A0A077ZA76_TRITR Loading...

Homeobox domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZA76, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 112 aa.

						>A0A077ZA76_TRITR|A0A077ZA76
MSAGNARLWQLPTDMAVAQPGGASRFYRRRKARTVFSDHQLQGLEKRFDCQRYLSTPERIELAAALSLSETQVKTWFQNRRMKHKKVTKKQSINDTSTVKDKEHENVCQATL
					

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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	42.5	Very low	50.1	Low	243 Å²	243	147.1 Å²	147.1	100%	1.197	80%	0.802	S	S	*	*				0	123.8	0	-67.3	163.3	85.9	0	0	108.6
2	S	47.9	Very low	51.1	Low	107 Å²	107	145 Å²	145	75%	0.748	80%	0.802	S	S	*	*			trans	33.1	103	161.7	-150	0	0	0	0	119.2	G4	S2-G4 PolarHBondContact O-N 3.07Å; S2-G4 VanDerWaalsContact O-N 3.09Å
3	A	46.4	Very low	51.9	Low	96 Å²	96	142.3 Å²	142.3	79%	0.793	79%	0.792	S	S	*	*			trans	-58.3	111.6	152.2	0	0	0	0	0	107.8	N5	A3-N5 PolarHBondContact O-N 2.66Å
4	G	43.2	Very low	51.7	Low	73 Å²	73	141.4 Å²	141.4	75%	0.753	79%	0.785	S	S	*	*			trans	-61.2	117.9	-179.4	0	0	0	0	0	110.5	S2 A6	S2-G4 PolarHBondContact O-N 3.07Å; S2-G4 VanDerWaalsContact O-N 3.09Å; G4-A6 PolarHBondContact O-N 2.85Å
5	N	48.8	Very low	51.8	Low	147 Å²	147	143.5 Å²	143.5	79%	0.786	79%	0.789	S	S	*	*			trans	-44.4	123.1	-178.4	-72.5	-41.6	0	0	0	112.8	A3 R7	A3-N5 PolarHBondContact O-N 2.66Å; N5-R7 PolarHBondContact O-N 3.08Å
6	A	48.8	Very low	51.4	Low	91 Å²	91	139.6 Å²	139.6	75%	0.752	78%	0.782	S	S	*	*			trans	-57	110.5	166.4	0	0	0	0	0	108.6	G4 L8	G4-A6 PolarHBondContact O-N 2.85Å; A6-L8 PolarHBondContact O-N 2.7Å
7	R	55.5	Low	51.4	Low	234 Å²	234	138.2 Å²	138.2	88%	0.883	78%	0.777	S	S	*	*			trans	-69.6	75.8	170.1	-76	-179.8	172.6	-101.2	3.8	108.9	N5 W9	N5-R7 PolarHBondContact O-N 3.08Å; R7-W9 PolarHBondContact O-N 2.7Å
8	L	56.6	Low	51	Low	135 Å²	135	136 Å²	136	71%	0.707	78%	0.779	S	S	*	*			trans	-75.5	103	175.7	-177.9	68.7	0	0	0	106.9	A6	A6-L8 PolarHBondContact O-N 2.7Å
9	W	64.2	Low	51.1	Low	194 Å²	194	137.5 Å²	137.5	74%	0.735	78%	0.779	S	S	*	*			trans	53	68.8	164.3	-47.8	105.7	0	0	0	115.7	R7 L11	R7-W9 PolarHBondContact O-N 2.7Å; W9-L11 VanDerWaalsContact C-N 3.27Å; W9-L11 PolarHBondContact O-N 2.7Å
10	Q	49.4	Very low	50.9	Low	155 Å²	155	137.8 Å²	137.8	72%	0.724	79%	0.786	S	S	*	*			trans	-67.6	97.2	153.5	-155	78.5	31	0	0	106.8
11	L	48.4	Very low	50.7	Low	143 Å²	143	134 Å²	134	75%	0.749	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-55.5	133.2	163.4	-76.9	144.7	0	0	0	107	W9 T13	W9-L11 VanDerWaalsContact C-N 3.27Å; W9-L11 PolarHBondContact O-N 2.7Å; L11-T13 PolarHBondContact O-N 2.66Å
12	P	61	Low	50.7	Low	122 Å²	122	126.6 Å²	126.6	79%	0.792	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-55.6	118.6	176.7	-16.1	25.8	0	0	0	108.1	D14	P12-D14 PolarHBondContact O-N 2.85Å
13	T	62.2	Low	51	Low	110 Å²	110	125.7 Å²	125.7	68%	0.675	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-49.8	126.5	170	-43	0	0	0	0	107.2	L11 M15	L11-T13 PolarHBondContact O-N 2.66Å; T13-M15 VanDerWaalsContact C-N 3.27Å; T13-M15 PolarHBondContact O-N 3.04Å
14	D	49.3	Very low	51.5	Low	130 Å²	130	124.7 Å²	124.7	70%	0.695	75%	0.75	S	S	*	*			trans	-52	84	-179.3	-163.5	-106	0	0	0	110.5	P12 A16	P12-D14 PolarHBondContact O-N 2.85Å; D14-A16 PolarHBondContact O-N 3.38Å; D14-A16 VanDerWaalsContact O-N 3.08Å
15	M	52.5	Low	52.2	Low	172 Å²	172	131.4 Å²	131.4	85%	0.847	75%	0.752	S	S	*	*			trans	-83.5	81.8	169.1	-64.4	-103.8	76	0	0	105.3	T13 V17	T13-M15 VanDerWaalsContact C-N 3.27Å; T13-M15 PolarHBondContact O-N 3.04Å; M15-V17 VanDerWaalsContact C-N 3.25Å; M15-V17 PolarHBondContact O-N 3.27Å
16	A	45.5	Very low	52.7	Low	82 Å²	82	132.3 Å²	132.3	68%	0.678	75%	0.75	S	S	*	*			trans	-59.7	84	176.3	0	0	0	0	0	110.2	D14 A18	D14-A16 PolarHBondContact O-N 3.38Å; D14-A16 VanDerWaalsContact O-N 3.08Å; A16-A18 PolarHBondContact O-N 3.04Å
17	V	51.2	Low	53.2	Low	116 Å²	116	138.6 Å²	138.6	70%	0.703	76%	0.755	S	S	*	*			trans	-80.6	101.4	161.2	99.4	0	0	0	0	106.6	M15 Q19	M15-V17 VanDerWaalsContact C-N 3.25Å; M15-V17 PolarHBondContact O-N 3.27Å; V17-Q19 HydrophobicContact CG1-CG 4.46Å; V17-Q19 PolarHBondContact O-N 3.08Å
18	A	45.1	Very low	53.5	Low	98 Å²	98	138.5 Å²	138.5	81%	0.81	76%	0.755	S	S	*	*			trans	-58.5	105.2	173.5	0	0	0	0	0	109.4	A16	A16-A18 PolarHBondContact O-N 3.04Å
19	Q	52.3	Low	54.2	Low	164 Å²	164	143.7 Å²	143.7	77%	0.766	77%	0.765	S	S	*	*			trans	-115.1	119.9	161.5	-75	-174.4	81.1	0	0	107.9	V17 G21	V17-Q19 HydrophobicContact CG1-CG 4.46Å; V17-Q19 PolarHBondContact O-N 3.08Å; Q19-G21 PolarHBondContact O-N 2.81Å
20	P	46.6	Very low	54.6	Low	143 Å²	143	144.8 Å²	144.8	93%	0.929	77%	0.769	S	S	*	*			trans	-81.9	90.5	-176.2	32.9	-31	0	0	0	108.6
21	G	46.4	Very low	55.9	Low	59 Å²	59	147 Å²	147	61%	0.608	78%	0.776	S	S	*	*	S	Bend	trans	-166.2	65.2	179.8	0	0	0	0	0	111.9	Q19 A23	Q19-G21 PolarHBondContact O-N 2.81Å; G21-A23 PolarHBondContact O-N 3.23Å
22	G	43.6	Very low	57.6	Low	87 Å²	87	144.3 Å²	144.3	90%	0.897	78%	0.775	S	S	*	*			trans	51.8	2.9	151.1	0	0	0	0	0	121	S24	G22-S24 PolarHBondContact O-N 2.74Å
23	A	54.8	Low	58.7	Low	88 Å²	88	150.3 Å²	150.3	73%	0.727	78%	0.782	S	S	*	*			trans	-81.4	80.2	-177.2	0	0	0	0	0	108.6	G21 R25	G21-A23 PolarHBondContact O-N 3.23Å; A23-R25 PolarHBondContact O-N 2.95Å; A23-R25 VanDerWaalsContact O-N 3.08Å
24	S	56.6	Low	59.9	Low	75 Å²	75	149.2 Å²	149.2	52%	0.524	78%	0.775	S	S	.	*			trans	-37.1	121.2	165.5	174.6	0	0	0	0	108.4	G22 F26	G22-S24 PolarHBondContact O-N 2.74Å; S24-F26 VanDerWaalsContact CB-CD2 3.47Å; S24-F26 WeakPolarHBondContact O-CD2 3.12Å; S24-F26 PolarHBondContact O-N 3.02Å; S24-F26 WeakPolarHBondContact OG-CD2 3.21Å; S24-F26 WeakPolarHBondContact OG-CE2 3.47Å
25	R	57.8	Low	62	Low	214 Å²	214	149.8 Å²	149.8	81%	0.808	78%	0.783	S	S	*	*			trans	-69.1	47	-178.1	-56.9	-178.8	-94.6	-173.6	-6.6	109.8	A23 Y27	A23-R25 PolarHBondContact O-N 2.95Å; A23-R25 VanDerWaalsContact O-N 3.08Å; R25-Y27 WeakPolarHBondContact O-CD2 3.47Å; R25-Y27 PolarHBondContact O-N 3.37Å
