63 PolarHBondContact O-N 3.18Å; L60-R64 WeakPolarHBondContact O-CG 3.47Å; L60-R64 PolarHBondContact O-N 2.63Å; L60-A71 HydrophobicContact CD1-CB 3.5Å; L60-A71 VanDerWaalsContact CD1-CB 3.5Å; L60-A71 HydrophobicContact CG-CB 4.19Å
61	E	95.2	Very high	94.5	Very high	75 Å²	75	100.5 Å²	100.5	35%	0.35	51%	0.514	S	S	.	.	H	α-helix	trans	-65.6	-42.4	176	-70.3	-48.8	89.3	0	0	112.8	R57 A58 L59 L63 R64	R57-E61 IonicContact CZ-OE1 2.7Å; R57-E61 IonicContact NH1-OE1 2.98Å; R57-E61 PolarHBondContact NH1-OE1 3.36Å; R57-E61 IonicContact NH1-OE2 3.47Å; R57-E61 PolarHBondContact NH1-OE2 3.13Å; R57-E61 WeakPolarHBondContact O-CG 3.47Å; R57-E61 PolarHBondContact O-N 3.23Å; A58-E61 PolarHBondContact O-N 3.15Å; L59-E61 VanDerWaalsContact C-N 3.32Å; L59-E61 PolarHBondContact O-N 3.03Å; E61-L63 VanDerWaalsContact C-N 3.31Å; E61-L63 PolarHBondContact O-N 3.41Å; E61-R64 WeakPolarHBondContact O-CB 3.36Å; E61-R64 PolarHBondContact O-N 2.92Å; E61-R64 VanDerWaalsContact OE1-CD 3.3Å; E61-R64 WeakPolarHBondContact OE1-CD 3.19Å; E61-R64 IonicContact OE1-CZ 3.78Å; E61-R64 IonicContact OE1-NE 3.59Å; E61-R64 IonicContact OE1-NH1 2.79Å; E61-R64 PolarHBondContact OE1-NH1 3.44Å
62	Y	95.9	Very high	94.4	Very high	169 Å²	169	101.1 Å²	101.1	66%	0.663	51%	0.513	S	S	*	.	H	α-helix	trans	-63.8	-39.7	176.9	-62.4	-32.9	0	0	0	111.7	A58 L59 R64 L65	A58-Y62 HydrophobicContact CB-CE2 4.37Å; A58-Y62 WeakPolarHBondContact O-CD2 3.19Å; A58-Y62 PolarHBondContact O-N 3.21Å; L59-Y62 PolarHBondContact O-N 3.22Å; Y62-R64 VanDerWaalsContact C-N 3.31Å; Y62-R64 PolarHBondContact O-N 3.24Å; Y62-L65 WeakPolarHBondContact O-CB 3.38Å; Y62-L65 PolarHBondContact O-N 3.04Å
63	L	96	Very high	94.1	Very high	75 Å²	75	94 Å²	94	39%	0.393	50%	0.495	S	S	.	.	H	α-helix	trans	-65.4	-34.1	176.1	-71.3	174.1	0	0	0	112.5	I48 L59 L60 E61 L65 H66 V69	I48-L63 HydrophobicContact CD1-CD1 4.27Å; L59-L63 HydrophobicContact CD1-CD1 4.17Å; L59-L63 HydrophobicContact CD1-CG 4.23Å; L59-L63 HydrophobicContact CG-CD1 4.09Å; L59-L63 VanDerWaalsContact O-CG 3.31Å; L59-L63 WeakPolarHBondContact O-CG 3.41Å; L59-L63 PolarHBondContact O-N 2.85Å; L60-L63 PolarHBondContact O-N 3.18Å; E61-L63 VanDerWaalsContact C-N 3.31Å; E61-L63 PolarHBondContact O-N 3.41Å; L63-L65 PolarHBondContact O-N 3.4Å; L63-H66 PolarHBondContact O-N 3.26Å; L63-H66 VanDerWaalsContact O-N 3.14Å; L63-V69 HydrophobicContact CB-CG1 4.22Å; L63-V69 WeakPolarHBondContact O-CB 3.32Å
