A0A077YV38_TRITR Loading...

Homeobox domain containing protein

AlphaFold DB , UniProt , Accession A0A077YV38, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 140 aa.

						>A0A077YV38_TRITR|A0A077YV38
MQISCKSDRRQTYHRSQTLELEKEFFTNRYLTRRRRIELAQYVGLTERQVKIWFQNRRMKWKKEHKQKEPDDQKQPESQENNPANVSTLTNCSSTTLVASNAVATKLEANNPRQTYGATANSAVQMDESKEFKKTLFNRC
					

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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	56.2	Low	58.8	Low	242 Å²	242	162.1 Å²	162.1	100%	1.192	80%	0.796	S	S	*	*				0	114.9	0	-72.5	-177.6	167.6	0	0	108	I3	M1-I3 PolarHBondContact O-N 3.45Å
2	Q	37.6	Very low	61.5	Low	196 Å²	196	158.2 Å²	158.2	92%	0.916	79%	0.788	S	S	*	*			trans	-71.6	118.5	-179.2	-70.5	179.2	-22.5	0	0	109.7	S4	Q2-S4 VanDerWaalsContact C-N 3.32Å; Q2-S4 PolarHBondContact O-N 2.56Å; Q2-S4 VanDerWaalsContact O-N 3.09Å
3	I	51.9	Low	64.1	Low	140 Å²	140	150.4 Å²	150.4	72%	0.718	75%	0.745	S	S	*	*			trans	-80.1	88.2	168.9	-57.8	172.3	0	0	0	106.4	M1 C5	M1-I3 PolarHBondContact O-N 3.45Å; I3-C5 PolarHBondContact O-N 3.21Å
4	S	50.6	Low	66.4	Low	92 Å²	92	148.9 Å²	148.9	64%	0.643	74%	0.735	S	S	*	*			trans	-79.8	96.2	170.4	-173.3	0	0	0	0	107.8	Q2 K6	Q2-S4 VanDerWaalsContact C-N 3.32Å; Q2-S4 PolarHBondContact O-N 2.56Å; Q2-S4 VanDerWaalsContact O-N 3.09Å; S4-K6 PolarHBondContact O-N 3.46Å
5	C	52.7	Low	68.4	Low	88 Å²	88	149.4 Å²	149.4	60%	0.595	73%	0.725	S	S	*	*			trans	-63.6	92.4	163	-48.8	0	0	0	0	106.4	I3 S7	I3-C5 PolarHBondContact O-N 3.21Å; C5-S7 VanDerWaalsContact C-N 3.32Å; C5-S7 PolarHBondContact O-N 2.51Å
6	K	55.1	Low	70.2	Confident	186 Å²	186	145 Å²	145	81%	0.809	71%	0.714	S	S	*	*			trans	-62.4	101	170.8	-70	-178.2	179.4	173.1	0	106	S4 D8	S4-K6 PolarHBondContact O-N 3.46Å; K6-D8 PolarHBondContact O-N 2.56Å
7	S	53.2	Low	71.8	Confident	113 Å²	113	137.9 Å²	137.9	79%	0.79	68%	0.679	S	S	*	*			trans	-60.4	91.2	174	62.3	0	0	0	0	107.6	C5 R9	C5-S7 VanDerWaalsContact C-N 3.32Å; C5-S7 PolarHBondContact O-N 2.51Å; S7-R9 PolarHBondContact O-N 2.9Å; S7-R9 VanDerWaalsContact O-N 3.08Å
8	D	55.7	Low	73.3	Confident	151 Å²	151	131.7 Å²	131.7	81%	0.807	65%	0.65	S	S	*	*			trans	-50.8	122.4	172.3	-173.5	9.5	0	0	0	106.9	K6 R10	K6-D8 PolarHBondContact O-N 2.56Å; D8-R10 VanDerWaalsContact C-N 3.35Å; D8-R10 PolarHBondContact O-N 3.2Å
9	R	72.1	Confident	74.6	Confident	227 Å²	227	128.9 Å²	128.9	86%	0.857	64%	0.638	S	S	*	*			trans	-58.7	97.9	-169.4	179.8	-172.5	-70.3	-148.3	-1.6	107.4	S7 Q11	S7-R9 PolarHBondContact O-N 2.9Å; S7-R9 VanDerWaalsContact O-N 3.08Å; R9-Q11 PolarHBondContact O-N 3.31Å
10	R	80.1	Confident	75.7	Confident	221 Å²	221	124.9 Å²	124.9	83%	0.834	62%	0.617	S	S	*	*			trans	-60.4	107.2	-179	-178.2	-179.4	-65.9	-84.7	-0.9	108.6	D8	D8-R10 VanDerWaalsContact C-N 3.35Å; D8-R10 PolarHBondContact O-N 3.2Å