26	F	58.5	Low	63.9	Low	167 Å²	167	143.6 Å²	143.6	73%	0.732	75%	0.751	S	S	*	*			trans	-54.3	97.8	170.7	-75.6	-72.1	0	0	0	105.2	S24 R28	S24-F26 VanDerWaalsContact CB-CD2 3.47Å; S24-F26 WeakPolarHBondContact O-CD2 3.12Å; S24-F26 PolarHBondContact O-N 3.02Å; S24-F26 WeakPolarHBondContact OG-CD2 3.21Å; S24-F26 WeakPolarHBondContact OG-CE2 3.47Å; F26-R28 WeakPolarHBondContact O-CA 3.45Å; F26-R28 PolarHBondContact O-N 3.41Å
27	Y	59.7	Low	66.3	Low	222 Å²	222	142.5 Å²	142.5	87%	0.871	74%	0.739	S	S	*	*			trans	-39.3	98.7	156.7	-65.5	-87.7	0	0	0	104.3	R25 R29	R25-Y27 WeakPolarHBondContact O-CD2 3.47Å; R25-Y27 PolarHBondContact O-N 3.37Å; Y27-R29 PolarHBondContact O-N 2.75Å
28	R	62.8	Low	68.5	Low	233 Å²	233	142 Å²	142	88%	0.879	73%	0.732	S	S	*	*			trans	-61.1	101.2	-171.1	-90.1	-143.3	-97.6	-165.9	-8.2	104.6	F26 R30	F26-R28 WeakPolarHBondContact O-CA 3.45Å; F26-R28 PolarHBondContact O-N 3.41Å; R28-R30 PolarHBondContact O-N 3.27Å
29	R	70	Confident	70.9	Confident	243 Å²	243	143.5 Å²	143.5	92%	0.917	72%	0.722	S	S	*	*			trans	-57.2	111	-171	-151.2	174.9	-148.6	-135.3	4	104.2	Y27 K31	Y27-R29 PolarHBondContact O-N 2.75Å; R29-K31 PolarHBondContact O-N 3.05Å
30	R	73.5	Confident	73	Confident	217 Å²	217	137.3 Å²	137.3	82%	0.819	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-56.1	122.7	-174.5	-77.8	-176.5	169.4	174.3	-2.3	106.2	R28 A32	R28-R30 PolarHBondContact O-N 3.27Å; R30-A32 PolarHBondContact O-N 2.75Å
31	K	76	Confident	75.3	Confident	201 Å²	201	133.1 Å²	133.1	87%	0.874	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-54.7	136.6	176.2	-146.6	81.8	145.4	176.9	0	107.2	R29	R29-K31 PolarHBondContact O-N 3.05Å
32	A	85.3	Confident	77.7	Confident	88 Å²	88	135.8 Å²	135.8	73%	0.727	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-54.1	143.8	174.2	0	0	0	0	0	109.6	R30 T34	R30-A32 PolarHBondContact O-N 2.75Å; A32-T34 PolarHBondContact O-N 3.32Å
33	R	82.8	Confident	80.2	Confident	248 Å²	248	132.7 Å²	132.7	94%	0.936	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-66.6	130.6	178.4	-69.8	-178.7	179.2	158.7	0.1	109
34	T	88.6	Confident	82.1	Confident	86 Å²	86	128.6 Å²	128.6	53%	0.528	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-86.4	137.3	173.1	56.1	0	0	0	0	109.8	A32	A32-T34 PolarHBondContact O-N 3.32Å
35	V	92.3	Very high	84	Confident	142 Å²	142	129 Å²	129	86%	0.861	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-100.8	129.2	168	-178	0	0	0	0	107.5
36	F	92.9	Very high	85.8	Confident	42 Å²	42	126.4 Å²	126.4	18%	0.184	58%	0.582	C	S	.	*	P	Polyproline II helix	trans	-87.7	148.1	176.4	-59.2	-46.2	0	0	0	110.3	Q40 L41 L68 Q72 W76	F36-Q40 HydrophobicContact CB-CB 4.16Å; F36-L41 HydrophobicContact CB-CD2 4.03Å; F36-L41 HydrophobicContact CB-CG 4.2Å; F36-L41 HydrophobicContact CD2-CD2 4.25Å; F36-L68 HydrophobicContact CD1-CD1 4.4Å; F36-L68 HydrophobicContact CD1-CD2 3.77Å; F36-L68 HydrophobicContact CE1-CD1 4.35Å; F36-L68 HydrophobicContact CE1-CD2 3.62Å; F36-Q72 HydrophobicContact CE1-CB 4.44Å; F36-Q72 HydrophobicContact CZ-CB 4.1Å; F36-Q72 HydrophobicContact CZ-CG 4.36Å; F36-W76 AromaticContact CD2-CD1 3.84Å; F36-W76 HydrophobicContact CE2-CB 4.44Å; F36-W76 AromaticContact CE2-CD1 3.74Å; F36-W76 HydrophobicContact CE2-CG 4.45Å
37	S	96.4	Very high	87.4	Confident	59 Å²	59	122 Å²	122	41%	0.413	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-72	161.3	174.2	69.1	0	0	0	0	111.3	H39 Q40 L41	S37-H39 VanDerWaalsContact C-N 3.3Å; S37-H39 PolarHBondContact O-N 2.96Å; S37-Q40 WeakPolarHBondContact O-CB 3.43Å; S37-Q40 PolarHBondContact O-N 3.07Å; S37-Q40 VanDerWaalsContact O-N 3.1Å; S37-Q40 WeakPolarHBondContact OG-CG 3.28Å; S37-Q40 PolarHBondContact OG-N 3.01Å; S37-L41 WeakPolarHBondContact O-CG 3.44Å; S37-L41 PolarHBondContact O-N 3.05Å
38	D	96.4	Very high	89.1	Confident	106 Å²	106	111.5 Å²	111.5	57%	0.567	52%	0.519	S	S	*	.	H	α-helix	trans	-59.4	-42.9	178.5	-165.4	-101.3	0	0	0	111.7	Q40 L41 Q42	D38-Q40 VanDerWaalsContact C-N 3.31Å; D38-Q40 PolarHBondContact O-N 3.44Å; D38-L41 PolarHBondContact O-N 3.29Å; D38-L41 VanDerWaalsContact O-N 3.09Å; D38-Q42 WeakPolarHBondContact O-CG 3.25Å; D38-Q42 PolarHBondContact O-N 2.92Å; D38-Q42 PolarHBondContact OD1-NE2 3.38Å
39	H	95.9	Very high	90.5	Very high	129 Å²	129	105.4 Å²	105.4	60%	0.597	50%	0.504	S	S	*	.	H	α-helix	trans	-55.4	-43.3	173.1	175.2	-99.1	0	0	0	112.9	S37 G43	S37-H39 VanDerWaalsContact C-N 3.3Å; S37-H39 PolarHBondContact O-N 2.96Å; H39-G43 PolarHBondContact O-N 3.39Å; H39-G43 VanDerWaalsContact O-N 3.08Å
40	Q	95.8	Very high	91.6	Very high	34 Å²	34	98.8 Å²	98.8	16%	0.159	49%	0.494	C	S	.	.	H	α-helix	trans	-64.7	-42.8	176.5	-73.1	173.6	-28.4	0	0	111.4	F36 S37 D38 G43 L44 L66	F36-Q40 HydrophobicContact CB-CB 4.16Å; S37-Q40 WeakPolarHBondContact O-CB 3.43Å; S37-Q40 PolarHBondContact O-N 3.07Å; S37-Q40 VanDerWaalsContact O-N 3.1Å; S37-Q40 WeakPolarHBondContact OG-CG 3.28Å; S37-Q40 PolarHBondContact OG-N 3.01Å; D38-Q40 VanDerWaalsContact C-N 3.31Å; D38-Q40 PolarHBondContact O-N 3.44Å; Q40-G43 PolarHBondContact O-N 3.35Å; Q40-L44 WeakPolarHBondContact O-CB 3.39Å; Q40-L44 WeakPolarHBondContact O-CD1 3.44Å; Q40-L44 WeakPolarHBondContact O-CG 3.3Å; Q40-L44 PolarHBondContact O-N 3.1Å; Q40-L66 HydrophobicContact CG-CB 4.43Å; Q40-L66 PolarHBondContact NE2-O 3.48Å
41	L	96	Very high	92.4	Very high	56 Å²	56	89.6 Å²	89.6	29%	0.293	46%	0.46	S	S	.	.	H	α-helix	trans	-63.5	-46	177.8	-66.3	176	0	0	0	111.5	F36 S37 D38 G43 L44 E45	F36-L41 HydrophobicContact CB-CD2 4.03Å; F36-L41 HydrophobicContact CB-CG 4.2Å; F36-L41 HydrophobicContact CD2-CD2 4.25Å; S37-L41 WeakPolarHBondContact O-CG 3.44Å; S37-L41 PolarHBondContact O-N 3.05Å; D38-L41 PolarHBondContact O-N 3.29Å; D38-L41 VanDerWaalsContact O-N 3.09Å; L41-G43 VanDerWaalsContact C-N 3.34Å; L41-G43 PolarHBondContact O-N 3Å; L41-L44 PolarHBondContact O-N 3.34Å; L41-E45 WeakPolarHBondContact O-CB 3.48Å; L41-E45 WeakPolarHBondContact O-CG 3.46Å; L41-E45 PolarHBondContact O-N 3.09Å