64	R	94.4	Very high	94	Very high	70 Å²	70	89.9 Å²	89.9	26%	0.264	49%	0.488	S	S	.	.	H	α-helix	trans	-63.3	-20.1	176.5	-81.4	171.4	161.9	149.1	4.2	114.3	L60 E61 Y62 H66 A71 P72 G73	L60-R64 WeakPolarHBondContact O-CG 3.47Å; L60-R64 PolarHBondContact O-N 2.63Å; E61-R64 WeakPolarHBondContact O-CB 3.36Å; E61-R64 PolarHBondContact O-N 2.92Å; E61-R64 VanDerWaalsContact OE1-CD 3.3Å; E61-R64 WeakPolarHBondContact OE1-CD 3.19Å; E61-R64 IonicContact OE1-CZ 3.78Å; E61-R64 IonicContact OE1-NE 3.59Å; E61-R64 IonicContact OE1-NH1 2.79Å; E61-R64 PolarHBondContact OE1-NH1 3.44Å; Y62-R64 VanDerWaalsContact C-N 3.31Å; Y62-R64 PolarHBondContact O-N 3.24Å; R64-H66 PolarHBondContact O-N 3.23Å; R64-A71 HydrophobicContact CG-CB 4.1Å; R64-A71 PolarHBondContact NH2-O 3.47Å; R64-P72 PolarHBondContact NH2-O 3.2Å; R64-G73 VanDerWaalsContact NH2-CA 3.29Å
65	L	95.5	Very high	93.9	Very high	139 Å²	139	92.4 Å²	92.4	73%	0.728	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-17.2	175.9	-60.9	175.6	0	0	0	112.4	Y62 L63	Y62-L65 WeakPolarHBondContact O-CB 3.38Å; Y62-L65 PolarHBondContact O-N 3.04Å; L63-L65 PolarHBondContact O-N 3.4Å
66	H	95.8	Very high	93.8	Very high	107 Å²	107	93.2 Å²	93.2	50%	0.495	48%	0.484	S	S	.	.	S	Bend	trans	-89	127.6	-179	-166.5	-53.5	0	0	0	112	L63 R64 M68 V69	L63-H66 PolarHBondContact O-N 3.26Å; L63-H66 VanDerWaalsContact O-N 3.14Å; R64-H66 PolarHBondContact O-N 3.23Å; H66-M68 PolarHBondContact ND1-N 3.28Å; H66-M68 VanDerWaalsContact ND1-N 3.18Å; H66-M68 PolarHBondContact O-N 3.14Å; H66-V69 HydrophobicContact CB-CB 4.43Å; H66-V69 HydrophobicContact CB-CG2 4.03Å; H66-V69 PolarHBondContact O-N 2.79Å
67	N	93.3	Very high	93.8	Very high	164 Å²	164	94.3 Å²	94.3	88%	0.877	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-16.8	-176.5	-56.3	-8.5	0	0	0	116.1
68	M	92.2	Very high	93.9	Very high	164 Å²	164	88 Å²	88	81%	0.808	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-5.1	-176.5	-65.2	-178.9	65.3	0	0	112.1	H66	H66-M68 PolarHBondContact ND1-N 3.28Å; H66-M68 VanDerWaalsContact ND1-N 3.18Å; H66-M68 PolarHBondContact O-N 3.14Å
69	V	92.8	Very high	93.9	Very high	56 Å²	56	91.5 Å²	91.5	34%	0.339	47%	0.471	S	S	.	.			trans	-107.4	122.2	-177.3	-178.5	0	0	0	0	108.7	L63 H66	L63-V69 HydrophobicContact CB-CG1 4.22Å; L63-V69 WeakPolarHBondContact O-CB 3.32Å; H66-V69 HydrophobicContact CB-CB 4.43Å; H66-V69 HydrophobicContact CB-CG2 4.03Å; H66-V69 PolarHBondContact O-N 2.79Å