11	Q	82.1	Confident	76.8	Confident	127 Å²	127	118.9 Å²	118.9	59%	0.593	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-77.1	128	169.6	-173.6	176.5	-9.3	0	0	109	R9	R9-Q11 PolarHBondContact O-N 3.31Å
12	T	91.3	Very high	78.8	Confident	115 Å²	115	110.2 Å²	110.2	71%	0.706	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-89.9	137.4	171.4	-58.7	0	0	0	0	109
13	Y	94.6	Very high	81.7	Confident	57 Å²	57	106.7 Å²	106.7	22%	0.224	53%	0.526	C	S	.	.	P	Polyproline II helix	trans	-75.8	145.6	175.4	-56.7	-50.5	0	0	0	111	L45 W53	Y13-L45 HydrophobicContact CD1-CD1 3.82Å; Y13-L45 HydrophobicContact CD1-CD2 3.76Å; Y13-L45 HydrophobicContact CD1-CG 4.46Å; Y13-L45 HydrophobicContact CE1-CD1 3.71Å; Y13-L45 HydrophobicContact CE1-CD2 3.66Å; Y13-L45 HydrophobicContact CE1-CG 4.36Å; Y13-L45 HydrophobicContact CG-CD1 4.36Å; Y13-W53 AromaticContact CD2-CD1 3.83Å; Y13-W53 AromaticContact CE2-CD1 3.67Å; Y13-W53 HydrophobicContact CE2-CG 4.47Å
14	H	96.4	Very high	83.9	Confident	130 Å²	130	101.2 Å²	101.2	60%	0.602	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-63.1	157	174.2	-68.1	-97.8	0	0	0	111.1	S16 Q17 T18	H14-S16 VanDerWaalsContact C-N 3.3Å; H14-S16 PolarHBondContact O-N 3.05Å; H14-Q17 HydrophobicContact CB-CG 4.15Å; H14-Q17 WeakPolarHBondContact O-CB 3.41Å; H14-Q17 PolarHBondContact O-N 3.46Å; H14-Q17 VanDerWaalsContact O-N 3.11Å; H14-T18 PolarHBondContact O-N 3.01Å
15	R	96.5	Very high	86.2	Confident	156 Å²	156	97 Å²	97	59%	0.589	47%	0.467	S	S	*	.	H	α-helix	trans	-57.9	-43.1	179.9	-175	60.4	-178.8	134.3	-3.9	111.9	Q17 T18 L19 E22	R15-Q17 VanDerWaalsContact C-N 3.34Å; R15-Q17 PolarHBondContact O-N 2.71Å; R15-T18 PolarHBondContact NH1-OG1 3.32Å; R15-T18 VanDerWaalsContact NH1-OG1 3.17Å; R15-T18 PolarHBondContact O-N 3.21Å; R15-T18 PolarHBondContact O-OG1 3.27Å; R15-L19 HydrophobicContact CG-CD1 4.12Å; R15-L19 HydrophobicContact CG-CG 4.39Å; R15-L19 VanDerWaalsContact CZ-CD2 3.45Å; R15-L19 WeakPolarHBondContact O-CG 3.31Å; R15-L19 PolarHBondContact O-N 3.34Å; R15-E22 IonicContact NH1-OE2 3.64Å
16	S	97.2	Very high	88.3	Confident	79 Å²	79	100.1 Å²	100.1	55%	0.552	47%	0.471	S	S	*	.	H	α-helix	trans	-55.7	-46.5	175	51.9	0	0	0	0	112.3	H14 T18 L19 E20	H14-S16 VanDerWaalsContact C-N 3.3Å; H14-S16 PolarHBondContact O-N 3.05Å; S16-T18 PolarHBondContact O-N 3.4Å; S16-L19 PolarHBondContact O-N 3.03Å; S16-E20 PolarHBondContact O-N 3.01Å; S16-E20 VanDerWaalsContact O-N 3.15Å
17	Q	98	Very high	90.3	Very high	24 Å²	24	96.6 Å²	96.6	11%	0.112	47%	0.465	C	S	.	.	H	α-helix	trans	-59.6	-46.2	176.8	-62.5	179.1	-48.7	0	0	111.4	H14 R15 L19 L21 V43	H14-Q17 HydrophobicContact CB-CG 4.15Å; H14-Q17 WeakPolarHBondContact O-CB 3.41Å; H14-Q17 PolarHBondContact O-N 3.46Å; H14-Q17 VanDerWaalsContact O-N 3.11Å; R15-Q17 VanDerWaalsContact C-N 3.34Å; R15-Q17 PolarHBondContact O-N 2.71Å; Q17-L19 VanDerWaalsContact C-N 3.35Å; Q17-L19 PolarHBondContact O-N 3.39Å; Q17-L21 WeakPolarHBondContact O-CB 3.46Å; Q17-L21 WeakPolarHBondContact O-CD1 2.94Å; Q17-L21 WeakPolarHBondContact O-CG 2.99Å; Q17-L21 PolarHBondContact O-N 3.46Å; Q17-L21 VanDerWaalsContact O-N 3.11Å; Q17-V43 PolarHBondContact NE2-O 3.48Å