42	Q	96.4	Very high	93.2	Very high	114 Å²	114	83.6 Å²	83.6	53%	0.533	43%	0.432	S	S	.	.	H	α-helix	trans	-59	-44.2	177.2	-70.3	-176.2	18.3	0	0	112	D38 E45 K46	D38-Q42 WeakPolarHBondContact O-CG 3.25Å; D38-Q42 PolarHBondContact O-N 2.92Å; D38-Q42 PolarHBondContact OD1-NE2 3.38Å; Q42-E45 PolarHBondContact O-N 3.32Å; Q42-K46 VanDerWaalsContact O-CB 3.31Å; Q42-K46 WeakPolarHBondContact O-CB 3.33Å; Q42-K46 PolarHBondContact O-N 3.15Å
43	G	95.2	Very high	93.7	Very high	23 Å²	23	85.7 Å²	85.7	24%	0.237	42%	0.422	C	S	.	.	H	α-helix	trans	-62.6	-42.7	176.6	0	0	0	0	0	112.9	H39 Q40 L41 R47	H39-G43 PolarHBondContact O-N 3.39Å; H39-G43 VanDerWaalsContact O-N 3.08Å; Q40-G43 PolarHBondContact O-N 3.35Å; L41-G43 VanDerWaalsContact C-N 3.34Å; L41-G43 PolarHBondContact O-N 3Å; G43-R47 PolarHBondContact O-N 2.89Å
44	L	96	Very high	94.1	Very high	1 Å²	1	75 Å²	75	1%	0.005	38%	0.383	C	S	.	.	H	α-helix	trans	-65.2	-42.3	175.9	-69.5	166	0	0	0	111.9	Q40 L41 F48 L62 L66 L68 V73 W76 F77	Q40-L44 WeakPolarHBondContact O-CB 3.39Å; Q40-L44 WeakPolarHBondContact O-CD1 3.44Å; Q40-L44 WeakPolarHBondContact O-CG 3.3Å; Q40-L44 PolarHBondContact O-N 3.1Å; L41-L44 PolarHBondContact O-N 3.34Å; L44-F48 WeakPolarHBondContact O-CB 3.42Å; L44-F48 PolarHBondContact O-N 3.13Å; L44-L62 HydrophobicContact CD2-CD2 3.85Å; L44-L62 HydrophobicContact CD2-CG 4.27Å; L44-L66 HydrophobicContact CD2-CD1 3.82Å; L44-L66 HydrophobicContact CG-CD1 3.61Å; L44-L68 HydrophobicContact CD1-CD1 4.15Å; L44-V73 HydrophobicContact CD2-CG1 4.21Å; L44-V73 HydrophobicContact CD2-CG2 4.39Å; L44-W76 HydrophobicContact CB-CD2 3.97Å; L44-W76 HydrophobicContact CB-CE3 3.86Å; L44-W76 HydrophobicContact CB-CH2 3.55Å; L44-W76 HydrophobicContact CB-CZ2 3.64Å; L44-W76 HydrophobicContact CB-CZ3 3.66Å; L44-W76 HydrophobicContact CD1-CB 4.5Å; L44-W76 HydrophobicContact CD1-CD2 3.76Å; L44-W76 HydrophobicContact CD1-CE3 4.35Å; L44-W76 HydrophobicContact CD1-CG 3.8Å; L44-W76 HydrophobicContact CD1-CZ2 4.41Å; L44-W76 HydrophobicContact CD2-CD2 4.42Å; L44-W76 HydrophobicContact CD2-CE3 4.24Å; L44-W76 HydrophobicContact CG-CD2 4.26Å; L44-W76 HydrophobicContact CG-CE3 4.37Å; L44-F77 HydrophobicContact CD2-CE2 4.02Å
45	E	96.1	Very high	94.4	Very high	83 Å²	83	72.4 Å²	72.4	39%	0.388	37%	0.369	S	S	.	.	H	α-helix	trans	-66.2	-46.7	178.6	-74.5	-171	163.5	0	0	111.9	L41 Q42 R47 F48 D49 W76	L41-E45 WeakPolarHBondContact O-CB 3.48Å; L41-E45 WeakPolarHBondContact O-CG 3.46Å; L41-E45 PolarHBondContact O-N 3.09Å; Q42-E45 PolarHBondContact O-N 3.32Å; E45-R47 VanDerWaalsContact C-N 3.29Å; E45-R47 PolarHBondContact O-N 2.7Å; E45-F48 WeakPolarHBondContact O-CA 3.33Å; E45-F48 WeakPolarHBondContact O-CB 3.49Å; E45-F48 PolarHBondContact O-N 2.84Å; E45-D49 PolarHBondContact O-N 2.86Å; E45-W76 HydrophobicContact CG-CH2 3.85Å; E45-W76 HydrophobicContact CG-CZ2 3.89Å
46	K	94.9	Very high	94.5	Very high	160 Å²	160	69.6 Å²	69.6	70%	0.696	35%	0.352	S	S	*	.	H	α-helix	trans	-55	-44.6	176.7	-176.7	176.3	-179.4	179.4	0	111.9	Q42	Q42-K46 VanDerWaalsContact O-CB 3.31Å; Q42-K46 WeakPolarHBondContact O-CB 3.33Å; Q42-K46 PolarHBondContact O-N 3.15Å
47	R	92.5	Very high	94.6	Very high	75 Å²	75	71.3 Å²	71.3	28%	0.283	37%	0.368	S	S	.	.	H	α-helix	trans	-69.4	-36.8	176.5	-164.8	73	175.6	-124.1	2.4	111.5	G43 E45 C50 Q51 L54 E58 E61 L62 F77	G43-R47 PolarHBondContact O-N 2.89Å; E45-R47 VanDerWaalsContact C-N 3.29Å; E45-R47 PolarHBondContact O-N 2.7Å; R47-C50 PolarHBondContact O-N 3.37Å; R47-Q51 PolarHBondContact O-N 3.37Å; R47-L54 HydrophobicContact CG-CD2 3.86Å; R47-E58 IonicContact CZ-OE1 3.95Å; R47-E58 IonicContact NH2-OE1 2.93Å; R47-E58 PolarHBondContact NH2-OE1 3.39Å; R47-E61 IonicContact NH2-OE2 3.9Å; R47-L62 HydrophobicContact CB-CD1 4.42Å; R47-L62 HydrophobicContact CB-CD2 4.12Å; R47-L62 HydrophobicContact CG-CD2 4.13Å; R47-F77 HydrophobicContact CB-CZ 4.44Å
48	F	94.7	Very high	94.5	Very high	2 Å²	2	70 Å²	70	1%	0.009	36%	0.355	C	S	.	.	H	α-helix	trans	-65.1	-37.9	179.1	-174.8	-94.8	0	0	0	113.6	L44 E45 Q51 R52 W76 F77 R80 R81	L44-F48 WeakPolarHBondContact O-CB 3.42Å; L44-F48 PolarHBondContact O-N 3.13Å; E45-F48 WeakPolarHBondContact O-CA 3.33Å; E45-F48 WeakPolarHBondContact O-CB 3.49Å; E45-F48 PolarHBondContact O-N 2.84Å; F48-Q51 WeakPolarHBondContact CA-O 3.34Å; F48-Q51 CarbonylContact O-C 3.12Å; F48-Q51 VanDerWaalsContact O-C 3.27Å; F48-Q51 PolarHBondContact O-N 3.19Å; F48-R52 HydrophobicContact CE1-CG 4.11Å; F48-R52 HydrophobicContact CE2-CB 4.11Å; F48-R52 HydrophobicContact CE2-CG 4.13Å; F48-R52 HydrophobicContact CZ-CB 4.27Å; F48-R52 HydrophobicContact CZ-CG 3.86Å; F48-R52 PolarHBondContact O-N 3.41Å; F48-W76 HydrophobicContact CB-CH2 4.34Å; F48-W76 HydrophobicContact CB-CZ3 4.13Å; F48-W76 HydrophobicContact CD2-CZ3 4.38Å; F48-W76 HydrophobicContact CG-CZ3 4.43Å; F48-F77 HydrophobicContact CB-CE1 4.21Å; F48-F77 HydrophobicContact CB-CZ 4.31Å; F48-F77 AromaticContact CD2-CD1 3.84Å; F48-F77 HydrophobicContact CD2-CD1 3.84Å; F48-F77 AromaticContact CD2-CE1 3.77Å; F48-F77 HydrophobicContact CD2-CE1 3.77Å; F48-F77 HydrophobicContact CE2-CD1 4.46Å; F48-F77 HydrophobicContact CG-CE1 4.5Å; F48-R80 HydrophobicContact CD1-CG 3.9Å; F48-R80 HydrophobicContact CD2-CB 4.33Å; F48-R80 HydrophobicContact CD2-CG 3.79Å; F48-R80 HydrophobicContact CE1-CG 3.8Å; F48-R80 HydrophobicContact CE2-CB 4.1Å; F48-R80 HydrophobicContact CE2-CG 3.69Å; F48-R80 HydrophobicContact CG-CG 3.89Å; F48-R80 HydrophobicContact CZ-CB 4.42Å; F48-R80 HydrophobicContact CZ-CG 3.7Å; F48-R81 HydrophobicContact CE2-CG 3.82Å; F48-R81 HydrophobicContact CZ-CG 4.18Å
49	D	93.9	Very high	94.5	Very high	105 Å²	105	67.3 Å²	67.3	56%	0.561	34%	0.337	S	S	*	.	H	α-helix	trans	-66.3	-38.4	179.7	-73.5	-38.1	0	0	0	112.1	E45	E45-D49 PolarHBondContact O-N 2.86Å
50	C	91.9	Very high	94.5	Very high	104 Å²	104	65.1 Å²	65.1	70%	0.703	33%	0.329	S	S	*	.	H	α-helix	trans	-72.8	-42.3	171.6	-61.8	0	0	0	0	111.4	R47	R47-C50 PolarHBondContact O-N 3.37Å