70	K	91.1	Very high	93.9	Very high	159 Å²	159	92.2 Å²	92.2	69%	0.691	48%	0.475	S	S	*	.			trans	-116.6	132.4	171.2	-63.8	-175.7	-178.4	178.2	0	108.4
71	A	92.4	Very high	93.9	Very high	29 Å²	29	97.9 Å²	97.9	24%	0.24	49%	0.494	C	S	.	.			trans	-137.9	140.1	-176.6	0	0	0	0	0	112	L60 R64	L60-A71 HydrophobicContact CD1-CB 3.5Å; L60-A71 VanDerWaalsContact CD1-CB 3.5Å; L60-A71 HydrophobicContact CG-CB 4.19Å; R64-A71 HydrophobicContact CG-CB 4.1Å; R64-A71 PolarHBondContact NH2-O 3.47Å
72	P	91.5	Very high	94	Very high	79 Å²	79	98.3 Å²	98.3	51%	0.513	49%	0.493	S	S	.	.			trans	-69	141.2	179.9	30.1	-35.5	0	0	0	111.9	R64 V76	R64-P72 PolarHBondContact NH2-O 3.2Å; P72-V76 HydrophobicContact CB-CG2 3.92Å; P72-V76 HydrophobicContact CG-CG2 3.71Å
73	G	88.1	Confident	94	Very high	46 Å²	46	98 Å²	98	47%	0.474	49%	0.492	S	S	.	.	S	Bend	trans	-53.1	-69.2	-177.3	0	0	0	0	0	113.6	R64	R64-G73 VanDerWaalsContact NH2-CA 3.29Å
74	P	91.5	Very high	94.1	Very high	106 Å²	106	100.9 Å²	100.9	69%	0.688	51%	0.508	S	S	*	.	S	Bend	trans	-81.9	160.4	175.8	32.9	-34.2	0	0	0	112.5	V76	P74-V76 PolarHBondContact O-N 2.65Å
75	E	93.2	Very high	94.2	Very high	128 Å²	128	104.1 Å²	104.1	60%	0.598	52%	0.52	S	S	*	.			trans	-62.4	120.3	166.9	-66.4	-177.1	173.1	0	0	109.1	H77	E75-H77 VanDerWaalsContact C-N 3.3Å; E75-H77 PolarHBondContact O-CD2 3.46Å; E75-H77 PolarHBondContact O-N 2.95Å; E75-H77 IonicContact OE2-CE1 3.68Å; E75-H77 IonicContact OE2-NE2 3.41Å; E75-H77 PolarHBondContact OE2-NE2 3.42Å
76	V	93.8	Very high	94.2	Very high	53 Å²	53	99 Å²	99	32%	0.321	50%	0.5	S	S	.	.			trans	-71.3	-27.4	-170.3	-178	0	0	0	0	112.2	P72 P74 F78 Y82 W89 Y90	P72-V76 HydrophobicContact CB-CG2 3.92Å; P72-V76 HydrophobicContact CG-CG2 3.71Å; P74-V76 PolarHBondContact O-N 2.65Å; V76-F78 HydrophobicContact CG1-CB 4.17Å; V76-F78 PolarHBondContact O-N 2.7Å; V76-Y82 WeakPolarHBondContact O-CD2 3.14Å; V76-W89 HydrophobicContact CG1-CH2 4.27Å; V76-W89 HydrophobicContact CG1-CZ3 4.17Å; V76-Y90 HydrophobicContact CB-CE2 4.46Å; V76-Y90 HydrophobicContact CG1-CD2 4.01Å; V76-Y90 HydrophobicContact CG1-CE2 3.95Å
