A0A077ZMS8_TRITR Loading...

LIM:homeobox protein Lhx9

AlphaFold DB , UniProt , Accession A0A077ZMS8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 125 aa.

						>A0A077ZMS8_TRITR|A0A077ZMS8
MSQGSDMCNAIGIRPKRMRTSFKQQQLRTMRAYFQLNHNPDAKDLKHLAQKTGLTKRILQVWFQNARAKFRRNIMAHEEVDIHGPINKTSCSDSPSSSVSSTRMDLTADDISSSNFTGHPLSSFE
					

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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	47.4	Very low	52.9	Low	248 Å²	248	141.5 Å²	141.5	100%	1.222	83%	0.827	S	S	*	*				0	97	0	-69.9	160	118.7	0	0	107.3
2	S	49.6	Very low	53.6	Low	124 Å²	124	135.7 Å²	135.7	87%	0.867	82%	0.82	S	S	*	*			trans	-108	111.8	177.1	-65.3	0	0	0	0	108.1
3	Q	56.2	Low	54.7	Low	196 Å²	196	135.2 Å²	135.2	92%	0.916	81%	0.808	S	S	*	*			trans	-121.5	116.2	158.3	-68.7	-149.3	-5.8	0	0	107.1	S5	Q3-S5 PolarHBondContact O-N 3.46Å
4	G	48	Very low	56.1	Low	83 Å²	83	141 Å²	141	86%	0.856	81%	0.809	S	S	*	*			trans	-64.8	127.5	-173.4	0	0	0	0	0	111.5	D6	G4-D6 PolarHBondContact O-N 3.13Å
5	S	58.2	Low	57.4	Low	101 Å²	101	137.9 Å²	137.9	71%	0.706	80%	0.796	S	S	*	*			trans	-64.3	119.7	168.8	49	0	0	0	0	111	Q3 M7	Q3-S5 PolarHBondContact O-N 3.46Å; S5-M7 PolarHBondContact O-N 3.47Å; S5-M7 VanDerWaalsContact O-N 3.13Å
6	D	57.5	Low	58.8	Low	150 Å²	150	142.2 Å²	142.2	80%	0.802	80%	0.802	S	S	*	*			trans	17.6	78.9	151.6	-56.8	-63.4	0	0	0	117	G4 C8	G4-D6 PolarHBondContact O-N 3.13Å; D6-C8 PolarHBondContact O-N 2.93Å
7	M	52.9	Low	60.1	Low	185 Å²	185	146.9 Å²	146.9	91%	0.911	80%	0.804	S	S	*	*			trans	-76.6	50.1	169.3	-63.7	-167.9	81.4	0	0	112.6	S5 N9	S5-M7 PolarHBondContact O-N 3.47Å; S5-M7 VanDerWaalsContact O-N 3.13Å; M7-N9 PolarHBondContact O-N 3.21Å
8	C	55.3	Low	61.6	Low	93 Å²	93	148.7 Å²	148.7	63%	0.628	81%	0.809	S	S	*	*			trans	-87.4	55.9	161	62.4	0	0	0	0	110.4	D6	D6-C8 PolarHBondContact O-N 2.93Å
9	N	48.6	Very low	62.9	Low	151 Å²	151	153.5 Å²	153.5	81%	0.807	81%	0.814	S	S	*	*			trans	-134.5	54.8	171.6	-162.5	3.2	0	0	0	110.8	M7	M7-N9 PolarHBondContact O-N 3.21Å
10	A	50.6	Low	64.2	Low	74 Å²	74	149.3 Å²	149.3	61%	0.612	80%	0.795	S	S	*	*	S	Bend	trans	-117.2	111.7	166.3	0	0	0	0	0	107.7
11	I	58	Low	65.6	Low	151 Å²	151	147.7 Å²	147.7	77%	0.774	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	63.7	64.7	171.8	-41.5	177.6	0	0	0	114.5	I13	I11-I13 HydrophobicContact CB-CD1 4.46Å; I11-I13 WeakPolarHBondContact O-CD1 3.13Å; I11-I13 WeakPolarHBondContact O-CG1 3.43Å; I11-I13 PolarHBondContact O-N 3.01Å
12	G	60.5	Low	68	Low	72 Å²	72	138.7 Å²	138.7	74%	0.742	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	54.6	4.1	156.6	0	0	0	0	0	118.9	R14	G12-R14 VanDerWaalsContact C-N 3.34Å; G12-R14 PolarHBondContact O-N 2.98Å
13	I	67.9	Low	70.2	Confident	129 Å²	129	140.1 Å²	140.1	66%	0.662	74%	0.74	S	S	*	*			trans	-85	85.8	-174.5	-65.6	146.7	0	0	0	105.5	I11	I11-I13 HydrophobicContact CB-CD1 4.46Å; I11-I13 WeakPolarHBondContact O-CD1 3.13Å; I11-I13 WeakPolarHBondContact O-CG1 3.43Å; I11-I13 PolarHBondContact O-N 3.01Å
14	R	74.5	Confident	72.2	Confident	217 Å²	217	136.4 Å²	136.4	82%	0.819	72%	0.723	S	S	*	*			trans	-48.1	127	164.9	-72.7	-175.1	-68.3	-88.4	0.1	107.6	G12 K16	G12-R14 VanDerWaalsContact C-N 3.34Å; G12-R14 PolarHBondContact O-N 2.98Å; R14-K16 PolarHBondContact O-N 3Å
15	P	76.6	Confident	74.5	Confident	95 Å²	95	137.4 Å²	137.4	62%	0.617	71%	0.705	S	S	*	*			trans	-49.9	117	-178.6	-27.6	32.1	0	0	0	110.4	R17	P15-R17 PolarHBondContact O-N 2.6Å
16	K	78.6	Confident	76.4	Confident	206 Å²	206	134 Å²	134	90%	0.896	68%	0.678	S	S	*	*			trans	-68.5	106.6	179.5	-168.4	167.7	-176.6	175.3	0	107.3	R14 M18	R14-K16 PolarHBondContact O-N 3Å; K16-M18 PolarHBondContact O-N 3.48Å
17	R	82.2	Confident	78.4	Confident	222 Å²	222	128.1 Å²	128.1	84%	0.838	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-59.8	129.6	-178.5	-58	-176.4	-163	155.1	4.8	109.3	P15 R19	P15-R17 PolarHBondContact O-N 2.6Å; R17-R19 PolarHBondContact O-N 3.13Å
18	M	85.8	Confident	80.5	Confident	180 Å²	180	126.4 Å²	126.4	89%	0.887	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-61	133.5	176.9	-177.4	155.8	59.1	0	0	110.4	K16 T20	K16-M18 PolarHBondContact O-N 3.48Å; M18-T20 PolarHBondContact O-N 2.84Å
19	R	86.9	Confident	82.5	Confident	239 Å²	239	122.9 Å²	122.9	90%	0.902	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-76.9	121.1	178.7	-173.4	177.8	-179.1	-161.3	0.8	109.3	R17	R17-R19 PolarHBondContact O-N 3.13Å
20	T	89.6	Confident	84.9	Confident	70 Å²	70	115.7 Å²	115.7	43%	0.429	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-75.6	133.8	173.8	56	0	0	0	0	110.5	M18 I58	M18-T20 PolarHBondContact O-N 2.84Å; T20-I58 HydrophobicContact CG2-CD1 4.22Å
21	S	93.7	Very high	87.1	Confident	116 Å²	116	118.5 Å²	118.5	81%	0.811	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-94.8	139.2	167.3	-170.5	0	0	0	0	110.1
22	F	96.6	Very high	89	Confident	58 Å²	58	113.8 Å²	113.8	25%	0.254	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-98	133.9	-179.7	-57.7	-58.1	0	0	0	110.6	L27 M30 L54 I58 W62	F22-L27 HydrophobicContact CB-CD1 4.41Å; F22-L27 HydrophobicContact CB-CD2 3.8Å; F22-L27 HydrophobicContact CB-CG 3.85Å; F22-L27 HydrophobicContact CD2-CD2 4.03Å; F22-L27 HydrophobicContact CG-CD2 4.2Å; F22-M30 HydrophobicContact CD1-CE 4.4Å; F22-M30 HydrophobicContact CG-CE 4.35Å; F22-L54 HydrophobicContact CD1-CD1 3.87Å; F22-L54 HydrophobicContact CD1-CD2 4.21Å; F22-L54 HydrophobicContact CE1-CD1 3.87Å; F22-L54 HydrophobicContact CE1-CD2 4.22Å; F22-I58 HydrophobicContact CE1-CG2 3.53Å; F22-I58 HydrophobicContact CZ-CG2 3.81Å; F22-W62 AromaticContact CE2-CD1 3.67Å
23	K	96.6	Very high	90.7	Very high	154 Å²	154	112.2 Å²	112.2	67%	0.67	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-68	152	169.4	-62.6	-176.4	179.7	-178.4	0	109.9	Q25 Q26 L27	K23-Q25 PolarHBondContact O-N 3.48Å; K23-Q26 HydrophobicContact CB-CG 4.25Å; K23-Q26 WeakPolarHBondContact O-CB 3.41Å; K23-Q26 PolarHBondContact O-N 3.04Å; K23-L27 PolarHBondContact O-N 3.12Å; K23-L27 VanDerWaalsContact O-N 3.11Å
24	Q	97.6	Very high	92.1	Very high	118 Å²	118	107.3 Å²	107.3	55%	0.551	49%	0.491	S	S	*	.	H	α-helix	trans	-56.4	-39.4	178.3	-172.9	59.5	21	0	0	112.3	Q26 L27 R28	Q24-Q26 VanDerWaalsContact C-N 3.33Å; Q24-Q26 PolarHBondContact O-N 3.43Å; Q24-L27 PolarHBondContact O-N 2.9Å; Q24-R28 WeakPolarHBondContact O-CG 3.48Å; Q24-R28 PolarHBondContact O-N 3.37Å