51	Q	91.1	Very high	94.5	Very high	23 Å²	23	69 Å²	69	11%	0.107	35%	0.346	C	S	.	.			trans	-146.2	110.1	-170.8	-177.6	172.8	-46.6	0	0	112.5	R47 F48 Y53 E58 H104	R47-Q51 PolarHBondContact O-N 3.37Å; F48-Q51 WeakPolarHBondContact CA-O 3.34Å; F48-Q51 CarbonylContact O-C 3.12Å; F48-Q51 VanDerWaalsContact O-C 3.27Å; F48-Q51 PolarHBondContact O-N 3.19Å; Q51-Y53 VanDerWaalsContact C-N 3.33Å; Q51-Y53 WeakPolarHBondContact CG-O 3.34Å; Q51-Y53 PolarHBondContact NE2-O 3.22Å; Q51-Y53 PolarHBondContact O-N 2.85Å; Q51-E58 PolarHBondContact NE2-OE1 2.91Å; Q51-E58 PolarHBondContact NE2-OE2 3.44Å; Q51-E58 PolarHBondContact OE1-OE1 2.92Å; Q51-H104 PolarHBondContact OE1-CE1 2.89Å
52	R	92.1	Very high	94.5	Very high	76 Å²	76	67 Å²	67	29%	0.287	34%	0.336	S	S	.	.	S	Bend	trans	-75.8	-17.6	-177.4	-69	175.9	164.3	73.6	-4.8	114.3	F48 R81 H84	F48-R52 HydrophobicContact CE1-CG 4.11Å; F48-R52 HydrophobicContact CE2-CB 4.11Å; F48-R52 HydrophobicContact CE2-CG 4.13Å; F48-R52 HydrophobicContact CZ-CB 4.27Å; F48-R52 HydrophobicContact CZ-CG 3.86Å; F48-R52 PolarHBondContact O-N 3.41Å; R52-R81 WeakPolarHBondContact O-CD 3.27Å; R52-H84 PolarHBondContact NE-NE2 3.24Å; R52-H84 PolarHBondContact NH2-CE1 2.88Å; R52-H84 PolarHBondContact NH2-NE2 3.48Å; R52-H84 VanDerWaalsContact NH2-NE2 3.11Å
53	Y	95	Very high	94.5	Very high	131 Å²	131	61.8 Å²	61.8	51%	0.514	31%	0.313	S	S	.	.	S	Bend	trans	-129.1	116.2	-177.5	-64.7	-99.7	0	0	0	109.6	Q51	Q51-Y53 VanDerWaalsContact C-N 3.33Å; Q51-Y53 WeakPolarHBondContact CG-O 3.34Å; Q51-Y53 PolarHBondContact NE2-O 3.22Å; Q51-Y53 PolarHBondContact O-N 2.85Å
54	L	91.6	Very high	94.6	Very high	23 Å²	23	64.2 Å²	64.2	12%	0.12	33%	0.331	C	S	.	.			trans	-93.3	132.8	177.4	-69.3	172.5	0	0	0	111.8	R47 E58 L62 V73 F77	R47-L54 HydrophobicContact CG-CD2 3.86Å; L54-E58 HydrophobicContact CD2-CB 3.89Å; L54-L62 HydrophobicContact CD1-CD2 3.69Å; L54-V73 HydrophobicContact CD1-CG1 3.93Å; L54-F77 HydrophobicContact CD1-CD1 4.03Å; L54-F77 HydrophobicContact CD1-CD2 3.73Å; L54-F77 HydrophobicContact CD1-CE1 3.63Å; L54-F77 HydrophobicContact CD1-CE2 3.3Å; L54-F77 HydrophobicContact CD1-CG 4.09Å; L54-F77 HydrophobicContact CD1-CZ 3.26Å; L54-F77 HydrophobicContact CD2-CE1 4.39Å; L54-F77 HydrophobicContact CD2-CZ 4.34Å; L54-F77 HydrophobicContact CG-CD1 4.03Å; L54-F77 HydrophobicContact CG-CE1 3.59Å; L54-F77 HydrophobicContact CG-CE2 4.22Å; L54-F77 HydrophobicContact CG-CZ 3.71Å
55	S	94.4	Very high	94.5	Very high	33 Å²	33	67.7 Å²	67.7	23%	0.231	36%	0.36	C	S	.	.			trans	-68.4	167.2	165.3	-65.1	0	0	0	0	111.2	E58 R59 N106	S55-E58 VanDerWaalsContact CB-OE2 3.27Å; S55-E58 WeakPolarHBondContact CB-OE2 3.09Å; S55-E58 PolarHBondContact N-OE2 3.34Å; S55-E58 PolarHBondContact O-N 2.9Å; S55-E58 PolarHBondContact OG-OE2 3.41Å; S55-R59 WeakPolarHBondContact O-CB 3.37Å; S55-R59 PolarHBondContact O-N 3.38Å; S55-N106 PolarHBondContact OG-ND2 2.96Å; S55-N106 PolarHBondContact OG-OD1 3.39Å
56	T	94.6	Very high	94.5	Very high	83 Å²	83	64.5 Å²	64.5	51%	0.509	35%	0.345	S	S	.	.	H	α-helix	trans	-54.6	-53.9	176.7	-54.5	0	0	0	0	113.4	E58 R59 I60	T56-E58 PolarHBondContact O-N 2.9Å; T56-R59 WeakPolarHBondContact O-CB 3.26Å; T56-R59 PolarHBondContact O-N 2.88Å; T56-I60 HydrophobicContact CG2-CD1 4.35Å; T56-I60 WeakPolarHBondContact O-CG1 3.19Å; T56-I60 PolarHBondContact O-N 2.78Å
57	P	95.3	Very high	94.5	Very high	78 Å²	78	62.1 Å²	62.1	51%	0.506	35%	0.348	S	S	.	.	H	α-helix	trans	-60.6	-42.5	-179.9	22.2	-34.1	0	0	0	112.9	R59 I60 E61	P57-R59 VanDerWaalsContact C-N 3.27Å; P57-R59 PolarHBondContact O-N 3.32Å; P57-I60 WeakPolarHBondContact O-CB 3.44Å; P57-I60 PolarHBondContact O-N 3.11Å; P57-E61 PolarHBondContact O-N 3.5Å
58	E	94.6	Very high	94.6	Very high	30 Å²	30	59.5 Å²	59.5	14%	0.14	34%	0.34	C	S	.	.	H	α-helix	trans	-66.7	-30.7	-178.8	-56.6	178.4	93.4	0	0	113	R47 Q51 L54 S55 T56 I60 L62	R47-E58 IonicContact CZ-OE1 3.95Å; R47-E58 IonicContact NH2-OE1 2.93Å; R47-E58 PolarHBondContact NH2-OE1 3.39Å; Q51-E58 PolarHBondContact NE2-OE1 2.91Å; Q51-E58 PolarHBondContact NE2-OE2 3.44Å; Q51-E58 PolarHBondContact OE1-OE1 2.92Å; L54-E58 HydrophobicContact CD2-CB 3.89Å; S55-E58 VanDerWaalsContact CB-OE2 3.27Å; S55-E58 WeakPolarHBondContact CB-OE2 3.09Å; S55-E58 PolarHBondContact N-OE2 3.34Å; S55-E58 PolarHBondContact O-N 2.9Å; S55-E58 PolarHBondContact OG-OE2 3.41Å; T56-E58 PolarHBondContact O-N 2.9Å; E58-I60 VanDerWaalsContact C-N 3.34Å; E58-L62 WeakPolarHBondContact O-CB 3.43Å; E58-L62 PolarHBondContact O-N 3.03Å
59	R	95.7	Very high	94.6	Very high	51 Å²	51	62 Å²	62	19%	0.192	36%	0.358	C	S	.	.	H	α-helix	trans	-65.7	-40.6	172.7	-172.4	-169.1	-57.7	147.4	10	110.9	S55 T56 P57 L62 A63 E70 V73	S55-R59 WeakPolarHBondContact O-CB 3.37Å; S55-R59 PolarHBondContact O-N 3.38Å; T56-R59 WeakPolarHBondContact O-CB 3.26Å; T56-R59 PolarHBondContact O-N 2.88Å; P57-R59 VanDerWaalsContact C-N 3.27Å; P57-R59 PolarHBondContact O-N 3.32Å; R59-L62 PolarHBondContact O-N 3.09Å; R59-A63 WeakPolarHBondContact O-CB 3.47Å; R59-A63 PolarHBondContact O-N 3.45Å; R59-E70 WeakPolarHBondContact CD-O 3.37Å; R59-E70 HydrophobicContact CG-CB 4.17Å; R59-E70 HydrophobicContact CG-CG 4.38Å; R59-V73 HydrophobicContact CG-CB 4.11Å; R59-V73 HydrophobicContact CG-CG1 4Å
60	I	96.6	Very high	94.7	Very high	83 Å²	83	60.9 Å²	60.9	43%	0.426	35%	0.349	S	S	.	.	H	α-helix	trans	-64	-47.1	177.4	-63.6	164.8	0	0	0	109.5	T56 P57 E58 L62 A63 A64 E70	T56-I60 HydrophobicContact CG2-CD1 4.35Å; T56-I60 WeakPolarHBondContact O-CG1 3.19Å; T56-I60 PolarHBondContact O-N 2.78Å; P57-I60 WeakPolarHBondContact O-CB 3.44Å; P57-I60 PolarHBondContact O-N 3.11Å; E58-I60 VanDerWaalsContact C-N 3.34Å; I60-L62 PolarHBondContact O-N 3.48Å; I60-A63 PolarHBondContact O-N 3.08Å; I60-A64 WeakPolarHBondContact O-CB 3.33Å; I60-A64 PolarHBondContact O-N 3.25Å; I60-E70 VanDerWaalsContact CG1-CD 3.47Å; I60-E70 HydrophobicContact CG1-CG 4.03Å