77	H	95.2	Very high	94.2	Very high	52 Å²	52	99 Å²	99	24%	0.241	50%	0.504	C	S	.	.			trans	51.8	37.4	-177.8	-67.8	-71.2	0	0	0	114.3	E75 D80 R81 Y82	E75-H77 VanDerWaalsContact C-N 3.3Å; E75-H77 PolarHBondContact O-CD2 3.46Å; E75-H77 PolarHBondContact O-N 2.95Å; E75-H77 IonicContact OE2-CE1 3.68Å; E75-H77 IonicContact OE2-NE2 3.41Å; E75-H77 PolarHBondContact OE2-NE2 3.42Å; H77-D80 WeakPolarHBondContact CA-OD1 2.89Å; H77-D80 WeakPolarHBondContact CB-OD1 3.34Å; H77-D80 IonicContact CE1-OD2 2.65Å; H77-D80 IonicContact CG-OD1 3.58Å; H77-D80 IonicContact CG-OD2 3.87Å; H77-D80 IonicContact ND1-OD1 3.54Å; H77-D80 PolarHBondContact ND1-OD1 3.07Å; H77-D80 IonicContact ND1-OD2 3.83Å; H77-D80 PolarHBondContact ND1-OD2 3.43Å; H77-R81 HydrophobicContact CB-CB 4.13Å; H77-R81 HydrophobicContact CB-CG 4.04Å; H77-R81 PolarHBondContact O-N 3.41Å; H77-Y82 HydrophobicContact CB-CD2 4.29Å; H77-Y82 HydrophobicContact CB-CE2 4.23Å; H77-Y82 VanDerWaalsContact O-CD2 3.32Å; H77-Y82 WeakPolarHBondContact O-CD2 3.44Å; H77-Y82 PolarHBondContact O-N 3.4Å; H77-Y82 VanDerWaalsContact O-N 3.15Å
78	F	96.8	Very high	94.2	Very high	6 Å²	6	100.6 Å²	100.6	3%	0.026	50%	0.503	C	S	.	.	H	α-helix	trans	-67.4	-52.8	-178.8	176.5	-112.8	0	0	0	111.7	V76 D80 Y82 Y83 G86 L87 W89 Y90	V76-F78 HydrophobicContact CG1-CB 4.17Å; V76-F78 PolarHBondContact O-N 2.7Å; F78-D80 VanDerWaalsContact C-N 3.31Å; F78-D80 PolarHBondContact O-N 3.19Å; F78-Y82 WeakPolarHBondContact CE2-O 3.31Å; F78-Y82 CarbonylContact O-C 3.31Å; F78-Y82 VanDerWaalsContact O-C 3.31Å; F78-Y82 PolarHBondContact O-N 2.97Å; F78-Y83 HydrophobicContact CE1-CD2 4.08Å; F78-Y83 HydrophobicContact CE1-CE2 4.5Å; F78-Y83 HydrophobicContact CZ-CD2 4.11Å; F78-Y83 WeakPolarHBondContact O-CA 3.3Å; F78-Y83 PolarHBondContact O-N 3.29Å; F78-G86 WeakPolarHBondContact CE2-O 3.4Å; F78-L87 HydrophobicContact CE1-CD2 4.12Å; F78-L87 HydrophobicContact CZ-CD2 4.26Å; F78-W89 HydrophobicContact CB-CZ3 4.36Å; F78-W89 AromaticContact CD2-CE3 3.69Å; F78-W89 HydrophobicContact CD2-CE3 3.69Å; F78-W89 AromaticContact CD2-CZ3 3.72Å; F78-W89 HydrophobicContact CD2-CZ3 3.72Å; F78-W89 HydrophobicContact CE2-CE3 4.15Å; F78-W89 HydrophobicContact CG-CZ3 4.49Å; F78-Y90 HydrophobicContact CB-CD2 3.46Å; F78-Y90 VanDerWaalsContact CB-CD2 3.46Å; F78-Y90 HydrophobicContact CB-CE2 3.58Å; F78-Y90 HydrophobicContact CB-CG 4.1Å; F78-Y90 AromaticContact CD1-CD1 3.67Å; F78-Y90 HydrophobicContact CD1-CD1 3.67Å; F78-Y90 AromaticContact CD1-CD2 3.87Å; F78-Y90 HydrophobicContact CD1-CD2 3.87Å; F78-Y90 AromaticContact CD1-CE1 4Å; F78-Y90 HydrophobicContact CD1-CE1 4Å; F78-Y90 HydrophobicContact