25	Q	97.5	Very high	93.1	Very high	105 Å²	105	104.6 Å²	104.6	49%	0.491	49%	0.488	S	S	.	.	H	α-helix	trans	-60.7	-39.3	176.7	178.5	57.2	14.5	0	0	113.2	K23 T29	K23-Q25 PolarHBondContact O-N 3.48Å; Q25-T29 PolarHBondContact O-N 3.1Å; Q25-T29 VanDerWaalsContact O-N 3.11Å; Q25-T29 PolarHBondContact O-OG1 3.21Å
26	Q	97.8	Very high	94	Very high	29 Å²	29	107.2 Å²	107.2	14%	0.136	50%	0.496	C	S	.	.	H	α-helix	trans	-66.6	-45.4	176.9	-62.6	168.9	-36.4	0	0	110	K23 Q24 R28 T29 M30 T52 L54	K23-Q26 HydrophobicContact CB-CG 4.25Å; K23-Q26 WeakPolarHBondContact O-CB 3.41Å; K23-Q26 PolarHBondContact O-N 3.04Å; Q24-Q26 VanDerWaalsContact C-N 3.33Å; Q24-Q26 PolarHBondContact O-N 3.43Å; Q26-R28 PolarHBondContact O-N 3.43Å; Q26-T29 PolarHBondContact O-N 3.31Å; Q26-M30 HydrophobicContact CB-CE 4.32Å; Q26-M30 WeakPolarHBondContact O-CG 3.32Å; Q26-M30 PolarHBondContact O-N 3.22Å; Q26-T52 HydrophobicContact CB-CG2 4.38Å; Q26-T52 PolarHBondContact NE2-O 2.81Å; Q26-L54 HydrophobicContact CB-CD1 4.39Å
27	L	98	Very high	94.7	Very high	27 Å²	27	99.9 Å²	99.9	14%	0.141	47%	0.467	C	S	.	.	H	α-helix	trans	-60.5	-43.9	176.9	-67.6	175.9	0	0	0	112.2	F22 K23 Q24 T29 M30 R31	F22-L27 HydrophobicContact CB-CD1 4.41Å; F22-L27 HydrophobicContact CB-CD2 3.8Å; F22-L27 HydrophobicContact CB-CG 3.85Å; F22-L27 HydrophobicContact CD2-CD2 4.03Å; F22-L27 HydrophobicContact CG-CD2 4.2Å; K23-L27 PolarHBondContact O-N 3.12Å; K23-L27 VanDerWaalsContact O-N 3.11Å; Q24-L27 PolarHBondContact O-N 2.9Å; L27-T29 VanDerWaalsContact C-N 3.34Å; L27-T29 PolarHBondContact O-N 3.17Å; L27-M30 HydrophobicContact CD2-CE 3.95Å; L27-M30 PolarHBondContact O-N 2.83Å; L27-R31 VanDerWaalsContact O-CB 3.27Å; L27-R31 WeakPolarHBondContact O-CB 3.23Å; L27-R31 WeakPolarHBondContact O-CG 3.36Å; L27-R31 PolarHBondContact O-N 3.2Å
28	R	97.9	Very high	95.3	Very high	149 Å²	149	92.3 Å²	92.3	56%	0.562	44%	0.441	S	S	*	.	H	α-helix	trans	-57.8	-48.2	175.5	-72.5	-163.1	-61.7	-177.7	-1.4	111.3	Q24 Q26 R31 A32	Q24-R28 WeakPolarHBondContact O-CG 3.48Å; Q24-R28 PolarHBondContact O-N 3.37Å; Q26-R28 PolarHBondContact O-N 3.43Å; R28-R31 PolarHBondContact O-N 3.02Å; R28-A32 VanDerWaalsContact O-CB 3.27Å; R28-A32 WeakPolarHBondContact O-CB 3.41Å; R28-A32 PolarHBondContact O-N 3.28Å
29	T	97.5	Very high	95.8	Very high	19 Å²	19	88.2 Å²	88.2	12%	0.117	42%	0.422	C	S	.	.	H	α-helix	trans	-61.3	-47.7	-179.7	-54.5	0	0	0	0	111.7	Q25 Q26 L27 Y33 L48 K51 T52	Q25-T29 PolarHBondContact O-N 3.1Å; Q25-T29 VanDerWaalsContact O-N 3.11Å; Q25-T29 PolarHBondContact O-OG1 3.21Å; Q26-T29 PolarHBondContact O-N 3.31Å; L27-T29 VanDerWaalsContact C-N 3.34Å; L27-T29 PolarHBondContact O-N 3.17Å; T29-Y33 PolarHBondContact O-N 3.46Å; T29-Y33 VanDerWaalsContact O-N 3.16Å; T29-L48 HydrophobicContact CG2-CD2 3.95Å; T29-K51 HydrophobicContact CG2-CB 4.38Å; T29-T52 HydrophobicContact CG2-CG2 4.01Å
30	M	97.9	Very high	96.2	Very high	0 Å²	0	77.6 Å²	77.6	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-68.1	-39.8	-179.4	-66.6	-176	-67.9	0	0	112.4	F22 Q26 L27 F34 T52 L54 L59 W62	F22-M30 HydrophobicContact CD1-CE 4.4Å; F22-M30 HydrophobicContact CG-CE 4.35Å; Q26-M30 HydrophobicContact CB-CE 4.32Å; Q26-M30 WeakPolarHBondContact O-CG 3.32Å; Q26-M30 PolarHBondContact O-N 3.22Å; L27-M30 HydrophobicContact CD2-CE 3.95Å; L27-M30 PolarHBondContact O-N 2.83Å; M30-F34 WeakPolarHBondContact O-CB 3.49Å; M30-F34 PolarHBondContact O-N 3.5Å; M30-T52 HydrophobicContact CG-CG2 4.37Å; M30-L54 HydrophobicContact CE-CD1 4.13Å; M30-L54 HydrophobicContact SD-CD1 3.96Å; M30-L59 HydrophobicContact CG-CD2 4.03Å; M30-L59 HydrophobicContact SD-CD2 3.52Å; M30-L59 VanDerWaalsContact SD-CD2 3.52Å; M30-W62 HydrophobicContact CB-CD2 4.13Å; M30-W62 HydrophobicContact CB-CE3 3.92Å; M30-W62 HydrophobicContact CB-CH2 3.54Å; M30-W62 HydrophobicContact CB-CZ2 3.73Å; M30-W62 HydrophobicContact CB-CZ3 3.64Å; M30-W62 HydrophobicContact CE-CD2 4.08Å; M30-W62 HydrophobicContact CE-CG 4.07Å; M30-W62 HydrophobicContact CE-CZ2 4.42Å; M30-W62 HydrophobicContact CG-CD2 4.5Å; M30-W62 HydrophobicContact CG-CE3 4.44Å; M30-W62 HydrophobicContact SD-CB 4.29Å; M30-W62 HydrophobicContact SD-CD2 3.67Å; M30-W62 HydrophobicContact SD-CE3 4.06Å; M30-W62 HydrophobicContact SD-CG 3.75Å
31	R	97.6	Very high	96.5	Very high	133 Å²	133	79.6 Å²	79.6	50%	0.502	39%	0.392	S	S	.	.	H	α-helix	trans	-67.2	-42.4	177.1	-72.8	173.5	-179.2	170.4	1.5	112.3	L27 R28 Y33 F34 Q35 W62	L27-R31 VanDerWaalsContact O-CB 3.27Å; L27-R31 WeakPolarHBondContact O-CB 3.23Å; L27-R31 WeakPolarHBondContact O-CG 3.36Å; L27-R31 PolarHBondContact O-N 3.2Å; R28-R31 PolarHBondContact O-N 3.02Å; R31-Y33 VanDerWaalsContact C-N 3.32Å; R31-Y33 PolarHBondContact O-N 3.05Å; R31-F34 WeakPolarHBondContact O-CB 3.3Å; R31-F34 PolarHBondContact O-N 2.67Å; R31-Q35 WeakPolarHBondContact O-CG 3.34Å; R31-Q35 PolarHBondContact O-N 2.87Å; R31-Q35 VanDerWaalsContact O-N 3.12Å; R31-W62 HydrophobicContact CG-CH2 4.2Å; R31-W62 HydrophobicContact CG-CZ2 4.09Å
32	A	97.4	Very high	96.6	Very high	52 Å²	52	77.1 Å²	77.1	43%	0.43	38%	0.379	S	S	.	.	H	α-helix	trans	-60.4	-43.9	176.9	0	0	0	0	0	111.1	R28 Q35	R28-A32 VanDerWaalsContact O-CB 3.27Å; R28-A32 WeakPolarHBondContact O-CB 3.41Å; R28-A32 PolarHBondContact O-N 3.28Å; A32-Q35 PolarHBondContact O-N 3.28Å
33	Y	97.3	Very high	96.6	Very high	38 Å²	38	82.7 Å²	82.7	15%	0.149	40%	0.403	C	S	.	.	H	α-helix	trans	-65.8	-41	174.2	-175.5	-78.8	0	0	0	111.8	T29 R31 Q35 L36 N37 P40 D44 L48 F63	T29-Y33 PolarHBondContact O-N 3.46Å; T29-Y33 VanDerWaalsContact O-N 3.16Å; R31-Y33 VanDerWaalsContact C-N 3.32Å; R31-Y33 PolarHBondContact O-N 3.05Å; Y33-Q35 PolarHBondContact O-N 3.1Å; Y33-L36 WeakPolarHBondContact O-CB 3.41Å; Y33-L36 PolarHBondContact O-N 3.28Å; Y33-N37 HydrophobicContact CE1-CB 3.79Å; Y33-N37 WeakPolarHBondContact CE1-O 3.47Å; Y33-N37 PolarHBondContact O-N 2.91Å; Y33-N37 PolarHBondContact OH-ND2 2.9Å; Y33-N37 VanDerWaalsContact OH-ND2 3.16Å; Y33-P40 HydrophobicContact CD1-CB 4.42Å; Y33-P40 HydrophobicContact CE1-CB 3.57Å; Y33-P40 HydrophobicContact CE1-CG 4.34Å; Y33-D44 HydrophobicContact CE2-CB 3.88Å; Y33-D44 WeakPolarHBondContact OH-CB 3.17Å; Y33-D44 PolarHBondContact OH-OD2 2.98Å; Y33-L48 HydrophobicContact CD1-CD1 4.11Å; Y33-L48 HydrophobicContact CD2-CD1 4.31Å; Y33-L48 HydrophobicContact CD2-CD2 4.49Å; Y33-L48 HydrophobicContact CG-CD1 3.99Å; Y33-L48 HydrophobicContact CG-CD2 4.37Å; Y33-F63 AromaticContact CD1-CE1 3.83Å; Y33-F63 HydrophobicContact CD1-CE1 3.83Å; Y33-F63 AromaticContact CD1-CZ 3.7Å; Y33-F63 HydrophobicContact CD1-CZ 3.7Å; Y33-F63 HydrophobicContact CE1-CE1 4.35Å; Y33-F63 HydrophobicContact CE1-CZ 4.39Å; Y33-F63 HydrophobicContact CG-CZ 4.47Å