18	T	97.5	Very high	92.4	Very high	27 Å²	27	94.9 Å²	94.9	17%	0.166	45%	0.447	C	S	.	.	H	α-helix	trans	-64.6	-37.7	179.1	60.2	0	0	0	0	113	H14 R15 S16 L21 E22	H14-T18 PolarHBondContact O-N 3.01Å; R15-T18 PolarHBondContact NH1-OG1 3.32Å; R15-T18 VanDerWaalsContact NH1-OG1 3.17Å; R15-T18 PolarHBondContact O-N 3.21Å; R15-T18 PolarHBondContact O-OG1 3.27Å; S16-T18 PolarHBondContact O-N 3.4Å; T18-L21 PolarHBondContact O-N 3.36Å; T18-E22 WeakPolarHBondContact O-CB 3.33Å; T18-E22 VanDerWaalsContact O-CG 3.28Å; T18-E22 WeakPolarHBondContact O-CG 3.46Å; T18-E22 PolarHBondContact O-N 3.04Å
19	L	98	Very high	94.4	Very high	78 Å²	78	93.5 Å²	93.5	41%	0.408	43%	0.43	S	S	.	.	H	α-helix	trans	-64.2	-46.2	179.6	-76	171.8	0	0	0	111.6	R15 S16 Q17 E22 K23	R15-L19 HydrophobicContact CG-CD1 4.12Å; R15-L19 HydrophobicContact CG-CG 4.39Å; R15-L19 VanDerWaalsContact CZ-CD2 3.45Å; R15-L19 WeakPolarHBondContact O-CG 3.31Å; R15-L19 PolarHBondContact O-N 3.34Å; S16-L19 PolarHBondContact O-N 3.03Å; Q17-L19 VanDerWaalsContact C-N 3.35Å; Q17-L19 PolarHBondContact O-N 3.39Å; L19-E22 PolarHBondContact O-N 3.19Å; L19-K23 WeakPolarHBondContact O-CB 3.39Å; L19-K23 PolarHBondContact O-N 3.41Å
20	E	98.2	Very high	95.6	Very high	48 Å²	48	89.4 Å²	89.4	22%	0.224	42%	0.416	C	S	.	.	H	α-helix	trans	-67.1	-38	178.7	-64.5	-55.3	145.5	0	0	111.9	S16 K23 E24 Y42 V43	S16-E20 PolarHBondContact O-N 3.01Å; S16-E20 VanDerWaalsContact O-N 3.15Å; E20-K23 PolarHBondContact O-N 3.29Å; E20-K23 IonicContact OE2-NZ 3.78Å; E20-E24 WeakPolarHBondContact O-CG 2.81Å; E20-E24 PolarHBondContact O-N 3Å; E20-Y42 HydrophobicContact CB-CD1 4.44Å; E20-Y42 HydrophobicContact CB-CE1 4.21Å; E20-Y42 HydrophobicContact CG-CD1 4.31Å; E20-Y42 HydrophobicContact CG-CE1 3.65Å; E20-V43 HydrophobicContact CB-CG1 3.74Å
21	L	98.4	Very high	96.4	Very high	0 Å²	0	80.3 Å²	80.3	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-64.8	-40.3	173.8	-69.3	168.1	0	0	0	112.3	Q17 T18 F25 L39 L45 V50 W53 F54	Q17-L21 WeakPolarHBondContact O-CB 3.46Å; Q17-L21 WeakPolarHBondContact O-CD1 2.94Å; Q17-L21 WeakPolarHBondContact O-CG 2.99Å; Q17-L21 PolarHBondContact O-N 3.46Å; Q17-L21 VanDerWaalsContact O-N 3.11Å; T18-L21 PolarHBondContact O-N 3.36Å; L21-F25 WeakPolarHBondContact O-CB 3.4Å; L21-F25 PolarHBondContact O-N 3.5Å; L21-L39 HydrophobicContact CD2-CD2 3.83Å; L21-L39 HydrophobicContact CD2-CG 4.21Å; L21-L45 HydrophobicContact CD1-CD1 4.18Å; L21-V50 HydrophobicContact CD2-CG1 4.2Å; L21-V50 