CD1-CE2 4.18Å; F78-Y90 AromaticContact CD1-CG 3.59Å; F78-Y90 HydrophobicContact CD1-CG 3.59Å; F78-Y90 HydrophobicContact CD2-CD2 4.06Å; F78-Y90 AromaticContact CD2-CG 3.98Å; F78-Y90 HydrophobicContact CD2-CG 3.98Å; F78-Y90 AromaticContact CE1-CD1 3.9Å; F78-Y90 HydrophobicContact CE1-CD1 3.9Å; F78-Y90 AromaticContact CE1-CG 3.97Å; F78-Y90 HydrophobicContact CE1-CG 3.97Å; F78-Y90 HydrophobicContact CE2-CG 4.32Å; F78-Y90 HydrophobicContact CG-CD1 4.17Å; F78-Y90 AromaticContact CG-CD2 3.51Å; F78-Y90 HydrophobicContact CG-CD2 3.51Å; F78-Y90 AromaticContact CG-CE2 4Å; F78-Y90 HydrophobicContact CG-CE2 4Å; F78-Y90 AromaticContact CG-CG 3.59Å; F78-Y90 HydrophobicContact CG-CG 3.59Å; F78-Y90 HydrophobicContact CZ-CG 4.31Å
79	F	96.1	Very high	94.2	Very high	119 Å²	119	97.6 Å²	97.6	52%	0.522	48%	0.483	S	S	.	.	H	α-helix	trans	-75.8	-14.3	-172.9	-62.9	-75.3	0	0	0	114.5	I47 Y83 Y90	I47-F79 HydrophobicContact CD1-CE2 3.76Å; I47-F79 HydrophobicContact CD1-CZ 4.27Å; F79-Y83 HydrophobicContact CD1-CD2 4.35Å; F79-Y90 HydrophobicContact CE2-CE1 4.03Å; F79-Y90 AromaticContact CE2-CZ 3.99Å; F79-Y90 HydrophobicContact CZ-CE1 4.02Å
80	D	95.2	Very high	94.3	Very high	102 Å²	102	96.9 Å²	96.9	55%	0.545	47%	0.474	S	S	.	.	H	α-helix	trans	-105.6	-39	177.9	61.2	-37.7	0	0	0	113.3	H77 F78	H77-D80 WeakPolarHBondContact CA-OD1 2.89Å; H77-D80 WeakPolarHBondContact CB-OD1 3.34Å; H77-D80 IonicContact CE1-OD2 2.65Å; H77-D80 IonicContact CG-OD1 3.58Å; H77-D80 IonicContact CG-OD2 3.87Å; H77-D80 IonicContact ND1-OD1 3.54Å; H77-D80 PolarHBondContact ND1-OD1 3.07Å; H77-D80 IonicContact ND1-OD2 3.83Å; H77-D80 PolarHBondContact ND1-OD2 3.43Å; F78-D80 VanDerWaalsContact C-N 3.31Å; F78-D80 PolarHBondContact O-N 3.19Å
81	R	96.3	Very high	94.3	Very high	157 Å²	157	95.6 Å²	95.6	59%	0.592	47%	0.468	S	S	*	.	H	α-helix	trans	-116.7	-30.6	-172.5	-59.7	-179.4	-164.2	-165.5	1.9	115.3	H77	H77-R81 HydrophobicContact CB-CB 4.13Å; H77-R81 HydrophobicContact CB-CG 4.04Å; H77-R81 PolarHBondContact O-N 3.41Å
82	Y	96.8	Very high	94.4	Very high	84 Å²	84	99 Å²	99	33%	0.329	48%	0.48	S	S	.	.	