34	F	97.4	Very high	96.7	Very high	26 Å²	26	77.7 Å²	77.7	11%	0.114	38%	0.383	C	S	.	.	H	α-helix	trans	-56.5	-37.3	179.3	-168.6	-98.5	0	0	0	112.2	M30 R31 L36 N37 H38 W62 F63 A66 R67 F70	M30-F34 WeakPolarHBondContact O-CB 3.49Å; M30-F34 PolarHBondContact O-N 3.5Å; R31-F34 WeakPolarHBondContact O-CB 3.3Å; R31-F34 PolarHBondContact O-N 2.67Å; F34-L36 PolarHBondContact O-N 3.38Å; F34-N37 CarbonylContact O-C 3.5Å; F34-N37 PolarHBondContact O-N 3.42Å; F34-H38 AromaticContact CD1-CD2 3.47Å; F34-H38 VanDerWaalsContact CD1-CD2 3.47Å; F34-H38 WeakPolarHBondContact CD1-CD2 3.39Å; F34-H38 AromaticContact CD1-NE2 3.75Å; F34-H38 AromaticContact CD2-CD2 3.88Å; F34-H38 AromaticContact CE1-CD2 3.24Å; F34-H38 WeakPolarHBondContact CE1-CD2 3.36Å; F34-H38 AromaticContact CE1-NE2 3.43Å; F34-H38 WeakPolarHBondContact CE1-NE2 3.48Å; F34-H38 HydrophobicContact CE2-CB 4.05Å; F34-H38 AromaticContact CE2-CD2 3.68Å; F34-H38 AromaticContact CG-CD2 3.78Å; F34-H38 HydrophobicContact CZ-CB 4.26Å; F34-H38 AromaticContact CZ-CD2 3.36Å; F34-H38 WeakPolarHBondContact CZ-CD2 3.27Å; F34-H38 AromaticContact CZ-CG 3.9Å; F34-H38 AromaticContact CZ-NE2 3.93Å; F34-H38 PolarHBondContact O-CD2 2.8Å; F34-H38 PolarHBondContact O-NE2 3Å; F34-W62 HydrophobicContact CB-CH2 4.34Å; F34-W62 HydrophobicContact CB-CZ3 4.37Å; F34-W62 HydrophobicContact CD2-CZ3 4.3Å; F34-F63 HydrophobicContact CB-CE1 4.26Å; F34-F63 AromaticContact CD2-CD1 3.74Å; F34-F63 HydrophobicContact CD2-CD1 3.74Å; F34-F63 AromaticContact CD2-CE1 3.84Å; F34-F63 HydrophobicContact CD2-CE1 3.84Å; F34-F63 HydrophobicContact CE2-CD1 4.34Å; F34-A66 HydrophobicContact CD2-CB 3.94Å; F34-A66 HydrophobicContact CE2-CB 3.59Å; F34-A66 HydrophobicContact CZ-CB 3.98Å; F34-R67 HydrophobicContact CE2-CG 3.86Å; F34-R67 HydrophobicContact CZ-CG 4.15Å; F34-F70 HydrophobicContact CE1-CB 4.31Å; F34-F70 HydrophobicContact CE1-CD2 4.41Å; F34-F70 HydrophobicContact CE1-CG 4.43Å; F34-F70 HydrophobicContact CZ-CB 4.16Å
35	Q	95.8	Very high	96.6	Very high	160 Å²	160	72.6 Å²	72.6	75%	0.748	36%	0.36	S	S	*	.	H	α-helix	trans	-62.2	-27.1	175.7	-68.9	170.1	-6.2	0	0	113.6	R31 A32 Y33	R31-Q35 WeakPolarHBondContact O-CG 3.34Å; R31-Q35 PolarHBondContact O-N 2.87Å; R31-Q35 VanDerWaalsContact O-N 3.12Å; A32-Q35 PolarHBondContact O-N 3.28Å; Y33-Q35 PolarHBondContact O-N 3.1Å
36	L	94.6	Very high	96.6	Very high	151 Å²	151	74.5 Å²	74.5	79%	0.791	37%	0.367	S	S	*	.	H	α-helix	trans	-88.4	-44.9	178.5	-57.4	175.5	0	0	0	111.4	Y33 F34	Y33-L36 WeakPolarHBondContact O-CB 3.41Å; Y33-L36 PolarHBondContact O-N 3.28Å; F34-L36 PolarHBondContact O-N 3.38Å
37	N	93.6	Very high	96.6	Very high	52 Å²	52	77.7 Å²	77.7	28%	0.278	38%	0.381	S	S	.	.			trans	-147.7	119.5	-178.5	-178.2	9.6	0	0	0	111.2	Y33 F34 N39	Y33-N37 HydrophobicContact CE1-CB 3.79Å; Y33-N37 WeakPolarHBondContact CE1-O 3.47Å; Y33-N37 PolarHBondContact O-N 2.91Å; Y33-N37 PolarHBondContact OH-ND2 2.9Å; Y33-N37 VanDerWaalsContact OH-ND2 3.16Å; F34-N37 CarbonylContact O-C 3.5Å; F34-N37 PolarHBondContact O-N 3.42Å; N37-N39 VanDerWaalsContact C-N 3.31Å; N37-N39 PolarHBondContact ND2-O 3.3Å; N37-N39 WeakPolarHBondContact OD1-CA 3.49Å; N37-N39 PolarHBondContact OD1-N 3.36Å; N37-N39 PolarHBondContact OD1-O 2.86Å
38	H	94.7	Very high	96.6	Very high	63 Å²	63	76.6 Å²	76.6	29%	0.292	38%	0.376	S	S	.	.	S	Bend	trans	-74.7	-19.7	176.2	-61.6	153.8	0	0	0	113.4	F34 P40 R67 F70	F34-H38 AromaticContact CD1-CD2 3.47Å; F34-H38 VanDerWaalsContact CD1-CD2 3.47Å; F34-H38 WeakPolarHBondContact CD1-CD2 3.39Å; F34-H38 AromaticContact CD1-NE2 3.75Å; F34-H38 AromaticContact CD2-CD2 3.88Å; F34-H38 AromaticContact CE1-CD2 3.24Å; F34-H38 WeakPolarHBondContact CE1-CD2 3.36Å; F34-H38 AromaticContact CE1-NE2 3.43Å; F34-H38 WeakPolarHBondContact CE1-NE2 3.48Å; F34-H38 HydrophobicContact CE2-CB 4.05Å; F34-H38 AromaticContact CE2-CD2 3.68Å; F34-H38 AromaticContact CG-CD2 3.78Å; F34-H38 HydrophobicContact CZ-CB 4.26Å; F34-H38 AromaticContact CZ-CD2 3.36Å; F34-H38 WeakPolarHBondContact CZ-CD2 3.27Å; F34-H38 AromaticContact CZ-CG 3.9Å; F34-H38 AromaticContact CZ-NE2 3.93Å; F34-H38 PolarHBondContact O-CD2 2.8Å; F34-H38 PolarHBondContact O-NE2 3Å; H38-P40 WeakPolarHBondContact O-CD 3.34Å; H38-R67 HydrophobicContact CB-CG 4.32Å; H38-R67 WeakPolarHBondContact O-CD 3.38Å; H38-R67 PolarHBondContact O-NH1 3.37Å; H38-F70 AromaticContact CE1-CE1 3.71Å; H38-F70 AromaticContact CE1-CZ 3.69Å
39	N	96.2	Very high	96.6	Very high	94 Å²	94	70.6 Å²	70.6	50%	0.503	36%	0.358	S	S	.	.	S	Bend	trans	-121.3	76	-175.8	-69.2	-26	0	0	0	110.5	N37 D41 R67	N37-N39 VanDerWaalsContact C-N 3.31Å; N37-N39 PolarHBondContact ND2-O 3.3Å; N37-N39 WeakPolarHBondContact OD1-CA 3.49Å; N37-N39 PolarHBondContact OD1-N 3.36Å; N37-N39 PolarHBondContact OD1-O 2.86Å; N39-D41 PolarHBondContact O-N 2.93Å; N39-R67 WeakPolarHBondContact OD1-CD 3.47Å; N39-R67 VanDerWaalsContact OD1-CZ 3.29Å; N39-R67 PolarHBondContact OD1-NE 3.44Å; N39-R67 PolarHBondContact OD1-NH1 3.29Å
40	P	94.7	Very high	96.6	Very high	16 Å²	16	76.5 Å²	76.5	10%	0.104	39%	0.385	C	S	.	.			trans	-64.2	133	177.5	25.6	-34.5	0	0	0	111.6	Y33 H38 D44 L45 F63	Y33-P40 HydrophobicContact CD1-CB 4.42Å; Y33-P40 HydrophobicContact CE1-CB 3.57Å; Y33-P40 HydrophobicContact CE1-CG 4.34Å; H38-P40 WeakPolarHBondContact O-CD 3.34Å; P40-D44 HydrophobicContact CB-CB 4.13Å; P40-L45 HydrophobicContact CB-CD2 4.17Å; P40-L45 HydrophobicContact CB-CG 4.11Å; P40-L45 HydrophobicContact CG-CD2 3.88Å; P40-L45 HydrophobicContact CG-CG 4.22Å; P40-F63 HydrophobicContact CG-CB 4.32Å; P40-F63 HydrophobicContact CG-CD1 3.62Å; P40-F63 HydrophobicContact CG-CD2 3.75Å; P40-F63 HydrophobicContact CG-CE1 3.77Å; P40-F63 HydrophobicContact CG-CE2 3.92Å; P40-F63 HydrophobicContact CG-CG 3.62Å; P40-F63 HydrophobicContact CG-CZ 3.93Å