61	E	96.4	Very high	94.8	Very high	114 Å²	114	60 Å²	60	53%	0.533	34%	0.341	S	S	.	.	H	α-helix	trans	-57.6	-47.9	176.2	-69	176.5	171	0	0	112.3	R47 P57 A64 A65	R47-E61 IonicContact NH2-OE2 3.9Å; P57-E61 PolarHBondContact O-N 3.5Å; E61-A64 PolarHBondContact O-N 3.4Å; E61-A65 WeakPolarHBondContact O-CB 3.49Å; E61-A65 PolarHBondContact O-N 3.23Å
62	L	95.5	Very high	94.9	Very high	14 Å²	14	61.5 Å²	61.5	7%	0.073	35%	0.348	C	S	.	.	H	α-helix	trans	-69.3	-36.3	-179.1	-172.4	60.7	0	0	0	112.3	L44 R47 L54 E58 R59 I60 A65 L66 V73 F77	L44-L62 HydrophobicContact CD2-CD2 3.85Å; L44-L62 HydrophobicContact CD2-CG 4.27Å; R47-L62 HydrophobicContact CB-CD1 4.42Å; R47-L62 HydrophobicContact CB-CD2 4.12Å; R47-L62 HydrophobicContact CG-CD2 4.13Å; L54-L62 HydrophobicContact CD1-CD2 3.69Å; E58-L62 WeakPolarHBondContact O-CB 3.43Å; E58-L62 PolarHBondContact O-N 3.03Å; R59-L62 PolarHBondContact O-N 3.09Å; I60-L62 PolarHBondContact O-N 3.48Å; L62-A65 PolarHBondContact O-N 2.82Å; L62-L66 HydrophobicContact CD1-CD1 3.8Å; L62-L66 HydrophobicContact CD1-CG 4.19Å; L62-L66 HydrophobicContact CG-CD1 4.15Å; L62-L66 WeakPolarHBondContact O-CB 3.47Å; L62-L66 PolarHBondContact O-N 3.42Å; L62-L66 VanDerWaalsContact O-N 3.11Å; L62-V73 HydrophobicContact CD2-CG1 3.9Å; L62-V73 HydrophobicContact CG-CG1 4.41Å; L62-F77 HydrophobicContact CD2-CE2 3.69Å; L62-F77 HydrophobicContact CD2-CZ 4.03Å
63	A	96.5	Very high	95.1	Very high	6 Å²	6	58 Å²	58	5%	0.05	33%	0.334	C	S	.	.	H	α-helix	trans	-61.4	-47.6	174.2	0	0	0	0	0	110.9	R59 I60 L66 S67 L68 E70 V73	R59-A63 WeakPolarHBondContact O-CB 3.47Å; R59-A63 PolarHBondContact O-N 3.45Å; I60-A63 PolarHBondContact O-N 3.08Å; A63-L66 PolarHBondContact O-N 3.25Å; A63-S67 WeakPolarHBondContact O-CA 3.4Å; A63-S67 PolarHBondContact O-N 3.05Å; A63-L68 CarbonylContact C-O 3.49Å; A63-L68 VanDerWaalsContact CB-O 3.28Å; A63-L68 WeakPolarHBondContact CB-O 3.42Å; A63-L68 PolarHBondContact O-N 3.31Å; A63-E70 HydrophobicContact CB-CG 4.22Å; A63-V73 HydrophobicContact CB-CG2 4.05Å
64	A	96.5	Very high	95.1	Very high	74 Å²	74	56.6 Å²	56.6	61%	0.612	33%	0.331	S	S	*	.	H	α-helix	trans	-61.9	-46.5	175.9	0	0	0	0	0	111.9	I60 E61 L66 S67	I60-A64 WeakPolarHBondContact O-CB 3.33Å; I60-A64 PolarHBondContact O-N 3.25Å; E61-A64 PolarHBondContact O-N 3.4Å; A64-L66 VanDerWaalsContact C-N 3.29Å; A64-L66 PolarHBondContact O-N 3.07Å; A64-S67 PolarHBondContact O-N 2.99Å
65	A	94.9	Very high	95.3	Very high	74 Å²	74	58.3 Å²	58.3	61%	0.612	34%	0.343	S	S	*	.	H	α-helix	trans	-62.1	-32.6	-179.1	0	0	0	0	0	113.6	E61 L62	E61-A65 WeakPolarHBondContact O-CB 3.49Å; E61-A65 PolarHBondContact O-N 3.23Å; L62-A65 PolarHBondContact O-N 2.82Å
66	L	95	Very high	95.4	Very high	15 Å²	15	58.1 Å²	58.1	8%	0.079	34%	0.337	C	S	.	.	H	α-helix	trans	-104.3	3.6	-177.1	-61.5	-179	0	0	0	114.1	Q40 L44 L62 A63 A64 L68	Q40-L66 HydrophobicContact CG-CB 4.43Å; Q40-L66 PolarHBondContact NE2-O 3.48Å; L44-L66 HydrophobicContact CD2-CD1 3.82Å; L44-L66 HydrophobicContact CG-CD1 3.61Å; L62-L66 HydrophobicContact CD1-CD1 3.8Å; L62-L66 HydrophobicContact CD1-CG 4.19Å; L62-L66 HydrophobicContact CG-CD1 4.15Å; L62-L66 WeakPolarHBondContact O-CB 3.47Å; L62-L66 PolarHBondContact O-N 3.42Å; L62-L66 VanDerWaalsContact O-N 3.11Å; A63-L66 PolarHBondContact O-N 3.25Å; A64-L66 VanDerWaalsContact C-N 3.29Å; A64-L66 PolarHBondContact O-N 3.07Å; L66-L68 VanDerWaalsContact C-N 3.26Å; L66-L68 HydrophobicContact CB-CD1 4.06Å; L66-L68 HydrophobicContact CB-CG 4.11Å; L66-L68 HydrophobicContact CD1-CD1 4.46Å; L66-L68 PolarHBondContact O-N 3.24Å
67	S	95.5	Very high	95.4	Very high	110 Å²	110	54.6 Å²	54.6	77%	0.769	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	44.3	-173.5	-58.9	0	0	0	0	112.6	A63 A64	A63-S67 WeakPolarHBondContact O-CA 3.4Å; A63-S67 PolarHBondContact O-N 3.05Å; A64-S67 PolarHBondContact O-N 2.99Å
68	L	94.5	Very high	95.5	Very high	20 Å²	20	56 Å²	56	11%	0.105	31%	0.314	C	S	.	.			trans	-114.5	161.1	176.7	-67.2	177.3	0	0	0	109.8	F36 L44 A63 L66 V73	F36-L68 HydrophobicContact CD1-CD1 4.4Å; F36-L68 HydrophobicContact CD1-CD2 3.77Å; F36-L68 HydrophobicContact CE1-CD1 4.35Å; F36-L68 HydrophobicContact CE1-CD2 3.62Å; L44-L68 HydrophobicContact CD1-CD1 4.15Å; A63-L68 CarbonylContact C-O 3.49Å; A63-L68 VanDerWaalsContact CB-O 3.28Å; A63-L68 WeakPolarHBondContact CB-O 3.42Å; A63-L68 PolarHBondContact O-N 3.31Å; L66-L68 VanDerWaalsContact C-N 3.26Å; L66-L68 HydrophobicContact CB-CD1 4.06Å; L66-L68 HydrophobicContact CB-CG 4.11Å; L66-L68 HydrophobicContact CD1-CD1 4.46Å; L66-L68 PolarHBondContact O-N 3.24Å; L68-V73 HydrophobicContact CB-CG2 4.07Å; L68-V73 HydrophobicContact CD1-CG2 4.43Å
69	S	94.9	Very high	95.5	Very high	55 Å²	55	59 Å²	59	39%	0.385	33%	0.332	S	S	.	.			trans	-79.2	149.6	168.4	64.3	0	0	0	0	111.1	T71 Q72 V73	S69-T71 PolarHBondContact O-N 3.48Å; S69-T71 VanDerWaalsContact O-N 3.13Å; S69-Q72 WeakPolarHBondContact O-CB 3.37Å; S69-Q72 PolarHBondContact O-N 2.96Å; S69-Q72 VanDerWaalsContact OG-CD 3.31Å; S69-Q72 VanDerWaalsContact OG-CG 3.25Å; S69-Q72 WeakPolarHBondContact OG-CG 3.47Å; S69-Q72 PolarHBondContact OG-N 3.3Å; S69-Q72 PolarHBondContact OG-OE1 3.37Å; S69-V73 PolarHBondContact O-N 2.97Å
70	E	95.7	Very high	95.4	Very high	82 Å²	82	59.2 Å²	59.2	38%	0.383	33%	0.332	S	S	.	.	H	α-helix	trans	-51.4	-38.9	173.4	-70.5	-179.6	-112.8	0	0	112.3	R59 I60 A63 V73 K74	R59-E70 WeakPolarHBondContact CD-O 3.37Å; R59-E70 HydrophobicContact CG-CB 4.17Å; R59-E70 HydrophobicContact CG-CG 4.38Å; I60-E70 VanDerWaalsContact CG1-CD 3.47Å; I60-E70 HydrophobicContact CG1-CG 4.03Å; A63-E70 HydrophobicContact CB-CG 4.22Å; E70-V73 PolarHBondContact O-N 3.37Å; E70-K74 VanDerWaalsContact O-CB 3.3Å; E70-K74 WeakPolarHBondContact O-CB 3.34Å; E70-K74 PolarHBondContact O-N 2.99Å
71	T	94	Very high	95.2	Very high	85 Å²	85	59.1 Å²	59.1	52%	0.521	33%	0.327	S	S	.	.	H	α-helix	trans	-65.3	-40.7	178.7	-64	0	0	0	0	111.7	S69 K74 T75	S69-T71 PolarHBondContact O-N 3.48Å; S69-T71 VanDerWaalsContact O-N 3.13Å; T71-K74 PolarHBondContact O-N 3.37Å; T71-T75 WeakPolarHBondContact O-CB 3.31Å; T71-T75 PolarHBondContact O-N 2.88Å; T71-T75 PolarHBondContact O-OG1 2.92Å