HydrophobicContact CD2-CG2 4.45Å; L21-W53 VanDerWaalsContact C-CH2 3.45Å; L21-W53 HydrophobicContact CB-CD2 3.91Å; L21-W53 HydrophobicContact CB-CE3 3.89Å; L21-W53 HydrophobicContact CB-CH2 3.64Å; L21-W53 HydrophobicContact CB-CZ2 3.63Å; L21-W53 HydrophobicContact CB-CZ3 3.76Å; L21-W53 HydrophobicContact CD1-CD2 3.84Å; L21-W53 HydrophobicContact CD1-CE3 4.47Å; L21-W53 HydrophobicContact CD1-CG 3.81Å; L21-W53 HydrophobicContact CD2-CD2 4.44Å; L21-W53 HydrophobicContact CD2-CE3 4.3Å; L21-W53 HydrophobicContact CG-CD2 4.29Å; L21-W53 HydrophobicContact CG-CE3 4.46Å; L21-W53 WeakPolarHBondContact O-CH2 3.47Å; L21-W53 WeakPolarHBondContact O-CZ3 3.42Å; L21-F54 HydrophobicContact CD2-CE2 4.21Å
22	E	98.4	Very high	97.2	Very high	60 Å²	60	78.1 Å²	78.1	28%	0.28	38%	0.379	S	S	.	.	H	α-helix	trans	-65.2	-46.9	175.9	-78.2	177.7	169.4	0	0	111.6	R15 T18 L19 E24 F25 F26 W53	R15-E22 IonicContact NH1-OE2 3.64Å; T18-E22 WeakPolarHBondContact O-CB 3.33Å; T18-E22 VanDerWaalsContact O-CG 3.28Å; T18-E22 WeakPolarHBondContact O-CG 3.46Å; T18-E22 PolarHBondContact O-N 3.04Å; L19-E22 PolarHBondContact O-N 3.19Å; E22-E24 VanDerWaalsContact C-N 3.3Å; E22-E24 PolarHBondContact O-N 2.85Å; E22-F25 WeakPolarHBondContact O-CB 3.34Å; E22-F25 PolarHBondContact O-N 3.1Å; E22-F25 VanDerWaalsContact O-N 3.08Å; E22-F26 HydrophobicContact CB-CE2 4.35Å; E22-F26 WeakPolarHBondContact O-CD2 3.23Å; E22-F26 PolarHBondContact O-N 3.04Å; E22-W53 HydrophobicContact CG-CH2 4.07Å; E22-W53 HydrophobicContact CG-CZ2 4.01Å
23	K	98.1	Very high	97.5	Very high	122 Å²	122	80.1 Å²	80.1	53%	0.53	37%	0.374	S	S	.	.	H	α-helix	trans	-52.8	-48.9	175.1	179.3	-177.7	172.9	-172.3	0	111.2	L19 E20 F25 F26 T27	L19-K23 WeakPolarHBondContact O-CB 3.39Å; L19-K23 PolarHBondContact O-N 3.41Å; E20-K23 PolarHBondContact O-N 3.29Å; E20-K23 IonicContact OE2-NZ 3.78Å; K23-F25 PolarHBondContact O-N 2.95Å; K23-F26 PolarHBondContact O-N 2.99Å; K23-T27 PolarHBondContact O-N 3.16Å; K23-T27 PolarHBondContact O-OG1 2.94Å
24	E	98.1	Very high	97.7	Very high	24 Å²	24	86.5 Å²	86.5	11%	0.112	40%	0.397	C	S	.	.	H	α-helix	trans	-64.5	-38.3	176.3	-73.5	-59.2	133.8	0	0	113.6	E20 E22 F26 T27 N28 R35 L39 F54	E20-E24 WeakPolarHBondContact O-CG 2.81Å; E20-E24 PolarHBondContact O-N 3Å; E22-E24 VanDerWaalsContact C-N 3.3Å; E22-E24 PolarHBondContact O-N 2.85Å; E24-F26 VanDerWaalsContact C-N 3.3Å; E24-F26 PolarHBondContact O-N 3.04Å; E24-T27 PolarHBondContact O-N 3.22Å; E24-N28 PolarHBondContact O-N 3.47Å; E24-R35 IonicContact OE1-CZ 3.82Å; E24-R35 IonicContact OE1-NE 3.78Å; E24-R35 IonicContact OE1-NH2 3.4Å; E24-R35 PolarHBondContact OE1-NH2 3.46Å; E24-R35 IonicContact OE2-CZ 3.94Å; E24-R35 IonicContact OE2-NE 3.61Å; E24-R35 PolarHBondContact OE2-NE 3.22Å; E24-R35 IonicContact OE2-NH2 2.96Å; E24-R35 PolarHBondContact OE2-NH2 2.85Å; E24-L39 HydrophobicContact CB-CD2 3.93Å; E24-L39 HydrophobicContact CG-CD1 3.63Å; E24-L39 HydrophobicContact CG-CD2 3.78Å; E24-L39 HydrophobicContact CG-CG 4.33Å; E24-F54 HydrophobicContact CB-CZ 4.06Å