S	Bend	trans	-120.1	18.2	-168.9	-56.6	-61	0	0	0	114.1	V76 H77 F78 N84 R85 W89	V76-Y82 WeakPolarHBondContact O-CD2 3.14Å; H77-Y82 HydrophobicContact CB-CD2 4.29Å; H77-Y82 HydrophobicContact CB-CE2 4.23Å; H77-Y82 VanDerWaalsContact O-CD2 3.32Å; H77-Y82 WeakPolarHBondContact O-CD2 3.44Å; H77-Y82 PolarHBondContact O-N 3.4Å; H77-Y82 VanDerWaalsContact O-N 3.15Å; F78-Y82 WeakPolarHBondContact CE2-O 3.31Å; F78-Y82 CarbonylContact O-C 3.31Å; F78-Y82 VanDerWaalsContact O-C 3.31Å; F78-Y82 PolarHBondContact O-N 2.97Å; Y82-N84 PolarHBondContact O-N 3.04Å; Y82-R85 WeakPolarHBondContact O-CB 3.32Å; Y82-R85 PolarHBondContact O-N 3.26Å; Y82-W89 AromaticContact CD2-CH2 3.57Å; Y82-W89 HydrophobicContact CD2-CH2 3.57Å; Y82-W89 HydrophobicContact CD2-CZ2 4.36Å; Y82-W89 HydrophobicContact CD2-CZ3 4.16Å; Y82-W89 HydrophobicContact CE2-CH2 4.34Å; Y82-W89 AromaticContact CG-CH2 3.7Å; Y82-W89 HydrophobicContact CG-CH2 3.7Å; Y82-W89 HydrophobicContact CG-CZ2 4.28Å; Y82-W89 HydrophobicContact CG-CZ3 4.1Å
83	Y	97	Very high	94.5	Very high	162 Å²	162	100 Å²	100	64%	0.635	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-59.5	-35.3	-177.3	-173.9	-106.1	0	0	0	111.9	F78 F79 R85 G86	F78-Y83 HydrophobicContact CE1-CD2 4.08Å; F78-Y83 HydrophobicContact CE1-CE2 4.5Å; F78-Y83 HydrophobicContact CZ-CD2 4.11Å; F78-Y83 WeakPolarHBondContact O-CA 3.3Å; F78-Y83 PolarHBondContact O-N 3.29Å; F79-Y83 HydrophobicContact CD1-CD2 4.35Å; Y83-R85 PolarHBondContact O-N 3.46Å; Y83-R85 VanDerWaalsContact O-N 3.13Å; Y83-G86 PolarHBondContact O-N 2.98Å
84	N	97.1	Very high	94.9	Very high	137 Å²	137	103 Å²	103	73%	0.733	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-61.3	-17.6	176.3	65.9	-30.9	0	0	0	114.6	Y82 G86	Y82-N84 PolarHBondContact O-N 3.04Å; N84-G86 VanDerWaalsContact C-N 3.26Å; N84-G86 PolarHBondContact O-N 2.98Å
85	R	96.6	Very high	95.1	Very high	138 Å²	138	102.8 Å²	102.8	52%	0.521	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-79.3	-10.3	176.3	-57.9	-171.4	179.5	-140.1	2.9	113.2	Y82 Y83 W89	Y82-R85 WeakPolarHBondContact O-CB 3.32Å; Y82-R85 PolarHBondContact O-N 3.26Å; Y83-R85 PolarHBondContact O-N 3.46Å; Y83-R85 VanDerWaalsContact O-N 3.13Å; R85-W89 HydrophobicContact CB-CB 3.63Å; R85-W89 HydrophobicContact CB-CD2 3.83Å; R85-W89 HydrophobicContact CB-CE3 4.2Å; R85-W89 HydrophobicContact CB-CG 3.57Å; R85-W89 HydrophobicContact CG-CD2 4.32Å; R85-W89 HydrophobicContact CG-CG 4.3Å; R85-W89 WeakPolarHBondContact O-CB 3.42Å