41	D	96.8	Very high	96.5	Very high	112 Å²	112	82.8 Å²	82.8	60%	0.599	41%	0.412	S	S	*	.			trans	-77.6	174.9	174.5	-72.7	-32.3	0	0	0	112.3	N39 K43 D44 L45	N39-D41 PolarHBondContact O-N 2.93Å; D41-K43 PolarHBondContact O-N 3.03Å; D41-D44 PolarHBondContact O-N 2.57Å; D41-L45 WeakPolarHBondContact O-CB 3.39Å; D41-L45 WeakPolarHBondContact O-CG 3.32Å; D41-L45 PolarHBondContact O-N 3.16Å
42	A	96.2	Very high	96.5	Very high	64 Å²	64	77 Å²	77	53%	0.529	39%	0.391	S	S	.	.	H	α-helix	trans	-57	-36.4	-179.6	0	0	0	0	0	113.2	K46	A42-K46 PolarHBondContact O-N 2.86Å; A42-K46 VanDerWaalsContact O-N 3.12Å
43	K	96.8	Very high	96.5	Very high	174 Å²	174	77.8 Å²	77.8	76%	0.757	40%	0.404	S	S	*	.	H	α-helix	trans	-67.5	-45	177.9	-173.7	-178.7	177	-175.3	0	111.4	D41 K46 H47	D41-K43 PolarHBondContact O-N 3.03Å; K43-K46 WeakPolarHBondContact O-CB 3.49Å; K43-K46 PolarHBondContact O-N 3.33Å; K43-H47 PolarHBondContact O-N 3.36Å
44	D	97	Very high	96.4	Very high	49 Å²	49	77 Å²	77	26%	0.262	40%	0.403	S	S	.	.	H	α-helix	trans	-70.5	-39	-179.3	-65.4	-27	0	0	0	111.8	Y33 P40 D41 K46 H47 L48	Y33-D44 HydrophobicContact CE2-CB 3.88Å; Y33-D44 WeakPolarHBondContact OH-CB 3.17Å; Y33-D44 PolarHBondContact OH-OD2 2.98Å; P40-D44 HydrophobicContact CB-CB 4.13Å; D41-D44 PolarHBondContact O-N 2.57Å; D44-K46 VanDerWaalsContact C-N 3.27Å; D44-K46 PolarHBondContact O-N 2.95Å; D44-H47 PolarHBondContact O-N 3.45Å; D44-L48 WeakPolarHBondContact O-CB 3.38Å; D44-L48 WeakPolarHBondContact O-CG 3.29Å; D44-L48 PolarHBondContact O-N 2.88Å
45	L	97.3	Very high	96.4	Very high	11 Å²	11	80 Å²	80	6%	0.058	42%	0.424	C	S	.	.	H	α-helix	trans	-59.1	-38.8	171.2	-74	173.2	0	0	0	111.9	P40 D41 A49 K56 L59 Q60 F63	P40-L45 HydrophobicContact CB-CD2 4.17Å; P40-L45 HydrophobicContact CB-CG 4.11Å; P40-L45 HydrophobicContact CG-CD2 3.88Å; P40-L45 HydrophobicContact CG-CG 4.22Å; D41-L45 WeakPolarHBondContact O-CB 3.39Å; D41-L45 WeakPolarHBondContact O-CG 3.32Å; D41-L45 PolarHBondContact O-N 3.16Å; L45-A49 VanDerWaalsContact O-CB 3.3Å; L45-A49 WeakPolarHBondContact O-CB 3.13Å; L45-A49 PolarHBondContact O-N 3.13Å; L45-K56 HydrophobicContact CB-CG 4.43Å; L45-K56 HydrophobicContact CD1-CG 4.42Å; L45-L59 HydrophobicContact CD2-CB 3.8Å; L45-L59 WeakPolarHBondContact O-CD1 3.27Å; L45-Q60 HydrophobicContact CD1-CG 3.85Å; L45-F63 HydrophobicContact CD2-CD2 4.33Å
46	K	97.4	Very high	96.4	Very high	146 Å²	146	77.5 Å²	77.5	64%	0.635	41%	0.41	S	S	*	.	H	α-helix	trans	-64.8	-45.6	175.6	-175.3	179	179.1	179.6	0	111	A42 K43 D44 A49 Q50	A42-K46 PolarHBondContact O-N 2.86Å; A42-K46 VanDerWaalsContact O-N 3.12Å; K43-K46 WeakPolarHBondContact O-CB 3.49Å; K43-K46 PolarHBondContact O-N 3.33Å; D44-K46 VanDerWaalsContact C-N 3.27Å; D44-K46 PolarHBondContact O-N 2.95Å; K46-A49 WeakPolarHBondContact O-CB 3.29Å; K46-A49 PolarHBondContact O-N 3.26Å; K46-Q50 WeakPolarHBondContact O-CG 3.27Å; K46-Q50 PolarHBondContact O-N 3.47Å; K46-Q50 VanDerWaalsContact O-N 3.1Å
47	H	97.2	Very high	96.5	Very high	95 Å²	95	77.2 Å²	77.2	44%	0.44	40%	0.398	S	S	.	.	H	α-helix	trans	-63	-43.6	177.3	-176	69.8	0	0	0	112.3	K43 D44 A49 Q50 K51	K43-H47 PolarHBondContact O-N 3.36Å; D44-H47 PolarHBondContact O-N 3.45Å; H47-A49 VanDerWaalsContact C-N 3.33Å; H47-A49 PolarHBondContact O-N 3.25Å; H47-Q50 PolarHBondContact O-N 3.11Å; H47-K51 WeakPolarHBondContact NE2-CD 3.49Å; H47-K51 PolarHBondContact O-N 3.39Å
48	L	97.7	Very high	96.6	Very high	4 Å²	4	77 Å²	77	2%	0.021	40%	0.397	C	S	.	.	H	α-helix	trans	-63.7	-37.9	175.2	-73	170.7	0	0	0	112.1	T29 Y33 D44 Q50 K51 T52 L59 F63	T29-L48 HydrophobicContact CG2-CD2 3.95Å; Y33-L48 HydrophobicContact CD1-CD1 4.11Å; Y33-L48 HydrophobicContact CD2-CD1 4.31Å; Y33-L48 HydrophobicContact CD2-CD2 4.49Å; Y33-L48 HydrophobicContact CG-CD1 3.99Å; Y33-L48 HydrophobicContact CG-CD2 4.37Å; D44-L48 WeakPolarHBondContact O-CB 3.38Å; D44-L48 WeakPolarHBondContact O-CG 3.29Å; D44-L48 PolarHBondContact O-N 2.88Å; L48-Q50 VanDerWaalsContact C-N 3.34Å; L48-Q50 PolarHBondContact O-N 3.44Å; L48-K51 PolarHBondContact O-N 3.02Å; L48-T52 WeakPolarHBondContact O-CB 3.37Å; L48-T52 WeakPolarHBondContact O-CG2 3.43Å; L48-T52 PolarHBondContact O-N 3.11Å; L48-T52 PolarHBondContact O-OG1 3.21Å; L48-L59 HydrophobicContact CB-CD1 3.82Å; L48-F63 HydrophobicContact CD1-CE2 3.71Å; L48-F63 HydrophobicContact CD1-CZ 3.75Å
49	A	97.7	Very high	96.8	Very high	24 Å²	24	74 Å²	74	20%	0.198	38%	0.383	C	S	.	.	H	α-helix	trans	-61.2	-43.8	175.5	0	0	0	0	0	111.2	L45 K46 H47 K51 G53 L54 L59	L45-A49 VanDerWaalsContact O-CB 3.3Å; L45-A49 WeakPolarHBondContact O-CB 3.13Å; L45-A49 PolarHBondContact O-N 3.13Å; K46-A49 WeakPolarHBondContact O-CB 3.29Å; K46-A49 PolarHBondContact O-N 3.26Å; H47-A49 VanDerWaalsContact C-N 3.33Å; H47-A49 PolarHBondContact O-N 3.25Å; A49-K51 PolarHBondContact O-N 2.99Å; A49-G53 VanDerWaalsContact O-CA 3.32Å; A49-G53 WeakPolarHBondContact O-CA 3.33Å; A49-G53 PolarHBondContact O-N 3.24Å; A49-L54 WeakPolarHBondContact CA-O 3.47Å; A49-L54 VanDerWaalsContact CB-O 3.23Å; A49-L54 WeakPolarHBondContact CB-O 3.42Å; A49-L59 HydrophobicContact CB-CD1 3.86Å
50	Q	97.3	Very high	96.8	Very high	143 Å²	143	72.6 Å²	72.6	67%	0.668	37%	0.373	S	S	*	.	H	α-helix	trans	-62.3	-42.3	175.4	-68.2	178.3	-63	0	0	112.1	K46 H47 L48	K46-Q50 WeakPolarHBondContact O-CG 3.27Å; K46-Q50 PolarHBondContact O-N 3.47Å; K46-Q50 VanDerWaalsContact O-N 3.1Å; H47-Q50 PolarHBondContact O-N 3.11Å; L48-Q50 VanDerWaalsContact C-N 3.34Å; L48-Q50 PolarHBondContact O-N 3.44Å
51	K	96.7	Very high	96.9	Very high	131 Å²	131	74.2 Å²	74.2	57%	0.57	38%	0.383	S	S	*	.	H	α-helix	trans	-74.2	-31.4	-178.5	-72.1	179.7	65	168.2	0	114.2	T29 H47 L48 A49	T29-K51 HydrophobicContact CG2-CB 4.38Å; H47-K51 WeakPolarHBondContact NE2-CD 3.49Å; H47-K51 PolarHBondContact O-N 3.39Å; L48-K51 PolarHBondContact O-N 3.02Å; A49-K51 PolarHBondContact O-N 2.99Å
52	T	96.9	Very high	97	Very high	11 Å²	11	70.6 Å²	70.6	7%	0.067	36%	0.361	C	S	.	.	H	α-helix	trans	-102	-17.4	-174.5	61.2	0	0	0	0	113.3	Q26 T29 M30 L48 L54	Q26-T52 HydrophobicContact CB-CG2 4.38Å; Q26-T52 PolarHBondContact NE2-O 2.81Å; T29-T52 HydrophobicContact CG2-CG2 4.01Å; M30-T52 HydrophobicContact CG-CG2 4.37Å; L48-T52 WeakPolarHBondContact O-CB 3.37Å; L48-T52 WeakPolarHBondContact O-CG2 3.43Å; L48-T52 PolarHBondContact O-N 3.11Å; L48-T52 PolarHBondContact O-OG1 3.21Å; T52-L54 PolarHBondContact O-N 2.82Å; T52-L54 WeakPolarHBondContact OG1-CB 3.38Å; T52-L54 PolarHBondContact OG1-N 3.47Å