25	F	98.3	Very high	97.8	Very high	3 Å²	3	84 Å²	84	1%	0.013	38%	0.383	C	S	.	.	H	α-helix	trans	-63.5	-35.8	177.7	-178.8	-98.3	0	0	0	112.8	L21 E22 K23 N28 R29 W53 F54 R57 R58 W61	L21-F25 WeakPolarHBondContact O-CB 3.4Å; L21-F25 PolarHBondContact O-N 3.5Å; E22-F25 WeakPolarHBondContact O-CB 3.34Å; E22-F25 PolarHBondContact O-N 3.1Å; E22-F25 VanDerWaalsContact O-N 3.08Å; K23-F25 PolarHBondContact O-N 2.95Å; F25-N28 CarbonylContact O-C 3.41Å; F25-R29 HydrophobicContact CE1-CG 4.4Å; F25-R29 HydrophobicContact CE2-CB 4.02Å; F25-R29 HydrophobicContact CE2-CG 4.17Å; F25-R29 HydrophobicContact CZ-CB 4.3Å; F25-R29 HydrophobicContact CZ-CG 4.01Å; F25-R29 PolarHBondContact O-N 2.84Å; F25-W53 HydrophobicContact CB-CH2 4.22Å; F25-W53 HydrophobicContact CB-CZ3 4.08Å; F25-F54 HydrophobicContact CB-CE1 4.25Å; F25-F54 HydrophobicContact CB-CZ 4.38Å; F25-F54 HydrophobicContact CD2-CD1 4.08Å; F25-F54 HydrophobicContact CD2-CE1 4Å; F25-R57 HydrophobicContact CB-CG 4.41Å; F25-R57 HydrophobicContact CD1-CG 3.76Å; F25-R57 HydrophobicContact CD2-CB 4.26Å; F25-R57 HydrophobicContact CD2-CG 3.57Å; F25-R57 HydrophobicContact CE1-CG 3.83Å; F25-R57 HydrophobicContact CE2-CB 4.28Å; F25-R57 HydrophobicContact CE2-CG 3.65Å; F25-R57 HydrophobicContact CG-CG 3.62Å; F25-R57 HydrophobicContact CZ-CG 3.79Å; F25-R58 HydrophobicContact CE2-CG 3.81Å; F25-R58 HydrophobicContact CZ-CG 4.41Å; F25-W61 HydrophobicContact CE1-CB 4.25Å; F25-W61 HydrophobicContact CE1-CG 4.17Å; F25-W61 HydrophobicContact CZ-CB 3.89Å; F25-W61 AromaticContact CZ-CG 3.96Å; F25-W61 HydrophobicContact CZ-CG 3.96Å
26	F	97.1	Very high	97.9	Very high	155 Å²	155	79.3 Å²	79.3	68%	0.68	37%	0.365	S	S	*	.	H	α-helix	trans	-67.2	-39.4	174.3	-72.8	-65.4	0	0	0	111.8	E22 K23 E24	E22-F26 HydrophobicContact CB-CE2 4.35Å; E22-F26 WeakPolarHBondContact O-CD2 3.23Å; E22-F26 PolarHBondContact O-N 3.04Å; K23-F26 PolarHBondContact O-N 2.99Å; E24-F26 VanDerWaalsContact C-N 3.3Å; E24-F26 PolarHBondContact O-N 3.04Å
27	T	97.3	Very high	97.9	Very high	111 Å²	111	78.3 Å²	78.3	68%	0.681	35%	0.353	S	S	*	.	H	α-helix	trans	-65.6	-47.1	174.4	-54.1	0	0	0	0	111.6	K23 E24	K23-T27 PolarHBondContact O-N 3.16Å; K23-T27 PolarHBondContact O-OG1 2.94Å; E24-T27 PolarHBondContact O-N 3.22Å
28	N	97	Very high	97.9	Very high	77 Å²	77	80.7 Å²	80.7	41%	0.412	36%	0.364	S	S	.	.			trans	-149.4	120.6	178.6	-169.7	-12.3	0	0	0	111.8	E24 F25 Y30 F54	E24-N28 PolarHBondContact O-N 3.47Å; F25-N28 CarbonylContact O-C 3.41Å; N28-Y30 PolarHBondContact ND2-O 3.29Å; N28-Y30 PolarHBondContact O-N 3.08Å; N28-Y30 VanDerWaalsContact O-N 3.16Å; N28-Y30 PolarHBondContact OD1-N 3.26Å; N28-Y30 PolarHBondContact OD1-O 3.49Å; N28-F54 WeakPolarHBondContact O-CE1 3.35Å