86	G	96	Very high	95.2	Very high	31 Å²	31	101.3 Å²	101.3	32%	0.32	46%	0.458	S	S	.	.			trans	76.5	166.1	177.7	0	0	0	0	0	114.4	F78 Y83 N84 K88 W89 Y90	F78-G86 WeakPolarHBondContact CE2-O 3.4Å; Y83-G86 PolarHBondContact O-N 2.98Å; N84-G86 VanDerWaalsContact C-N 3.26Å; N84-G86 PolarHBondContact O-N 2.98Å; G86-K88 PolarHBondContact O-N 3.33Å; G86-W89 WeakPolarHBondContact O-CB 3.44Å; G86-W89 PolarHBondContact O-N 3.2Å; G86-W89 VanDerWaalsContact O-N 3.08Å; G86-Y90 PolarHBondContact O-N 3.31Å
87	L	94.4	Very high	95.3	Very high	107 Å²	107	104.5 Å²	104.5	56%	0.56	47%	0.467	S	S	*	.	H	α-helix	trans	-62.4	-27.2	-175.8	-73.6	165.9	0	0	0	113.8	L43 F78 W89 Y90 K91	L43-L87 HydrophobicContact CD2-CD2 4.48Å; F78-L87 HydrophobicContact CE1-CD2 4.12Å; F78-L87 HydrophobicContact CZ-CD2 4.26Å; L87-W89 VanDerWaalsContact C-N 3.26Å; L87-W89 PolarHBondContact O-N 2.99Å; L87-Y90 HydrophobicContact CD2-CD1 4.49Å; L87-Y90 PolarHBondContact O-N 3.06Å; L87-K91 PolarHBondContact O-N 3.22Å; L87-K91 VanDerWaalsContact O-N 3.09Å
88	K	93.6	Very high	95.3	Very high	197 Å²	197	108.2 Å²	108.2	86%	0.857	48%	0.483	S	S	*	.	H	α-helix	trans	-64.9	-32.2	176.5	-174	176	179.2	-178.4	0	112	G86	G86-K88 PolarHBondContact O-N 3.33Å
89	W	93.7	Very high	95.2	Very high	102 Å²	102	116.1 Å²	116.1	39%	0.386	52%	0.518	S	S	.	.	H	α-helix	trans	-74.5	-33	174.3	177.7	86.5	0	0	0	112.1	V76 F78 Y82 R85 G86 L87	V76-W89 HydrophobicContact CG1-CH2 4.27Å; V76-W89 HydrophobicContact CG1-CZ3 4.17Å; F78-W89 HydrophobicContact CB-CZ3 4.36Å; F78-W89 AromaticContact CD2-CE3 3.69Å; F78-W89 HydrophobicContact CD2-CE3 3.69Å; F78-W89 AromaticContact CD2-CZ3 3.72Å; F78-W89 HydrophobicContact CD2-CZ3 3.72Å; F78-W89 HydrophobicContact CE2-CE3 4.15Å; F78-W89 HydrophobicContact CG-CZ3 4.49Å; Y82-W89 AromaticContact CD2-CH2 3.57Å; Y82-W89 HydrophobicContact CD2-CH2 3.57Å; Y82-W89 HydrophobicContact CD2-CZ2 4.36Å; Y82-W89 HydrophobicContact CD2-CZ3 4.16Å; Y82-W89 HydrophobicContact CE2-CH2 4.34Å; Y82-W89 AromaticContact CG-CH2 3.7Å; Y82-W89 HydrophobicContact CG-CH2 3.7Å; Y82-W89 HydrophobicContact CG-CZ2 4.28Å; Y82-W89 HydrophobicContact CG-CZ3 4.1Å; R85-W89 HydrophobicContact CB-CB 3.63Å; R85-W89 HydrophobicContact CB-CD2 3.83Å; R85-W89 HydrophobicContact CB-CE3 4.2Å; R85-W89 HydrophobicContact CB-CG 3.57Å; R85-W89 HydrophobicContact CG-CD2 4.32Å; R85-W89 HydrophobicContact CG-CG 4.3Å; R85-W89 WeakPolarHBondContact O-CB 3.42Å; G86-W89 WeakPolarHBondContact O-CB 3.44Å; G86-W89 PolarHBondContact O-N 3.2Å; G86-W89 VanDerWaalsContact O-N 3.08Å; L87-W89 VanDerWaalsContact C-N 3.26Å; L87-W89 PolarHBondContact O-N 2.99Å