53	G	96.8	Very high	97.1	Very high	69 Å²	69	67.6 Å²	67.6	71%	0.711	34%	0.336	S	S	*	.			trans	68.8	13.5	-170.7	0	0	0	0	0	113.6	A49	A49-G53 VanDerWaalsContact O-CA 3.32Å; A49-G53 WeakPolarHBondContact O-CA 3.33Å; A49-G53 PolarHBondContact O-N 3.24Å
54	L	96.8	Very high	97.1	Very high	23 Å²	23	63.6 Å²	63.6	12%	0.12	32%	0.32	C	S	.	.			trans	-92.7	146.3	179.3	-60.9	176.3	0	0	0	110.5	F22 Q26 M30 A49 T52 I58 L59	F22-L54 HydrophobicContact CD1-CD1 3.87Å; F22-L54 HydrophobicContact CD1-CD2 4.21Å; F22-L54 HydrophobicContact CE1-CD1 3.87Å; F22-L54 HydrophobicContact CE1-CD2 4.22Å; Q26-L54 HydrophobicContact CB-CD1 4.39Å; M30-L54 HydrophobicContact CE-CD1 4.13Å; M30-L54 HydrophobicContact SD-CD1 3.96Å; A49-L54 WeakPolarHBondContact CA-O 3.47Å; A49-L54 VanDerWaalsContact CB-O 3.23Å; A49-L54 WeakPolarHBondContact CB-O 3.42Å; T52-L54 PolarHBondContact O-N 2.82Å; T52-L54 WeakPolarHBondContact OG1-CB 3.38Å; T52-L54 PolarHBondContact OG1-N 3.47Å; L54-I58 HydrophobicContact CB-CG2 4.44Å; L54-I58 HydrophobicContact CD1-CG2 4.38Å; L54-I58 HydrophobicContact CD2-CG2 4.41Å; L54-L59 HydrophobicContact CB-CD2 4.14Å; L54-L59 HydrophobicContact CB-CG 4.08Å; L54-L59 HydrophobicContact CD1-CD2 3.99Å
55	T	96.1	Very high	97.1	Very high	89 Å²	89	66.2 Å²	66.2	55%	0.546	33%	0.334	S	S	.	.			trans	-68.9	152.7	175.6	69.5	0	0	0	0	111	R57 I58 L59	T55-R57 PolarHBondContact O-N 2.84Å; T55-R57 VanDerWaalsContact O-N 3.13Å; T55-I58 PolarHBondContact O-N 2.92Å; T55-I58 WeakPolarHBondContact OG1-CG1 3.34Å; T55-I58 PolarHBondContact OG1-N 2.91Å; T55-L59 PolarHBondContact O-N 3.43Å; T55-L59 VanDerWaalsContact O-N 3.1Å
56	K	96.2	Very high	97.1	Very high	107 Å²	107	66.6 Å²	66.6	47%	0.465	34%	0.339	S	S	.	.	H	α-helix	trans	-50.8	-40	176.5	-176	177.1	-179.9	-178.5	0	112	L45 L59 Q60	L45-K56 HydrophobicContact CB-CG 4.43Å; L45-K56 HydrophobicContact CD1-CG 4.42Å; K56-L59 PolarHBondContact O-N 2.93Å; K56-Q60 HydrophobicContact CG-CG 4.48Å; K56-Q60 WeakPolarHBondContact O-CB 3.41Å; K56-Q60 VanDerWaalsContact O-CG 3.27Å; K56-Q60 WeakPolarHBondContact O-CG 3.47Å; K56-Q60 PolarHBondContact O-N 3.16Å
57	R	96.6	Very high	97.1	Very high	144 Å²	144	62.9 Å²	62.9	54%	0.543	32%	0.321	S	S	.	.	H	α-helix	trans	-64.1	-43.4	179.6	-178.7	58.1	179.7	176.1	0.4	112.4	T55 Q60 V61	T55-R57 PolarHBondContact O-N 2.84Å; T55-R57 VanDerWaalsContact O-N 3.13Å; R57-Q60 PolarHBondContact O-N 3.48Å; R57-V61 WeakPolarHBondContact O-CG2 3.44Å; R57-V61 PolarHBondContact O-N 2.95Å
58	I	96.3	Very high	97.1	Very high	47 Å²	47	59.7 Å²	59.7	24%	0.241	31%	0.311	C	S	.	.	H	α-helix	trans	-65.4	-43.1	178.9	-65.7	-64.9	0	0	0	110.5	T20 F22 L54 T55 V61 W62	T20-I58 HydrophobicContact CG2-CD1 4.22Å; F22-I58 HydrophobicContact CE1-CG2 3.53Å; F22-I58 HydrophobicContact CZ-CG2 3.81Å; L54-I58 HydrophobicContact CB-CG2 4.44Å; L54-I58 HydrophobicContact CD1-CG2 4.38Å; L54-I58 HydrophobicContact CD2-CG2 4.41Å; T55-I58 PolarHBondContact O-N 2.92Å; T55-I58 WeakPolarHBondContact OG1-CG1 3.34Å; T55-I58 PolarHBondContact OG1-N 2.91Å; I58-V61 PolarHBondContact O-N 3.39Å; I58-W62 WeakPolarHBondContact O-CB 3.38Å; I58-W62 PolarHBondContact O-N 3.18Å
59	L	97.5	Very high	96.9	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-60.3	-47.7	174.4	-68.1	173.6	0	0	0	111.3	M30 L45 L48 A49 L54 T55 K56 V61 W62 F63	M30-L59 HydrophobicContact CG-CD2 4.03Å; M30-L59 HydrophobicContact SD-CD2 3.52Å; M30-L59 VanDerWaalsContact SD-CD2 3.52Å; L45-L59 HydrophobicContact CD2-CB 3.8Å; L45-L59 WeakPolarHBondContact O-CD1 3.27Å; L48-L59 HydrophobicContact CB-CD1 3.82Å; A49-L59 HydrophobicContact CB-CD1 3.86Å; L54-L59 HydrophobicContact CB-CD2 4.14Å; L54-L59 HydrophobicContact CB-CG 4.08Å; L54-L59 HydrophobicContact CD1-CD2 3.99Å; T55-L59 PolarHBondContact O-N 3.43Å; T55-L59 VanDerWaalsContact O-N 3.1Å; K56-L59 PolarHBondContact O-N 2.93Å; L59-V61 VanDerWaalsContact C-N 3.32Å; L59-V61 PolarHBondContact O-N 2.93Å; L59-W62 WeakPolarHBondContact O-CB 3.19Å; L59-W62 PolarHBondContact O-N 3.23Å; L59-W62 VanDerWaalsContact O-N 3.13Å; L59-F63 VanDerWaalsContact O-CD2 3.29Å; L59-F63 WeakPolarHBondContact O-CD2 3.43Å; L59-F63 PolarHBondContact O-N 3.44Å
60	Q	97.6	Very high	96.8	Very high	65 Å²	65	68.4 Å²	68.4	30%	0.304	34%	0.344	S	S	.	.	H	α-helix	trans	-55.3	-46	175.9	-76.5	174.7	-29.3	0	0	112.4	L45 K56 R57 Q64	L45-Q60 HydrophobicContact CD1-CG 3.85Å; K56-Q60 HydrophobicContact CG-CG 4.48Å; K56-Q60 WeakPolarHBondContact O-CB 3.41Å; K56-Q60 VanDerWaalsContact O-CG 3.27Å; K56-Q60 WeakPolarHBondContact O-CG 3.47Å; K56-Q60 PolarHBondContact O-N 3.16Å; R57-Q60 PolarHBondContact O-N 3.48Å; Q60-Q64 WeakPolarHBondContact O-CB 3.44Å; Q60-Q64 VanDerWaalsContact O-CG 3.29Å; Q60-Q64 WeakPolarHBondContact O-CG 3.36Å; Q60-Q64 PolarHBondContact O-N 3.48Å; Q60-Q64 PolarHBondContact O-NE2 2.91Å
61	V	97	Very high	96.6	Very high	51 Å²	51	68.2 Å²	68.2	31%	0.309	34%	0.337	S	S	.	.	H	α-helix	trans	-66	-40.9	178.4	172.6	0	0	0	0	110.7	R57 I58 L59 Q64 N65	R57-V61 WeakPolarHBondContact O-CG2 3.44Å; R57-V61 PolarHBondContact O-N 2.95Å; I58-V61 PolarHBondContact O-N 3.39Å; L59-V61 VanDerWaalsContact C-N 3.32Å; L59-V61 PolarHBondContact O-N 2.93Å; V61-Q64 PolarHBondContact O-N 2.89Å; V61-N65 PolarHBondContact O-N 2.92Å; V61-N65 PolarHBondContact O-ND2 3.38Å
62	W	97.8	Very high	96.4	Very high	36 Å²	36	69.7 Å²	69.7	14%	0.136	34%	0.339	C	S	.	.	H	α-helix	trans	-60.5	-48.3	176.9	-174.1	94.9	0	0	0	111.6	F22 M30 R31 F34 I58 L59 Q64 N65 A66	F22-W62 AromaticContact CE2-CD1 3.67Å; M30-W62 HydrophobicContact CB-CD2 4.13Å; M30-W62 HydrophobicContact CB-CE3 3.92Å; M30-W62 HydrophobicContact CB-CH2 3.54Å; M30-W62 HydrophobicContact CB-CZ2 3.73Å; M30-W62 HydrophobicContact CB-CZ3 3.64Å; M30-W62 HydrophobicContact CE-CD2 4.08Å; M30-W62 HydrophobicContact CE-CG 4.07Å; M30-W62 HydrophobicContact CE-CZ2 4.42Å; M30-W62 HydrophobicContact CG-CD2 4.5Å; M30-W62 HydrophobicContact CG-CE3 4.44Å; M30-W62 HydrophobicContact SD-CB 4.29Å; M30-W62 HydrophobicContact SD-CD2 3.67Å; M30-W62 HydrophobicContact SD-CE3 4.06Å; M30-W62 HydrophobicContact SD-CG 3.75Å; R31-W62 HydrophobicContact CG-CH2 4.2Å; R31-W62 HydrophobicContact CG-CZ2 4.09Å; F34-W62 HydrophobicContact CB-CH2 4.34Å; F34-W62 HydrophobicContact CB-CZ3 4.37Å; F34-W62 HydrophobicContact CD2-CZ3 4.3Å; I58-W62 WeakPolarHBondContact O-CB 3.38Å; I58-W62 PolarHBondContact O-N 3.18Å; L59-W62 WeakPolarHBondContact O-CB 3.19Å; L59-W62 PolarHBondContact O-N 3.23Å; L59-W62 VanDerWaalsContact O-N 3.13Å; W62-Q64 VanDerWaalsContact C-N 3.35Å; W62-Q64 PolarHBondContact O-N 3.3Å; W62-N65 PolarHBondContact O-N 2.85Å; W62-A66 HydrophobicContact CE3-CB 4.16Å; W62-A66 HydrophobicContact CH2-CB 4.14Å; W62-A66 HydrophobicContact CZ3-CB 3.91Å; W62-A66 WeakPolarHBondContact O-CB 3.47Å; W62-A66 PolarHBondContact O-N 2.89Å