29	R	97.2	Very high	98	Very high	122 Å²	122	79.5 Å²	79.5	46%	0.46	36%	0.357	S	S	.	.	S	Bend	trans	-68.6	-13.5	-179.6	-61.9	176.7	178	117.9	-0.7	113.4	F25 R58	F25-R29 HydrophobicContact CE1-CG 4.4Å; F25-R29 HydrophobicContact CE2-CB 4.02Å; F25-R29 HydrophobicContact CE2-CG 4.17Å; F25-R29 HydrophobicContact CZ-CB 4.3Å; F25-R29 HydrophobicContact CZ-CG 4.01Å; F25-R29 PolarHBondContact O-N 2.84Å; R29-R58 WeakPolarHBondContact O-CD 3.13Å; R29-R58 PolarHBondContact O-NH1 3.1Å; R29-R58 VanDerWaalsContact O-NH1 3.1Å
30	Y	98.2	Very high	98	Very high	141 Å²	141	76.1 Å²	76.1	55%	0.553	34%	0.34	S	S	*	.	S	Bend	trans	-130.6	129.3	-179.4	-62.7	-89.4	0	0	0	111.2	N28	N28-Y30 PolarHBondContact ND2-O 3.29Å; N28-Y30 PolarHBondContact O-N 3.08Å; N28-Y30 VanDerWaalsContact O-N 3.16Å; N28-Y30 PolarHBondContact OD1-N 3.26Å; N28-Y30 PolarHBondContact OD1-O 3.49Å
31	L	97.6	Very high	98	Very high	30 Å²	30	81 Å²	81	16%	0.157	36%	0.363	C	S	.	.			trans	-87.9	132.9	178.4	-70.1	177.8	0	0	0	112.3	R35 R36 L39 V50 F54	L31-R35 HydrophobicContact CD2-CB 4.23Å; L31-R35 HydrophobicContact CD2-CG 3.75Å; L31-R36 HydrophobicContact CD1-CB 4.39Å; L31-R36 HydrophobicContact CD1-CG 4.46Å; L31-L39 HydrophobicContact CD1-CD2 4.38Å; L31-L39 HydrophobicContact CD2-CD2 4.36Å; L31-V50 HydrophobicContact CD1-CG1 3.43Å; L31-V50 VanDerWaalsContact CD1-CG1 3.43Å; L31-F54 HydrophobicContact CD1-CD1 4.14Å; L31-F54 HydrophobicContact CD1-CD2 3.33Å; L31-F54 HydrophobicContact CD1-CE1 4.15Å; L31-F54 HydrophobicContact CD1-CE2 3.38Å; L31-F54 HydrophobicContact CD1-CG 3.74Å; L31-F54 HydrophobicContact CD1-CZ 3.8Å; L31-F54 HydrophobicContact CD2-CD1 4.49Å; L31-F54 HydrophobicContact CD2-CE1 3.84Å; L31-F54 HydrophobicContact CD2-CE2 4.02Å; L31-F54 HydrophobicContact CD2-CZ 3.57Å; L31-F54 HydrophobicContact CG-CD1 3.73Å; L31-F54 HydrophobicContact CG-CD2 3.87Å; L31-F54 HydrophobicContact CG-CE1 3.57Å; L31-F54 HydrophobicContact CG-CE2 3.75Å; L31-F54 HydrophobicContact CG-CG 3.87Å; L31-F54 HydrophobicContact CG-CZ 3.58Å
32	T	98	Very high	98	Very high	82 Å²	82	88.5 Å²	88.5	50%	0.503	39%	0.392	S	S	.	.			trans	-72.8	165.4	161.7	66.8	0	0	0	0	110.6	R35 R36	T32-R35 PolarHBondContact OG1-N 2.91Å; T32-R36 WeakPolarHBondContact O-CB 3.43Å; T32-R36 PolarHBondContact O-N 3.32Å
33	R	97.9	Very high	98	Very high	157 Å²	157	86.3 Å²	86.3	59%	0.592	38%	0.383	S	S	*	.	H	α-helix	trans	-59.9	-48	177.1	178	159.8	177.7	63.4	-5.4	112	R35 R36 I37 E47	R33-R35 PolarHBondContact O-N 3.05Å; R33-R36 WeakPolarHBondContact O-CB 3.48Å; R33-R36 PolarHBondContact O-N 3.24Å; R33-I37 HydrophobicContact CG-CD1 4.22Å; R33-I37 WeakPolarHBondContact O-CG1 3.45Å; R33-I37 PolarHBondContact O-N 2.95Å; R33-E47 IonicContact NH1-OE2 3.08Å; R33-E47 PolarHBondContact NH1-OE2 3.36Å; R33-E47 VanDerWaalsContact NH1-OE2 3.08Å