72	Q	94.6	Very high	95	Very high	55 Å²	55	58.5 Å²	58.5	26%	0.257	33%	0.325	S	S	.	.	H	α-helix	trans	-63.1	-45.1	175.5	-76.4	165.1	-55.6	0	0	111.4	F36 S69 T75 W76	F36-Q72 HydrophobicContact CE1-CB 4.44Å; F36-Q72 HydrophobicContact CZ-CB 4.1Å; F36-Q72 HydrophobicContact CZ-CG 4.36Å; S69-Q72 WeakPolarHBondContact O-CB 3.37Å; S69-Q72 PolarHBondContact O-N 2.96Å; S69-Q72 VanDerWaalsContact OG-CD 3.31Å; S69-Q72 VanDerWaalsContact OG-CG 3.25Å; S69-Q72 WeakPolarHBondContact OG-CG 3.47Å; S69-Q72 PolarHBondContact OG-N 3.3Å; S69-Q72 PolarHBondContact OG-OE1 3.37Å; Q72-T75 PolarHBondContact O-N 3.05Å; Q72-W76 WeakPolarHBondContact O-CB 3.26Å; Q72-W76 PolarHBondContact O-N 3.29Å
73	V	95.3	Very high	94.7	Very high	1 Å²	1	64.4 Å²	64.4	1%	0.006	35%	0.35	C	S	.	.	H	α-helix	trans	-59.8	-48.4	175.4	178.3	0	0	0	0	110.2	L44 L54 R59 L62 A63 L68 S69 E70 T75 W76 F77	L44-V73 HydrophobicContact CD2-CG1 4.21Å; L44-V73 HydrophobicContact CD2-CG2 4.39Å; L54-V73 HydrophobicContact CD1-CG1 3.93Å; R59-V73 HydrophobicContact CG-CB 4.11Å; R59-V73 HydrophobicContact CG-CG1 4Å; L62-V73 HydrophobicContact CD2-CG1 3.9Å; L62-V73 HydrophobicContact CG-CG1 4.41Å; A63-V73 HydrophobicContact CB-CG2 4.05Å; L68-V73 HydrophobicContact CB-CG2 4.07Å; L68-V73 HydrophobicContact CD1-CG2 4.43Å; S69-V73 PolarHBondContact O-N 2.97Å; E70-V73 PolarHBondContact O-N 3.37Å; V73-T75 PolarHBondContact O-N 2.98Å; V73-W76 PolarHBondContact O-N 3.38Å; V73-F77 HydrophobicContact CG1-CD2 3.84Å; V73-F77 HydrophobicContact CG1-CE2 3.96Å; V73-F77 WeakPolarHBondContact O-CD2 3.46Å; V73-F77 PolarHBondContact O-N 3.25Å
74	K	95.2	Very high	94.2	Very high	103 Å²	103	67.6 Å²	67.6	45%	0.448	36%	0.364	S	S	.	.	H	α-helix	trans	-55.7	-50.2	177.2	-176.5	179.8	69.4	-179.9	0	112.1	E70 T71 F77 Q78	E70-K74 VanDerWaalsContact O-CB 3.3Å; E70-K74 WeakPolarHBondContact O-CB 3.34Å; E70-K74 PolarHBondContact O-N 2.99Å; T71-K74 PolarHBondContact O-N 3.37Å; K74-F77 PolarHBondContact O-N 3.02Å; K74-Q78 WeakPolarHBondContact O-CB 3.38Å; K74-Q78 PolarHBondContact O-N 2.91Å
75	T	95.5	Very high	93.5	Very high	59 Å²	59	70.4 Å²	70.4	36%	0.362	36%	0.362	S	S	.	.	H	α-helix	trans	-64.6	-40.2	179.2	-65.8	0	0	0	0	111.4	T71 Q72 V73 Q78 N79	T71-T75 WeakPolarHBondContact O-CB 3.31Å; T71-T75 PolarHBondContact O-N 2.88Å; T71-T75 PolarHBondContact O-OG1 2.92Å; Q72-T75 PolarHBondContact O-N 3.05Å; V73-T75 PolarHBondContact O-N 2.98Å; T75-Q78 PolarHBondContact O-N 2.99Å; T75-N79 WeakPolarHBondContact O-CB 3.39Å; T75-N79 VanDerWaalsContact O-CG 3.29Å; T75-N79 PolarHBondContact O-N 2.88Å; T75-N79 PolarHBondContact O-ND2 2.77Å
76	W	96	Very high	92.6	Very high	29 Å²	29	74.2 Å²	74.2	11%	0.11	37%	0.365	C	S	.	.	H	α-helix	trans	-61.6	-47.6	175.7	-172.9	99.1	0	0	0	111.2	F36 L44 E45 F48 Q72 V73 Q78 N79 R80	F36-W76 AromaticContact CD2-CD1 3.84Å; F36-W76 HydrophobicContact CE2-CB 4.44Å; F36-W76 AromaticContact CE2-CD1 3.74Å; F36-W76 HydrophobicContact CE2-CG 4.45Å; L44-W76 HydrophobicContact CB-CD2 3.97Å; L44-W76 HydrophobicContact CB-CE3 3.86Å; L44-W76 HydrophobicContact CB-CH2 3.55Å; L44-W76 HydrophobicContact CB-CZ2 3.64Å; L44-W76 HydrophobicContact CB-CZ3 3.66Å; L44-W76 HydrophobicContact CD1-CB 4.5Å; L44-W76 HydrophobicContact CD1-CD2 3.76Å; L44-W76 HydrophobicContact CD1-CE3 4.35Å; L44-W76 HydrophobicContact CD1-CG 3.8Å; L44-W76 HydrophobicContact CD1-CZ2 4.41Å; L44-W76 HydrophobicContact CD2-CD2 4.42Å; L44-W76 HydrophobicContact CD2-CE3 4.24Å; L44-W76 HydrophobicContact CG-CD2 4.26Å; L44-W76 HydrophobicContact CG-CE3 4.37Å; E45-W76 HydrophobicContact CG-CH2 3.85Å; E45-W76 HydrophobicContact CG-CZ2 3.89Å; F48-W76 HydrophobicContact CB-CH2 4.34Å; F48-W76 HydrophobicContact CB-CZ3 4.13Å; F48-W76 HydrophobicContact CD2-CZ3 4.38Å; F48-W76 HydrophobicContact CG-CZ3 4.43Å; Q72-W76 WeakPolarHBondContact O-CB 3.26Å; Q72-W76 PolarHBondContact O-N 3.29Å; V73-W76 PolarHBondContact O-N 3.38Å; W76-Q78 VanDerWaalsContact C-N 3.32Å; W76-Q78 PolarHBondContact O-N 3.46Å; W76-N79 PolarHBondContact O-N 2.88Å; W76-R80 HydrophobicContact CD2-CB 4.49Å; W76-R80 HydrophobicContact CE3-CB 4.06Å; W76-R80 HydrophobicContact CH2-CB 4.2Å; W76-R80 HydrophobicContact CH2-CG 3.81Å; W76-R80 HydrophobicContact CZ2-CG 4.42Å; W76-R80 HydrophobicContact CZ3-CB 3.9Å; W76-R80 HydrophobicContact CZ3-CG 3.87Å; W76-R80 VanDerWaalsContact O-CB 3.26Å; W76-R80 WeakPolarHBondContact O-CB 3.33Å; W76-R80 PolarHBondContact O-N 3.25Å
77	F	96.4	Very high	91.2	Very high	8 Å²	8	76.9 Å²	76.9	4%	0.035	38%	0.381	C	S	.	.	H	α-helix	trans	-61.5	-38.7	176.6	-91.9	-102.5	0	0	0	112.4	L44 R47 F48 L54 L62 V73 K74 R81	L44-F77 HydrophobicContact CD2-CE2 4.02Å; R47-F77 HydrophobicContact CB-CZ 4.44Å; F48-F77 HydrophobicContact CB-CE1 4.21Å; F48-F77 HydrophobicContact CB-CZ 4.31Å; F48-F77 AromaticContact CD2-CD1 3.84Å; F48-F77 HydrophobicContact CD2-CD1 3.84Å; F48-F77 AromaticContact CD2-CE1 3.77Å; F48-F77 HydrophobicContact CD2-CE1 3.77Å; F48-F77 HydrophobicContact CE2-CD1 4.46Å; F48-F77 HydrophobicContact CG-CE1 4.5Å; L54-F77 HydrophobicContact CD1-CD1 4.03Å; L54-F77 HydrophobicContact CD1-CD2 3.73Å; L54-F77 HydrophobicContact CD1-CE1 3.63Å; L54-F77 HydrophobicContact CD1-CE2 3.3Å; L54-F77 HydrophobicContact CD1-CG 4.09Å; L54-F77 HydrophobicContact CD1-CZ 3.26Å; L54-F77 HydrophobicContact CD2-CE1 4.39Å; L54-F77 HydrophobicContact CD2-CZ 4.34Å; L54-F77 HydrophobicContact CG-CD1 4.03Å; L54-F77 HydrophobicContact CG-CE1 3.59Å; L54-F77 HydrophobicContact CG-CE2 4.22Å; L54-F77 HydrophobicContact CG-CZ 3.71Å; L62-F77 HydrophobicContact CD2-CE2 3.69Å; L62-F77 HydrophobicContact CD2-CZ 4.03Å; V73-F77 HydrophobicContact CG1-CD2 3.84Å; V73-F77 HydrophobicContact CG1-CE2 3.96Å; V73-F77 WeakPolarHBondContact O-CD2 3.46Å; V73-F77 PolarHBondContact O-N 3.25Å; K74-F77 PolarHBondContact O-N 3.02Å; F77-R81 WeakPolarHBondContact O-CG 3.46Å; F77-R81 PolarHBondContact O-N 2.68Å; F77-R81 PolarHBondContact O-NE 3.18Å