63	F	98.2	Very high	96	Very high	1 Å²	1	73.7 Å²	73.7	0%	0.004	36%	0.36	C	S	.	.	H	α-helix	trans	-65.1	-37.1	178.6	-85.5	-84.8	0	0	0	112.3	Y33 F34 P40 L45 L48 L59 A66 R67	Y33-F63 AromaticContact CD1-CE1 3.83Å; Y33-F63 HydrophobicContact CD1-CE1 3.83Å; Y33-F63 AromaticContact CD1-CZ 3.7Å; Y33-F63 HydrophobicContact CD1-CZ 3.7Å; Y33-F63 HydrophobicContact CE1-CE1 4.35Å; Y33-F63 HydrophobicContact CE1-CZ 4.39Å; Y33-F63 HydrophobicContact CG-CZ 4.47Å; F34-F63 HydrophobicContact CB-CE1 4.26Å; F34-F63 AromaticContact CD2-CD1 3.74Å; F34-F63 HydrophobicContact CD2-CD1 3.74Å; F34-F63 AromaticContact CD2-CE1 3.84Å; F34-F63 HydrophobicContact CD2-CE1 3.84Å; F34-F63 HydrophobicContact CE2-CD1 4.34Å; P40-F63 HydrophobicContact CG-CB 4.32Å; P40-F63 HydrophobicContact CG-CD1 3.62Å; P40-F63 HydrophobicContact CG-CD2 3.75Å; P40-F63 HydrophobicContact CG-CE1 3.77Å; P40-F63 HydrophobicContact CG-CE2 3.92Å; P40-F63 HydrophobicContact CG-CG 3.62Å; P40-F63 HydrophobicContact CG-CZ 3.93Å; L45-F63 HydrophobicContact CD2-CD2 4.33Å; L48-F63 HydrophobicContact CD1-CE2 3.71Å; L48-F63 HydrophobicContact CD1-CZ 3.75Å; L59-F63 VanDerWaalsContact O-CD2 3.29Å; L59-F63 WeakPolarHBondContact O-CD2 3.43Å; L59-F63 PolarHBondContact O-N 3.44Å; F63-A66 PolarHBondContact O-N 3.43Å; F63-R67 WeakPolarHBondContact O-CG 3.5Å; F63-R67 PolarHBondContact O-N 3.34Å
64	Q	97.6	Very high	95.3	Very high	90 Å²	90	74.3 Å²	74.3	42%	0.421	35%	0.346	S	S	.	.	H	α-helix	trans	-59.8	-48.4	172.4	-77.6	170.2	87.4	0	0	111.7	Q60 V61 W62 A66 R67 A68	Q60-Q64 WeakPolarHBondContact O-CB 3.44Å; Q60-Q64 VanDerWaalsContact O-CG 3.29Å; Q60-Q64 WeakPolarHBondContact O-CG 3.36Å; Q60-Q64 PolarHBondContact O-N 3.48Å; Q60-Q64 PolarHBondContact O-NE2 2.91Å; V61-Q64 PolarHBondContact O-N 2.89Å; W62-Q64 VanDerWaalsContact C-N 3.35Å; W62-Q64 PolarHBondContact O-N 3.3Å; Q64-A66 VanDerWaalsContact C-N 3.35Å; Q64-R67 PolarHBondContact O-N 3.2Å; Q64-A68 WeakPolarHBondContact O-CB 3.45Å; Q64-A68 PolarHBondContact O-N 3.37Å
65	N	97.6	Very high	94.3	Very high	104 Å²	104	79.1 Å²	79.1	56%	0.556	37%	0.37	S	S	*	.	H	α-helix	trans	-66.5	-37.3	178.3	-71.7	-21.7	0	0	0	112.1	V61 W62 A68 K69	V61-N65 PolarHBondContact O-N 2.92Å; V61-N65 PolarHBondContact O-ND2 3.38Å; W62-N65 PolarHBondContact O-N 2.85Å; N65-A68 PolarHBondContact O-N 2.9Å; N65-K69 WeakPolarHBondContact O-CB 3.24Å; N65-K69 PolarHBondContact O-N 3.33Å
66	A	96.8	Very high	92.9	Very high	19 Å²	19	77.7 Å²	77.7	16%	0.157	37%	0.367	C	S	.	.	H	α-helix	trans	-61.9	-46.2	175.8	0	0	0	0	0	111	F34 W62 F63 Q64 K69 F70	F34-A66 HydrophobicContact CD2-CB 3.94Å; F34-A66 HydrophobicContact CE2-CB 3.59Å; F34-A66 HydrophobicContact CZ-CB 3.98Å; W62-A66 HydrophobicContact CE3-CB 4.16Å; W62-A66 HydrophobicContact CH2-CB 4.14Å; W62-A66 HydrophobicContact CZ3-CB 3.91Å; W62-A66 WeakPolarHBondContact O-CB 3.47Å; W62-A66 PolarHBondContact O-N 2.89Å; F63-A66 PolarHBondContact O-N 3.43Å; Q64-A66 VanDerWaalsContact C-N 3.35Å; A66-K69 PolarHBondContact O-N 3.45Å; A66-F70 WeakPolarHBondContact O-CB 3.34Å; A66-F70 PolarHBondContact O-N 3.11Å
67	R	97	Very high	91.2	Very high	68 Å²	68	79.8 Å²	79.8	26%	0.257	38%	0.378	S	S	.	.	H	α-helix	trans	-62.8	-41.3	172.9	-70.4	-170.9	-63.9	-109.1	9.3	112.7	F34 H38 N39 F63 Q64 K69 F70 R71	F34-R67 HydrophobicContact CE2-CG 3.86Å; F34-R67 HydrophobicContact CZ-CG 4.15Å; H38-R67 HydrophobicContact CB-CG 4.32Å; H38-R67 WeakPolarHBondContact O-CD 3.38Å; H38-R67 PolarHBondContact O-NH1 3.37Å; N39-R67 WeakPolarHBondContact OD1-CD 3.47Å; N39-R67 VanDerWaalsContact OD1-CZ 3.29Å; N39-R67 PolarHBondContact OD1-NE 3.44Å; N39-R67 PolarHBondContact OD1-NH1 3.29Å; F63-R67 WeakPolarHBondContact O-CG 3.5Å; F63-R67 PolarHBondContact O-N 3.34Å; Q64-R67 PolarHBondContact O-N 3.2Å; R67-K69 VanDerWaalsContact C-N 3.3Å; R67-K69 PolarHBondContact O-N 3.12Å; R67-F70 PolarHBondContact O-N 3.36Å; R67-R71 PolarHBondContact O-N 2.93Å
68	A	96.6	Very high	89.2	Confident	28 Å²	28	80.8 Å²	80.8	23%	0.231	39%	0.389	C	S	.	.	H	α-helix	trans	-63.2	-37.8	176.8	0	0	0	0	0	111.9	Q64 N65 R72	Q64-A68 WeakPolarHBondContact O-CB 3.45Å; Q64-A68 PolarHBondContact O-N 3.37Å; N65-A68 PolarHBondContact O-N 2.9Å; A68-R72 WeakPolarHBondContact O-CG 3.42Å; A68-R72 PolarHBondContact O-N 2.87Å; A68-R72 PolarHBondContact O-NE 3.26Å
69	K	94.9	Very high	86.8	Confident	124 Å²	124	86.2 Å²	86.2	54%	0.539	41%	0.413	S	S	.	.	H	α-helix	trans	-66	-48.1	171.7	-175.6	173.1	-179.5	177.6	0	110.8	N65 A66 R67 R71 R72 N73	N65-K69 WeakPolarHBondContact O-CB 3.24Å; N65-K69 PolarHBondContact O-N 3.33Å; A66-K69 PolarHBondContact O-N 3.45Å; R67-K69 VanDerWaalsContact C-N 3.3Å; R67-K69 PolarHBondContact O-N 3.12Å; K69-R71 PolarHBondContact O-N 3.34Å; K69-R72 PolarHBondContact O-N 2.92Å; K69-R72 VanDerWaalsContact O-N 3.11Å; K69-N73 WeakPolarHBondContact CG-OD1 3.42Å; K69-N73 PolarHBondContact O-N 3.33Å; K69-N73 PolarHBondContact O-OD1 3.46Å
70	F	94.3	Very high	84.4	Confident	87 Å²	87	90.2 Å²	90.2	38%	0.382	44%	0.437	S	S	.	.	H	α-helix	trans	-55.8	-45.6	179.5	-175.5	-106.2	0	0	0	112.8	F34 H38 A66 R67 R72 N73 I74	F34-F70 HydrophobicContact CE1-CB 4.31Å; F34-F70 HydrophobicContact CE1-CD2 4.41Å; F34-F70 HydrophobicContact CE1-CG 4.43Å; F34-F70 HydrophobicContact CZ-CB 4.16Å; H38-F70 AromaticContact CE1-CE1 3.71Å; H38-F70 AromaticContact CE1-CZ 3.69Å; A66-F70 WeakPolarHBondContact O-CB 3.34Å; A66-F70 PolarHBondContact O-N 3.11Å; R67-F70 PolarHBondContact O-N 3.36Å; F70-R72 PolarHBondContact O-N 3.45Å; F70-N73 WeakPolarHBondContact O-CB 3.47Å; F70-N73 PolarHBondContact O-N 3.04Å; F70-I74 HydrophobicContact CD1-CD1 3.78Å; F70-I74 HydrophobicContact CE1-CD1 3.28Å; F70-I74 HydrophobicContact CE1-CG1 4.39Å; F70-I74 HydrophobicContact CE2-CD1 4.27Å; F70-I74 HydrophobicContact CG-CD1 4.46Å; F70-I74 HydrophobicContact CZ-CD1 3.57Å; F70-I74 HydrophobicContact CZ-CG1 4.38Å; F70-I74 PolarHBondContact O-N 2.95Å; F70-I74 VanDerWaalsContact O-N 3.08Å