34	R	98	Very high	97.9	Very high	190 Å²	190	83.4 Å²	83.4	72%	0.717	39%	0.387	S	S	*	.	H	α-helix	trans	-58.7	-49.6	179.4	-174.5	168.9	75.6	-171.8	1.8	111.5	R36 I37 E38	R34-R36 VanDerWaalsContact C-N 3.28Å; R34-R36 PolarHBondContact O-N 2.79Å; R34-I37 PolarHBondContact O-N 2.94Å; R34-I37 VanDerWaalsContact O-N 3.11Å; R34-E38 WeakPolarHBondContact CG-OE1 3.45Å; R34-E38 IonicContact NE-OE1 3.87Å; R34-E38 PolarHBondContact O-N 3.08Å; R34-E38 VanDerWaalsContact O-N 3.15Å
35	R	98.2	Very high	97.9	Very high	79 Å²	79	83 Å²	83	30%	0.298	39%	0.386	S	S	.	.	H	α-helix	trans	-63.9	-34.7	-179.1	-169.9	63.6	-171.4	148.1	-1.3	112.7	E24 L31 T32 R33 I37 E38 L39	E24-R35 IonicContact OE1-CZ 3.82Å; E24-R35 IonicContact OE1-NE 3.78Å; E24-R35 IonicContact OE1-NH2 3.4Å; E24-R35 PolarHBondContact OE1-NH2 3.46Å; E24-R35 IonicContact OE2-CZ 3.94Å; E24-R35 IonicContact OE2-NE 3.61Å; E24-R35 PolarHBondContact OE2-NE 3.22Å; E24-R35 IonicContact OE2-NH2 2.96Å; E24-R35 PolarHBondContact OE2-NH2 2.85Å; L31-R35 HydrophobicContact CD2-CB 4.23Å; L31-R35 HydrophobicContact CD2-CG 3.75Å; T32-R35 PolarHBondContact OG1-N 2.91Å; R33-R35 PolarHBondContact O-N 3.05Å; R35-I37 VanDerWaalsContact C-N 3.31Å; R35-I37 PolarHBondContact O-N 3.3Å; R35-E38 WeakPolarHBondContact CD-OE2 3.4Å; R35-E38 IonicContact CZ-OE2 3.7Å; R35-E38 IonicContact NH1-OE2 2.78Å; R35-E38 PolarHBondContact NH1-OE2 3.29Å; R35-E38 PolarHBondContact O-N 3.46Å; R35-L39 VanDerWaalsContact O-CB 3.26Å; R35-L39 WeakPolarHBondContact O-CB 3.44Å; R35-L39 PolarHBondContact O-N 3.21Å
36	R	98.5	Very high	97.9	Very high	56 Å²	56	86.6 Å²	86.6	21%	0.211	41%	0.409	C	S	.	.	H	α-helix	trans	-59.7	-42.2	175	-170.7	-166	-52.8	164.1	5	112	L31 T32 R33 R34 A40 E47 V50	L31-R36 HydrophobicContact CD1-CB 4.39Å; L31-R36 HydrophobicContact CD1-CG 4.46Å; T32-R36 WeakPolarHBondContact O-CB 3.43Å; T32-R36 PolarHBondContact O-N 3.32Å; R33-R36 WeakPolarHBondContact O-CB 3.48Å; R33-R36 PolarHBondContact O-N 3.24Å; R34-R36 VanDerWaalsContact C-N 3.28Å; R34-R36 PolarHBondContact O-N 2.79Å; R36-A40 WeakPolarHBondContact O-CB 3.41Å; R36-A40 PolarHBondContact O-N 2.96Å; R36-E47 HydrophobicContact CG-CB 4.15Å; R36-E47 HydrophobicContact CG-CG 4.22Å; R36-V50 HydrophobicContact CG-CG1 4.39Å
37	I	98.6	Very high	97.9	Very high	59 Å²	59	82.5 Å²	82.5	30%	0.303	39%	0.391	S	S	.	.	H	α-helix	trans	-66.2	-50.1	179.4	-63.9	164.2	0	0	0	109.9	R33 R34 R35 L39 A40 Q41 E47	R33-I37 HydrophobicContact CG-CD1 4.22Å; R33-I37 WeakPolarHBondContact O-CG1 3.45Å; R33-I37 PolarHBondContact O-N 2.95Å; R34-I37 PolarHBondContact O-N 2.94Å; R34-I37 VanDerWaalsContact O-N 3.11Å; R35-I37 VanDerWaalsContact C-N 3.31Å; R35-I37 PolarHBondContact O-N 3.3Å; I37-L39 PolarHBondContact O-N 3.44Å; I37-A40 PolarHBondContact O-N 2.92Å; I37-Q41 WeakPolarHBondContact O-CG 3.45Å; I37-Q41 PolarHBondContact O-N 2.97Å; I37-Q41 VanDerWaalsContact O-N 3.1Å; I37-E47 HydrophobicContact CG1-CG 4.28Å