90	Y	94.8	Very high	95.1	Very high	41 Å²	41	115.8 Å²	115.8	16%	0.161	52%	0.518	C	S	.	.	H	α-helix	trans	-74.5	-28.2	-179.2	-174.8	-135.4	0	0	0	114	L43 P44 V76 F78 F79 G86 L87	L43-Y90 HydrophobicContact CD2-CD1 3.8Å; L43-Y90 HydrophobicContact CD2-CE1 4.43Å; P44-Y90 HydrophobicContact CG-CE1 3.63Å; P44-Y90 WeakPolarHBondContact CG-OH 3.23Å; V76-Y90 HydrophobicContact CB-CE2 4.46Å; V76-Y90 HydrophobicContact CG1-CD2 4.01Å; V76-Y90 HydrophobicContact CG1-CE2 3.95Å; F78-Y90 HydrophobicContact CB-CD2 3.46Å; F78-Y90 VanDerWaalsContact CB-CD2 3.46Å; F78-Y90 HydrophobicContact CB-CE2 3.58Å; F78-Y90 HydrophobicContact CB-CG 4.1Å; F78-Y90 AromaticContact CD1-CD1 3.67Å; F78-Y90 HydrophobicContact CD1-CD1 3.67Å; F78-Y90 AromaticContact CD1-CD2 3.87Å; F78-Y90 HydrophobicContact CD1-CD2 3.87Å; F78-Y90 AromaticContact CD1-CE1 4Å; F78-Y90 HydrophobicContact CD1-CE1 4Å; F78-Y90 HydrophobicContact CD1-CE2 4.18Å; F78-Y90 AromaticContact CD1-CG 3.59Å; F78-Y90 HydrophobicContact CD1-CG 3.59Å; F78-Y90 HydrophobicContact CD2-CD2 4.06Å; F78-Y90 AromaticContact CD2-CG 3.98Å; F78-Y90 HydrophobicContact CD2-CG 3.98Å; F78-Y90 AromaticContact CE1-CD1 3.9Å; F78-Y90 HydrophobicContact CE1-CD1 3.9Å; F78-Y90 AromaticContact CE1-CG 3.97Å; F78-Y90 HydrophobicContact CE1-CG 3.97Å; F78-Y90 HydrophobicContact CE2-CG 4.32Å; F78-Y90 HydrophobicContact CG-CD1 4.17Å; F78-Y90 AromaticContact CG-CD2 3.51Å; F78-Y90 HydrophobicContact CG-CD2 3.51Å; F78-Y90 AromaticContact CG-CE2 4Å; F78-Y90 HydrophobicContact CG-CE2 4Å; F78-Y90 AromaticContact CG-CG 3.59Å; F78-Y90 HydrophobicContact CG-CG 3.59Å; F78-Y90 HydrophobicContact CZ-CG 4.31Å; F79-Y90 HydrophobicContact CE2-CE1 4.03Å; F79-Y90 AromaticContact CE2-CZ 3.99Å; F79-Y90 HydrophobicContact CZ-CE1 4.02Å; G86-Y90 PolarHBondContact O-N 3.31Å; L87-Y90 HydrophobicContact CD2-CD1 4.49Å; L87-Y90 PolarHBondContact O-N 3.06Å
91	K	89.9	Confident	95.1	Very high	132 Å²	132	117.1 Å²	117.1	57%	0.574	52%	0.515	S	S	*	.			trans	-70.9	0	179.3	-172.2	179.5	178	178.5	0	111.6	K41 L43 L87	K41-K91 HydrophobicContact CB-CG 4.49Å; K41-K91 WeakPolarHBondContact CB-O 3.47Å; K41-K91 WeakPolarHBondContact O-CE 3.33Å; L43-K91 HydrophobicContact CD2-CB 4.12Å; L87-K91 PolarHBondContact O-N 3.22Å; L87-K91 VanDerWaalsContact O-N 3.09Å

Retrieved 91 of 91 residues in 83.1 ms (Link to these results)

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