78	Q	95.6	Very high	89.5	Confident	107 Å²	107	75.9 Å²	75.9	50%	0.5	37%	0.371	S	S	.	.	H	α-helix	trans	-63.1	-51.4	174.2	-172.4	173.7	62	0	0	111.2	K74 T75 W76 R80 R81 M82	K74-Q78 WeakPolarHBondContact O-CB 3.38Å; K74-Q78 PolarHBondContact O-N 2.91Å; T75-Q78 PolarHBondContact O-N 2.99Å; W76-Q78 VanDerWaalsContact C-N 3.32Å; W76-Q78 PolarHBondContact O-N 3.46Å; Q78-R80 VanDerWaalsContact C-N 3.3Å; Q78-R80 PolarHBondContact O-N 3.38Å; Q78-R81 PolarHBondContact O-N 2.84Å; Q78-M82 VanDerWaalsContact O-CG 3.31Å; Q78-M82 WeakPolarHBondContact O-CG 3.49Å; Q78-M82 PolarHBondContact O-N 3.39Å
79	N	94.4	Very high	87.7	Confident	95 Å²	95	83.1 Å²	83.1	51%	0.508	40%	0.401	S	S	.	.	H	α-helix	trans	-61	-39.3	177.9	-71.6	-20.1	0	0	0	112	T75 W76 M82 K83	T75-N79 WeakPolarHBondContact O-CB 3.39Å; T75-N79 VanDerWaalsContact O-CG 3.29Å; T75-N79 PolarHBondContact O-N 2.88Å; T75-N79 PolarHBondContact O-ND2 2.77Å; W76-N79 PolarHBondContact O-N 2.88Å; N79-M82 PolarHBondContact O-N 2.93Å; N79-K83 PolarHBondContact O-N 3.22Å
80	R	94.4	Very high	85.8	Confident	54 Å²	54	88.2 Å²	88.2	20%	0.204	42%	0.417	C	S	.	.	H	α-helix	trans	-64.1	-43.7	178.4	-172.3	67.3	-176.2	86.2	-2.4	111.8	F48 W76 Q78 K83 H84	F48-R80 HydrophobicContact CD1-CG 3.9Å; F48-R80 HydrophobicContact CD2-CB 4.33Å; F48-R80 HydrophobicContact CD2-CG 3.79Å; F48-R80 HydrophobicContact CE1-CG 3.8Å; F48-R80 HydrophobicContact CE2-CB 4.1Å; F48-R80 HydrophobicContact CE2-CG 3.69Å; F48-R80 HydrophobicContact CG-CG 3.89Å; F48-R80 HydrophobicContact CZ-CB 4.42Å; F48-R80 HydrophobicContact CZ-CG 3.7Å; W76-R80 HydrophobicContact CD2-CB 4.49Å; W76-R80 HydrophobicContact CE3-CB 4.06Å; W76-R80 HydrophobicContact CH2-CB 4.2Å; W76-R80 HydrophobicContact CH2-CG 3.81Å; W76-R80 HydrophobicContact CZ2-CG 4.42Å; W76-R80 HydrophobicContact CZ3-CB 3.9Å; W76-R80 HydrophobicContact CZ3-CG 3.87Å; W76-R80 VanDerWaalsContact O-CB 3.26Å; W76-R80 WeakPolarHBondContact O-CB 3.33Å; W76-R80 PolarHBondContact O-N 3.25Å; Q78-R80 VanDerWaalsContact C-N 3.3Å; Q78-R80 PolarHBondContact O-N 3.38Å; R80-K83 PolarHBondContact O-N 3.31Å; R80-H84 WeakPolarHBondContact O-CB 3.31Å; R80-H84 PolarHBondContact O-N 3.42Å
81	R	93	Very high	83.7	Confident	82 Å²	82	88.7 Å²	88.7	31%	0.309	42%	0.419	S	S	.	.	H	α-helix	trans	-62.5	-41.8	172.2	-73.3	-177.9	-67.7	165.3	-0.7	111.9	F48 R52 F77 Q78 K83 H84 K85	F48-R81 HydrophobicContact CE2-CG 3.82Å; F48-R81 HydrophobicContact CZ-CG 4.18Å; R52-R81 WeakPolarHBondContact O-CD 3.27Å; F77-R81 WeakPolarHBondContact O-CG 3.46Å; F77-R81 PolarHBondContact O-N 2.68Å; F77-R81 PolarHBondContact O-NE 3.18Å; Q78-R81 PolarHBondContact O-N 2.84Å; R81-K83 PolarHBondContact O-N 3.49Å; R81-H84 PolarHBondContact O-N 2.9Å; R81-K85 WeakPolarHBondContact O-CB 3.13Å; R81-K85 PolarHBondContact O-N 2.85Å
82	M	91.7	Very high	81.6	Confident	100 Å²	100	89.4 Å²	89.4	49%	0.493	43%	0.428	S	S	.	.	H	α-helix	trans	-62.5	-42.4	176.4	-67.3	-54.2	-69.9	0	0	112	Q78 N79 K86	Q78-M82 VanDerWaalsContact O-CG 3.31Å; Q78-M82 WeakPolarHBondContact O-CG 3.49Å; Q78-M82 PolarHBondContact O-N 3.39Å; N79-M82 PolarHBondContact O-N 2.93Å; M82-K86 VanDerWaalsContact O-CB 3.26Å; M82-K86 WeakPolarHBondContact O-CB 3.46Å; M82-K86 PolarHBondContact O-N 3.43Å
83	K	88.9	Confident	79.8	Confident	138 Å²	138	93.5 Å²	93.5	60%	0.6	45%	0.45	S	S	*	.	H	α-helix	trans	-60.5	-47.9	172.8	-173.7	-180	178.6	-174.7	0	110.7	N79 R80 R81 K85 K86 V87	N79-K83 PolarHBondContact O-N 3.22Å; R80-K83 PolarHBondContact O-N 3.31Å; R81-K83 PolarHBondContact O-N 3.49Å; K83-K85 PolarHBondContact O-N 3.33Å; K83-K86 PolarHBondContact O-N 3.12Å; K83-V87 WeakPolarHBondContact O-CG2 3.4Å; K83-V87 PolarHBondContact O-N 3.27Å
84	H	86.7	Confident	77.5	Confident	74 Å²	74	99.6 Å²	99.6	34%	0.343	48%	0.482	S	S	.	.	H	α-helix	trans	-58.8	-47.7	179.3	-169.1	57.6	0	0	0	112.1	R52 R80 R81 K86 V87 T88	R52-H84 PolarHBondContact NE-NE2 3.24Å; R52-H84 PolarHBondContact NH2-CE1 2.88Å; R52-H84 PolarHBondContact NH2-NE2 3.48Å; R52-H84 VanDerWaalsContact NH2-NE2 3.11Å; R80-H84 WeakPolarHBondContact O-CB 3.31Å; R80-H84 PolarHBondContact O-N 3.42Å; R81-H84 PolarHBondContact O-N 2.9Å; H84-K86 PolarHBondContact O-N 3.47Å; H84-V87 PolarHBondContact O-N 3.34Å; H84-T88 PolarHBondContact O-N 2.96Å; H84-T88 PolarHBondContact O-OG1 3.47Å
85	K	82.5	Confident	74.9	Confident	133 Å²	133	101 Å²	101	58%	0.578	50%	0.495	S	S	*	.	H	α-helix	trans	-62.9	-38.8	176.2	-175.8	174	67.6	178	0	112.8	R81 K83 V87 T88 K89	R81-K85 WeakPolarHBondContact O-CB 3.13Å; R81-K85 PolarHBondContact O-N 2.85Å; K83-K85 PolarHBondContact O-N 3.33Å; K85-V87 VanDerWaalsContact C-N 3.32Å; K85-V87 PolarHBondContact O-N 3.49Å; K85-T88 WeakPolarHBondContact O-CB 3.5Å; K85-T88 PolarHBondContact O-N 3.06Å; K85-K89 PolarHBondContact O-N 3.16Å
86	K	74.2	Confident	72	Confident	154 Å²	154	103.6 Å²	103.6	67%	0.67	51%	0.511	S	S	*	.	H	α-helix	trans	-69.7	-29.3	-179.5	-176.8	168.6	162.2	175.9	0	112.3	M82 K83 H84 K89 K90	M82-K86 VanDerWaalsContact O-CB 3.26Å; M82-K86 WeakPolarHBondContact O-CB 3.46Å; M82-K86 PolarHBondContact O-N 3.43Å; K83-K86 PolarHBondContact O-N 3.12Å; H84-K86 PolarHBondContact O-N 3.47Å; K86-K89 PolarHBondContact O-N 3.41Å; K86-K90 PolarHBondContact O-N 3.49Å; K86-K90 VanDerWaalsContact O-N 3.12Å
87	V	66.7	Low	69.3	Low	70 Å²	70	106.9 Å²	106.9	42%	0.424	54%	0.538	S	S	.	.	H	α-helix	trans	-61.8	-46.2	171.9	173.3	0	0	0	0	110	K83 H84 K85 K89 K90 Q91	K83-V87 WeakPolarHBondContact O-CG2 3.4Å; K83-V87 PolarHBondContact O-N 3.27Å; H84-V87 PolarHBondContact O-N 3.34Å; K85-V87 VanDerWaalsContact C-N 3.32Å; K85-V87 PolarHBondContact O-N 3.49Å; V87-K89 VanDerWaalsContact C-N 3.34Å; V87-K89 PolarHBondContact O-N 3.11Å; V87-K90 PolarHBondContact O-N 3.28Å; V87-K90 VanDerWaalsContact O-N 3.16Å; V87-Q91 HydrophobicContact CG1-CG 4.39Å; V87-Q91 WeakPolarHBondContact O-CG 3.41Å; V87-Q91 PolarHBondContact O-N 3.44Å