71	R	94.4	Very high	82	Confident	139 Å²	139	94.5 Å²	94.5	53%	0.525	46%	0.462	S	S	.	.	H	α-helix	trans	-60.5	-44.1	174.9	-71.7	-166.3	-49.3	-85.8	-1.4	113	R67 K69 N73 I74 M75	R67-R71 PolarHBondContact O-N 2.93Å; K69-R71 PolarHBondContact O-N 3.34Å; R71-N73 VanDerWaalsContact C-N 3.27Å; R71-N73 PolarHBondContact O-N 3.25Å; R71-I74 PolarHBondContact O-N 2.86Å; R71-M75 WeakPolarHBondContact O-CG 3.45Å; R71-M75 PolarHBondContact O-N 3.31Å
72	R	92.1	Very high	79.7	Confident	162 Å²	162	98 Å²	98	61%	0.611	48%	0.478	S	S	*	.	H	α-helix	trans	-62.9	-35.7	176.8	-72.5	-176.4	-67.4	127.7	-8.4	112.2	A68 K69 F70 A76	A68-R72 WeakPolarHBondContact O-CG 3.42Å; A68-R72 PolarHBondContact O-N 2.87Å; A68-R72 PolarHBondContact O-NE 3.26Å; K69-R72 PolarHBondContact O-N 2.92Å; K69-R72 VanDerWaalsContact O-N 3.11Å; F70-R72 PolarHBondContact O-N 3.45Å; R72-A76 VanDerWaalsContact O-CB 3.32Å; R72-A76 WeakPolarHBondContact O-CB 3.45Å; R72-A76 PolarHBondContact O-N 3.28Å; R72-A76 VanDerWaalsContact O-N 3.08Å
73	N	87.2	Confident	77.3	Confident	95 Å²	95	104.5 Å²	104.5	51%	0.508	51%	0.509	S	S	.	.	H	α-helix	trans	-68.1	-34.4	176.8	-82.3	78	0	0	0	113	K69 F70 R71	K69-N73 WeakPolarHBondContact CG-OD1 3.42Å; K69-N73 PolarHBondContact O-N 3.33Å; K69-N73 PolarHBondContact O-OD1 3.46Å; F70-N73 WeakPolarHBondContact O-CB 3.47Å; F70-N73 PolarHBondContact O-N 3.04Å; R71-N73 VanDerWaalsContact C-N 3.27Å; R71-N73 PolarHBondContact O-N 3.25Å
74	I	83.8	Confident	74.5	Confident	81 Å²	81	107.2 Å²	107.2	42%	0.415	54%	0.538	S	S	.	.	H	α-helix	trans	-74.3	-49.5	175.1	-65.3	168.7	0	0	0	110.5	F70 R71 A76 H77 E78	F70-I74 HydrophobicContact CD1-CD1 3.78Å; F70-I74 HydrophobicContact CE1-CD1 3.28Å; F70-I74 HydrophobicContact CE1-CG1 4.39Å; F70-I74 HydrophobicContact CE2-CD1 4.27Å; F70-I74 HydrophobicContact CG-CD1 4.46Å; F70-I74 HydrophobicContact CZ-CD1 3.57Å; F70-I74 HydrophobicContact CZ-CG1 4.38Å; F70-I74 PolarHBondContact O-N 2.95Å; F70-I74 VanDerWaalsContact O-N 3.08Å; R71-I74 PolarHBondContact O-N 2.86Å; I74-A76 VanDerWaalsContact C-N 3.27Å; I74-A76 PolarHBondContact O-N 3.19Å; I74-H77 WeakPolarHBondContact O-CB 3.33Å; I74-H77 PolarHBondContact O-N 2.94Å; I74-E78 PolarHBondContact O-N 3.2Å
75	M	74.9	Confident	72	Confident	125 Å²	125	107.6 Å²	107.6	62%	0.616	55%	0.548	S	S	*	.	H	α-helix	trans	-57.8	-40.3	-179.4	-71.9	167.4	159.9	0	0	112.1	R71 H77 E78	R71-M75 WeakPolarHBondContact O-CG 3.45Å; R71-M75 PolarHBondContact O-N 3.31Å; M75-H77 PolarHBondContact O-N 2.91Å; M75-E78 PolarHBondContact O-N 2.92Å
76	A	66.7	Low	69.6	Low	58 Å²	58	110.8 Å²	110.8	48%	0.479	56%	0.564	S	S	.	*	H	α-helix	trans	-68.7	-20.6	176.4	0	0	0	0	0	113.5	R72 I74 E78 V80	R72-A76 VanDerWaalsContact O-CB 3.32Å; R72-A76 WeakPolarHBondContact O-CB 3.45Å; R72-A76 PolarHBondContact O-N 3.28Å; R72-A76 VanDerWaalsContact O-N 3.08Å; I74-A76 VanDerWaalsContact C-N 3.27Å; I74-A76 PolarHBondContact O-N 3.19Å; A76-E78 VanDerWaalsContact C-N 3.32Å; A76-V80 VanDerWaalsContact O-CG2 3.27Å; A76-V80 WeakPolarHBondContact O-CG2 3.32Å
77	H	59.4	Low	66.9	Low	152 Å²	152	116.1 Å²	116.1	70%	0.704	59%	0.589	S	S	*	*	H	α-helix	trans	-79	-18.5	176.9	-158.6	-71.5	0	0	0	112.2	I74 M75	I74-H77 WeakPolarHBondContact O-CB 3.33Å; I74-H77 PolarHBondContact O-N 2.94Å; M75-H77 PolarHBondContact O-N 2.91Å
78	E	54.8	Low	64.3	Low	164 Å²	164	121 Å²	121	77%	0.766	61%	0.613	S	S	*	*	H	α-helix	trans	-78.6	-21.6	173.6	-64.3	-173.4	176	0	0	112	I74 M75 A76	I74-E78 PolarHBondContact O-N 3.2Å; M75-E78 PolarHBondContact O-N 2.92Å; A76-E78 VanDerWaalsContact C-N 3.32Å
79	E	47.1	Very low	61.6	Low	161 Å²	161	125.8 Å²	125.8	75%	0.752	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	12.8	177.9	-65.3	-167.7	166.5	0	0	114.2	D81	E79-D81 VanDerWaalsContact C-N 3.33Å; E79-D81 PolarHBondContact O-N 3.4Å
80	V	47.9	Very low	58.8	Low	84 Å²	84	124.4 Å²	124.4	51%	0.509	65%	0.645	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.5	66	171.9	-162	0	0	0	0	110.3	A76	A76-V80 VanDerWaalsContact O-CG2 3.27Å; A76-V80 WeakPolarHBondContact O-CG2 3.32Å
81	D	45.9	Very low	55.8	Low	155 Å²	155	126.6 Å²	126.6	83%	0.829	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.3	-10	146	-108	-32.9	0	0	0	113	E79	E79-D81 VanDerWaalsContact C-N 3.33Å; E79-D81 PolarHBondContact O-N 3.4Å
82	I	49.6	Very low	53.1	Low	125 Å²	125	124.7 Å²	124.7	64%	0.641	68%	0.678	S	S	*	*	S	Bend	trans	-148.6	121.6	169.8	-31.9	-91.4	0	0	0	110
83	H	47.5	Very low	50.6	Low	172 Å²	172	124.8 Å²	124.8	80%	0.796	69%	0.69	S	S	*	*	S	Bend	trans	90.4	83.1	171.5	-44.1	101.6	0	0	0	117.8
84	G	37.9	Very low	48.6	Very low	59 Å²	59	125.9 Å²	125.9	61%	0.608	71%	0.705	S	S	*	*			trans	19.3	117.9	138.9	0	0	0	0	0	120.2	I86	G84-I86 PolarHBondContact O-N 3.24Å
85	P	46.4	Very low	46.8	Very low	97 Å²	97	128.2 Å²	128.2	63%	0.63	73%	0.726	S	S	*	*			trans	-81.4	101.2	-175.3	31.6	-33.1	0	0	0	113.1	N87	P85-N87 PolarHBondContact O-N 2.96Å
86	I	46.7	Very low	45.2	Very low	172 Å²	172	127.8 Å²	127.8	88%	0.882	74%	0.735	S	S	*	*			trans	-82.9	94.2	162.5	-56.1	172.6	0	0	0	107.7	G84	G84-I86 PolarHBondContact O-N 3.24Å
87	N	40.6	Very low	43.9	Very low	130 Å²	130	129.6 Å²	129.6	70%	0.695	74%	0.744	S	S	*	*			trans	167.9	71.3	137.8	-165.4	7.3	0	0	0	109.8	P85	P85-N87 PolarHBondContact O-N 2.96Å
88	K	42.8	Very low	43.1	Very low	172 Å²	172	127.5 Å²	127.5	75%	0.748	75%	0.747	S	S	*	*			trans	-116.6	82.7	160.8	-66.8	-179.3	-174.5	170.4	0	107.1	S90	K88-S90 PolarHBondContact O-N 3.25Å
89	T	39.4	Very low	43	Very low	127 Å²	127	126.4 Å²	126.4	78%	0.779	75%	0.751	S	S	*	*			trans	-70.8	76.3	161.3	59.7	0	0	0	0	108.1
90	S	35.1	Very low	43.1	Very low	96 Å²	96	124.1 Å²	124.1	67%	0.671	75%	0.752	S	S	*	*			trans	-78.2	105.9	154.7	35	0	0	0	0	106.3	K88 S92	K88-S90 PolarHBondContact O-N 3.25Å; S90-S92 PolarHBondContact O-N 3.4Å; S90-S92 VanDerWaalsContact O-N 3.09Å
91	C	31.7	Very low	43.2	Very low	132 Å²	132	125.2 Å²	125.2	89%	0.892	76%	0.764	S	S	*	*			trans	-66.3	101.1	174.5	49.8	0	0	0	0	109.5