88	T	59.3	Low	66.6	Low	89 Å²	89	112.6 Å²	112.6	55%	0.546	57%	0.573	S	S	.	*	H	α-helix	trans	-59.3	-42	177.5	-41.8	0	0	0	0	112.7	H84 K85 K90 Q91 S92	H84-T88 PolarHBondContact O-N 2.96Å; H84-T88 PolarHBondContact O-OG1 3.47Å; K85-T88 WeakPolarHBondContact O-CB 3.5Å; K85-T88 PolarHBondContact O-N 3.06Å; T88-K90 VanDerWaalsContact C-N 3.35Å; T88-K90 PolarHBondContact O-N 3.47Å; T88-Q91 PolarHBondContact O-N 3.5Å; T88-S92 PolarHBondContact O-N 3.31Å
89	K	56.7	Low	64.1	Low	172 Å²	172	112.8 Å²	112.8	75%	0.748	58%	0.582	S	S	*	*	H	α-helix	trans	-74	-23.1	180	-169.2	148.5	-176.8	143.8	0	113.8	K85 K86 V87 S92	K85-K89 PolarHBondContact O-N 3.16Å; K86-K89 PolarHBondContact O-N 3.41Å; V87-K89 VanDerWaalsContact C-N 3.34Å; V87-K89 PolarHBondContact O-N 3.11Å; K89-S92 PolarHBondContact O-OG 3.32Å; K89-S92 VanDerWaalsContact O-OG 3.06Å
90	K	54.5	Low	61.5	Low	163 Å²	163	116.5 Å²	116.5	71%	0.709	59%	0.594	S	S	*	*	H	α-helix	trans	-83.9	-26.7	173.8	-164.9	155.6	168	147.2	0	111.4	K86 V87 T88 S92 I93	K86-K90 PolarHBondContact O-N 3.49Å; K86-K90 VanDerWaalsContact O-N 3.12Å; V87-K90 PolarHBondContact O-N 3.28Å; V87-K90 VanDerWaalsContact O-N 3.16Å; T88-K90 VanDerWaalsContact C-N 3.35Å; T88-K90 PolarHBondContact O-N 3.47Å; K90-S92 VanDerWaalsContact C-N 3.34Å; K90-I93 PolarHBondContact O-N 3.35Å
91	Q	51.9	Low	58.9	Low	92 Å²	92	120.5 Å²	120.5	43%	0.43	62%	0.619	S	S	.	*	H	α-helix	trans	-76.1	-14.4	173.3	-74.6	178.8	-42.4	0	0	114.1	V87 T88 I93 N94	V87-Q91 HydrophobicContact CG1-CG 4.39Å; V87-Q91 WeakPolarHBondContact O-CG 3.41Å; V87-Q91 PolarHBondContact O-N 3.44Å; T88-Q91 PolarHBondContact O-N 3.5Å; Q91-I93 PolarHBondContact O-N 3.25Å; Q91-N94 CarbonylContact O-C 3.27Å; Q91-N94 PolarHBondContact O-N 3.35Å
92	S	50.2	Low	56.4	Low	100 Å²	100	125.2 Å²	125.2	70%	0.699	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	0.1	165.3	71.5	0	0	0	0	113.5	T88 K89 K90	T88-S92 PolarHBondContact O-N 3.31Å; K89-S92 PolarHBondContact O-OG 3.32Å; K89-S92 VanDerWaalsContact O-OG 3.06Å; K90-S92 VanDerWaalsContact C-N 3.34Å
93	I	57	Low	53.9	Low	141 Å²	141	129.3 Å²	129.3	72%	0.723	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	-18.1	166.4	-65	173.4	0	0	0	112	K90 Q91	K90-I93 PolarHBondContact O-N 3.35Å; Q91-I93 PolarHBondContact O-N 3.25Å
94	N	46.9	Very low	51.7	Low	129 Å²	129	127.7 Å²	127.7	69%	0.69	65%	0.654	S	S	*	*	S	Bend	trans	-141.9	93.6	177.5	-100.9	7	0	0	0	109.6	Q91	Q91-N94 CarbonylContact O-C 3.27Å; Q91-N94 PolarHBondContact O-N 3.35Å
95	D	39.8	Very low	49.5	Very low	132 Å²	132	131.4 Å²	131.4	71%	0.706	67%	0.672	S	S	*	*			trans	61.3	144.6	155.9	-125.5	-66.3	0	0	0	120.3
96	T	35.3	Very low	47.7	Very low	114 Å²	114	128.3 Å²	128.3	70%	0.699	66%	0.661	S	S	*	*			trans	-71.9	170.8	-174.6	63.2	0	0	0	0	111.6
97	S	39.8	Very low	46.1	Very low	97 Å²	97	124.9 Å²	124.9	68%	0.678	65%	0.653	S	S	*	*			trans	88.4	120.5	-179.3	-39.8	0	0	0	0	113
98	T	40.3	Very low	44.8	Very low	128 Å²	128	127.5 Å²	127.5	79%	0.785	67%	0.673	S	S	*	*			cis	-154.6	125.3	30.5	-4.1	0	0	0	0	108.3	K100	T98-K100 PolarHBondContact O-N 2.89Å
99	V	42.1	Very low	43.7	Very low	112 Å²	112	131.8 Å²	131.8	68%	0.679	69%	0.687	S	S	*	*			trans	-52	119.5	162.8	176.5	0	0	0	0	108.5	D101	V99-D101 HydrophobicContact CG1-CB 4.46Å; V99-D101 WeakPolarHBondContact CG1-OD2 2.89Å
100	K	40.6	Very low	42.5	Very low	173 Å²	173	128.5 Å²	128.5	75%	0.752	69%	0.691	S	S	*	*			trans	-125.5	79.7	158.3	-80.2	-167.1	176.3	-178.4	0	106.8	T98 K102	T98-K100 PolarHBondContact O-N 2.89Å; K100-K102 PolarHBondContact O-N 2.96Å; K100-K102 VanDerWaalsContact O-N 3.12Å
101	D	38.1	Very low	41.8	Very low	138 Å²	138	127.4 Å²	127.4	74%	0.738	70%	0.699	S	S	*	*			trans	-57.3	108.6	159.5	-62.8	-47.5	0	0	0	107.5	V99	V99-D101 HydrophobicContact CG1-CB 4.46Å; V99-D101 WeakPolarHBondContact CG1-OD2 2.89Å
102	K	42.3	Very low	41.2	Very low	180 Å²	180	134.5 Å²	134.5	78%	0.783	74%	0.739	S	S	*	*			trans	-132.6	93.6	152.3	-71.9	-166.2	177.7	-175	0	104.4	K100 H104	K100-K102 PolarHBondContact O-N 2.96Å; K100-K102 VanDerWaalsContact O-N 3.12Å; K102-H104 VanDerWaalsContact C-N 3.29Å; K102-H104 PolarHBondContact O-N 3.06Å
103	E	37.5	Very low	40.8	Very low	187 Å²	187	136.3 Å²	136.3	87%	0.874	74%	0.741	S	S	*	*			trans	-48	100.3	161.1	-66.3	-169	101.9	0	0	107.3
104	H	43.6	Very low	39.9	Very low	103 Å²	103	136 Å²	136	48%	0.477	74%	0.741	S	S	.	*			trans	-107.2	78.6	160.5	-141.3	-177.9	0	0	0	105.6	Q51 K102 N106	Q51-H104 PolarHBondContact OE1-CE1 2.89Å; K102-H104 VanDerWaalsContact C-N 3.29Å; K102-H104 PolarHBondContact O-N 3.06Å; H104-N106 PolarHBondContact O-N 3.29Å
105	E	40.2	Very low	39.5	Very low	153 Å²	153	136.4 Å²	136.4	72%	0.715	74%	0.744	S	S	*	*			trans	-40.3	104.5	148.2	-118.7	-92.1	100.6	0	0	107
106	N	45	Very low	39.5	Very low	68 Å²	68	136.6 Å²	136.6	36%	0.364	75%	0.747	S	S	.	*			trans	-128.1	75.8	162.4	-163.4	-7.1	0	0	0	106.4	S55 H104	S55-N106 PolarHBondContact OG-ND2 2.96Å; S55-N106 PolarHBondContact OG-OD1 3.39Å; H104-N106 PolarHBondContact O-N 3.29Å
107	V	40.8	Very low	39.8	Very low	82 Å²	82	138.1 Å²	138.1	50%	0.497	75%	0.75	S	S	.	*			trans	6.5	115.9	145.4	-178.7	0	0	0	0	113.9	Q109	V107-Q109 PolarHBondContact O-N 3.12Å
108	C	38.4	Very low	39.8	Very low	125 Å²	125	140.8 Å²	140.8	85%	0.845	75%	0.754	S	S	*	*			trans	-40.6	127.7	170.2	-57.7	0	0	0	0	113.3
109	Q	36.4	Very low	39.7	Very low	179 Å²	179	141.7 Å²	141.7	84%	0.836	75%	0.752	S	S	*	*			trans	-139	137.1	159	-64.6	-168.4	18.2	0	0	111.1	V107	V107-Q109 PolarHBondContact O-N 3.12Å
110	A	31.7	Very low	39.5	Very low	102 Å²	102	144 Å²	144	84%	0.843	76%	0.758	S	S	*	*			trans	86.7	62.6	177.3	0	0	0	0	0	117
111	T	39.8	Very low	39.5	Very low	141 Å²	141	141.6 Å²	141.6	87%	0.865	76%	0.758	S	S	*	*			trans	-82.3	115.7	138.7	-58.2	0	0	0	0	106.8
112	L	39.9	Very low	39.6	Very low	241 Å²	241	141.9 Å²	141.9	100%	1.262	76%	0.76	S	S	*	*			trans	8.7	0	161.6	-66.1	161.9	0	0	0	119.3

Retrieved 112 of 112 residues in 158.7 ms (Link to these results)

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