92	S	37.1	Very low	43.9	Very low	100 Å²	100	124 Å²	124	70%	0.699	76%	0.763	S	S	*	*			trans	-122.8	116.5	160.5	48.6	0	0	0	0	106.7	S90 S94	S90-S92 PolarHBondContact O-N 3.4Å; S90-S92 VanDerWaalsContact O-N 3.09Å; S92-S94 PolarHBondContact O-N 3.08Å
93	D	41.4	Very low	44.4	Very low	164 Å²	164	129.2 Å²	129.2	88%	0.877	77%	0.774	S	S	*	*			trans	-39.8	122.8	176.2	-78.2	-87.9	0	0	0	113.5
94	S	43.9	Very low	44.7	Very low	117 Å²	117	129 Å²	129	82%	0.818	78%	0.776	S	S	*	*			trans	-164.9	122.5	149.3	-78.4	0	0	0	0	109	S92	S92-S94 PolarHBondContact O-N 3.08Å
95	P	46.3	Very low	45	Very low	131 Å²	131	132.9 Å²	132.9	85%	0.851	78%	0.782	S	S	*	*			trans	-98.3	116.4	-177.5	34.7	-27.1	0	0	0	111.2
96	S	41.7	Very low	45.4	Very low	116 Å²	116	135.6 Å²	135.6	81%	0.811	79%	0.791	S	S	*	*			trans	176.7	136.4	155.8	-148.3	0	0	0	0	107.4
97	S	38.1	Very low	45.9	Very low	96 Å²	96	133 Å²	133	67%	0.671	78%	0.783	S	S	*	*			cis	-169.4	163.9	-6.8	34.4	0	0	0	0	105.4
98	S	43.6	Very low	46.4	Very low	108 Å²	108	130.9 Å²	130.9	76%	0.755	78%	0.783	S	S	*	*			trans	81.1	89.8	162	-53.3	0	0	0	0	117.2	S100	S98-S100 PolarHBondContact O-N 3.21Å
99	V	51.7	Low	46.6	Very low	140 Å²	140	130.6 Å²	130.6	85%	0.848	79%	0.79	S	S	*	*			trans	-48	118	153.6	-72.8	0	0	0	0	111
100	S	49.1	Very low	47.2	Very low	113 Å²	113	131.3 Å²	131.3	79%	0.79	79%	0.789	S	S	*	*			trans	-119	86.4	156.2	-92.2	0	0	0	0	107.5	S98 T102	S98-S100 PolarHBondContact O-N 3.21Å; S100-T102 VanDerWaalsContact C-N 3.33Å; S100-T102 PolarHBondContact O-N 3.08Å
101	S	52	Low	48.2	Very low	108 Å²	108	134.3 Å²	134.3	76%	0.755	80%	0.796	S	S	*	*			trans	-81.1	81.5	169.9	-66.2	0	0	0	0	108.4	R103	S101-R103 PolarHBondContact O-N 2.87Å
102	T	58.6	Low	49.2	Very low	130 Å²	130	132.4 Å²	132.4	80%	0.798	78%	0.784	S	S	*	*			trans	-76.8	107	163.9	-45.3	0	0	0	0	107.1	S100	S100-T102 VanDerWaalsContact C-N 3.33Å; S100-T102 PolarHBondContact O-N 3.08Å
103	R	60.3	Low	50	Low	234 Å²	234	132 Å²	132	88%	0.883	78%	0.782	S	S	*	*			trans	-66.3	131.8	174.7	-73.4	-178.7	168.8	-174.6	-2.9	109.1	S101 D105	S101-R103 PolarHBondContact O-N 2.87Å; R103-D105 PolarHBondContact O-N 3.09Å
104	M	54.5	Low	50.8	Low	168 Å²	168	129.6 Å²	129.6	83%	0.828	78%	0.778	S	S	*	*			trans	-65.6	117.9	169.6	-61.9	-79.4	176.7	0	0	108.8
105	D	44.7	Very low	51.2	Low	139 Å²	139	130.7 Å²	130.7	74%	0.743	77%	0.774	S	S	*	*			trans	-102.2	98.8	157.4	-167.1	55.5	0	0	0	106.2	R103	R103-D105 PolarHBondContact O-N 3.09Å
106	L	55.2	Low	51.6	Low	154 Å²	154	134.1 Å²	134.1	81%	0.806	78%	0.776	S	S	*	*			trans	-95.3	87.4	171.5	-70.6	167.6	0	0	0	105.9	A108	L106-A108 PolarHBondContact O-N 3.4Å
107	T	57.3	Low	52.1	Low	117 Å²	117	134.6 Å²	134.6	72%	0.718	77%	0.774	S	S	*	*			trans	-68	111.6	162.3	46.1	0	0	0	0	107.4	D109	T107-D109 PolarHBondContact O-N 3.34Å
108	A	50.7	Low	52.7	Low	86 Å²	86	132.2 Å²	132.2	71%	0.711	77%	0.765	S	S	*	*			trans	-71	110.4	168.2	0	0	0	0	0	107.6	L106	L106-A108 PolarHBondContact O-N 3.4Å
109	D	47.3	Very low	53	Low	166 Å²	166	136.5 Å²	136.5	89%	0.888	77%	0.773	S	S	*	*			trans	-177.1	97.8	154.5	-89.5	-43.5	0	0	0	108.2	T107	T107-D109 PolarHBondContact O-N 3.34Å
110	D	50.6	Low	53.2	Low	142 Å²	142	134.4 Å²	134.4	76%	0.759	76%	0.762	S	S	*	*				-179.8	94.9	129.3	-166.1	52.1	0	0	0	107.7	S112	D110-S112 PolarHBondContact O-N 3.49Å; D110-S112 WeakPolarHBondContact OD2-CB 3.37Å
111	I	56	Low	52.9	Low	159 Å²	159	137 Å²	137	82%	0.815	77%	0.766	S	S	*	*			trans	-74.1	78.2	166	-58.7	178.1	0	0	0	105.8	S113	I111-S113 VanDerWaalsContact C-N 3.31Å; I111-S113 PolarHBondContact O-N 3.25Å; I111-S113 PolarHBondContact O-OG 2.91Å
112	S	52.5	Low	53	Low	92 Å²	92	137.6 Å²	137.6	64%	0.643	77%	0.771	S	S	*	*			trans	-69	97.9	169.6	-161.7	0	0	0	0	108.1	D110 S114	D110-S112 PolarHBondContact O-N 3.49Å; D110-S112 WeakPolarHBondContact OD2-CB 3.37Å; S112-S114 VanDerWaalsContact C-N 3.34Å; S112-S114 PolarHBondContact O-N 3.32Å
113	S	54.7	Low	52.8	Low	93 Å²	93	135.7 Å²	135.7	65%	0.65	76%	0.762	S	S	*	*			trans	-66.5	88	179.8	-59.6	0	0	0	0	109	I111 N115	I111-S113 VanDerWaalsContact C-N 3.31Å; I111-S113 PolarHBondContact O-N 3.25Å; I111-S113 PolarHBondContact O-OG 2.91Å; S113-N115 PolarHBondContact O-N 3.29Å
114	S	58.6	Low	52.1	Low	113 Å²	113	133.4 Å²	133.4	79%	0.79	76%	0.759	S	S	*	*			trans	-81.7	105.9	167.3	43.7	0	0	0	0	108.5	S112 F116	S112-S114 VanDerWaalsContact C-N 3.34Å; S112-S114 PolarHBondContact O-N 3.32Å; S114-F116 PolarHBondContact O-N 3.27Å
115	N	51.4	Low	51.8	Low	139 Å²	139	138 Å²	138	74%	0.743	78%	0.779	S	S	*	*			trans	-47.9	115.3	-178.9	-71.7	-54.8	0	0	0	111.9	S113 T117	S113-N115 PolarHBondContact O-N 3.29Å; N115-T117 PolarHBondContact O-N 3.22Å
116	F	55.5	Low	52.2	Low	204 Å²	204	138 Å²	138	90%	0.895	78%	0.781	S	S	*	*			trans	-73.7	78.8	156.9	-166.2	-96.8	0	0	0	107.3	S114 G118	S114-F116 PolarHBondContact O-N 3.27Å; F116-G118 PolarHBondContact O-N 3.3Å
117	T	51.5	Low	52	Low	126 Å²	126	137.2 Å²	137.2	77%	0.773	78%	0.779	S	S	*	*			trans	-67.2	102.7	167.7	10.1	0	0	0	0	107.2	N115	N115-T117 PolarHBondContact O-N 3.22Å
118	G	50.1	Low	51.7	Low	46 Å²	46	138.3 Å²	138.3	47%	0.474	78%	0.783	S	S	.	*			trans	-58.1	143.4	176.8	0	0	0	0	0	112.1	F116 P120	F116-G118 PolarHBondContact O-N 3.3Å; G118-P120 WeakPolarHBondContact O-CD 3.27Å
119	H	50.6	Low	51.8	Low	197 Å²	197	141.4 Å²	141.4	91%	0.912	79%	0.787	S	S	*	*			trans	-102.7	99.8	149.5	-105.9	-95	0	0	0	107.2
120	P	56	Low	52.1	Low	96 Å²	96	139.8 Å²	139.8	62%	0.623	78%	0.78	S	S	*	*			trans	-79.2	167.2	157.5	34.5	-28.1	0	0	0	108.6	G118	G118-P120 WeakPolarHBondContact O-CD 3.27Å
121	L	43.6	Very low	52.2	Low	167 Å²	167	139.7 Å²	139.7	87%	0.874	78%	0.782	S	S	*	*			trans	93.6	98.4	166.1	-50.6	166.9	0	0	0	116
122	S	53.1	Low	51.9	Low	122 Å²	122	138.3 Å²	138.3	85%	0.853	78%	0.779	S	S	*	*				-155.5	104.4	104.6	-168.6	0	0	0	0	109.1
123	S	54.6	Low	51.9	Low	89 Å²	89	141.8 Å²	141.8	62%	0.622	79%	0.79	S	S	*	*			trans	-99	155.5	162.6	-177.2	0	0	0	0	106.8
124	F	45.9	Very low	51.6	Low	187 Å²	187	145.9 Å²	145.9	82%	0.82	80%	0.802	S	S	*	*			trans	81.1	124.9	178.3	-60	-89.1	0	0	0	113.6
125	E	48.6	Very low	51	Low	265 Å²	265	148.9 Å²	148.9	100%	1.238	80%	0.803	S	S	*	*			cis	-135.1	0	12.7	-71.4	175.6	92.4	0	0	111.4

Retrieved 125 of 125 residues in 56.5 ms (Link to these results)

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