38	E	98.5	Very high	97.9	Very high	74 Å²	74	84.7 Å²	84.7	35%	0.346	39%	0.387	S	S	.	.	H	α-helix	trans	-57.8	-47.4	178.6	-67.4	167.6	-171.9	0	0	111.8	R34 R35 Q41 Y42	R34-E38 WeakPolarHBondContact CG-OE1 3.45Å; R34-E38 IonicContact NE-OE1 3.87Å; R34-E38 PolarHBondContact O-N 3.08Å; R34-E38 VanDerWaalsContact O-N 3.15Å; R35-E38 WeakPolarHBondContact CD-OE2 3.4Å; R35-E38 IonicContact CZ-OE2 3.7Å; R35-E38 IonicContact NH1-OE2 2.78Å; R35-E38 PolarHBondContact NH1-OE2 3.29Å; R35-E38 PolarHBondContact O-N 3.46Å; E38-Q41 PolarHBondContact O-N 3.27Å; E38-Y42 WeakPolarHBondContact O-CB 3.48Å; E38-Y42 PolarHBondContact O-N 3.09Å
39	L	98.3	Very high	98	Very high	1 Å²	1	83.2 Å²	83.2	1%	0.005	38%	0.378	C	S	.	.	H	α-helix	trans	-67	-41.9	-178	-169.5	56.9	0	0	0	111.4	L21 E24 L31 R35 I37 Q41 Y42 V43 V50 F54	L21-L39 HydrophobicContact CD2-CD2 3.83Å; L21-L39 HydrophobicContact CD2-CG 4.21Å; E24-L39 HydrophobicContact CB-CD2 3.93Å; E24-L39 HydrophobicContact CG-CD1 3.63Å; E24-L39 HydrophobicContact CG-CD2 3.78Å; E24-L39 HydrophobicContact CG-CG 4.33Å; L31-L39 HydrophobicContact CD1-CD2 4.38Å; L31-L39 HydrophobicContact CD2-CD2 4.36Å; R35-L39 VanDerWaalsContact O-CB 3.26Å; R35-L39 WeakPolarHBondContact O-CB 3.44Å; R35-L39 PolarHBondContact O-N 3.21Å; I37-L39 PolarHBondContact O-N 3.44Å; L39-Q41 VanDerWaalsContact C-N 3.34Å; L39-Q41 PolarHBondContact O-N 2.84Å; L39-Y42 PolarHBondContact O-N 3Å; L39-V43 HydrophobicContact CD1-CG1 3.96Å; L39-V43 HydrophobicContact CG-CG1 4.47Å; L39-V43 WeakPolarHBondContact O-CG2 3.48Å; L39-V43 PolarHBondContact O-N 3.48Å; L39-V50 HydrophobicContact CD2-CG1 4.05Å; L39-F54 HydrophobicContact CD2-CE2 3.85Å; L39-F54 HydrophobicContact CD2-CZ 4.29Å
40	A	98.4	Very high	98	Very high	7 Å²	7	77.4 Å²	77.4	6%	0.058	36%	0.356	C	S	.	.	H	α-helix	trans	-56.4	-46.9	176.6	0	0	0	0	0	112	R36 I37 G44 L45 E47 V50	R36-A40 WeakPolarHBondContact O-CB 3.41Å; R36-A40 PolarHBondContact O-N 2.96Å; I37-A40 PolarHBondContact O-N 2.92Å; A40-G44 PolarHBondContact O-N 3.35Å; A40-G44 VanDerWaalsContact O-N 3.08Å; A40-L45 CarbonylContact C-O 2.97Å; A40-L45 WeakPolarHBondContact CA-O 3.42Å; A40-L45 VanDerWaalsContact CB-O 3.24Å; A40-L45 WeakPolarHBondContact CB-O 3.44Å; A40-L45 PolarHBondContact O-N 3.08Å; A40-L45 VanDerWaalsContact O-O 3.05Å; A40-E47 HydrophobicContact CB-CG 4.27Å; A40-V50 HydrophobicContact CB-CG2 4.11Å
41	Q	98.3	Very high	98	Very high	152 Å²	152	76.3 Å²	76.3	71%	0.71	35%	0.354	S	S	*	.	H	α-helix	trans	-63.1	-43.3	175.8	-70	174.1	-23.2	0	0	111.7	I37 E38 L39	I37-Q41 WeakPolarHBondContact O-CG 3.45Å; I37-Q41 PolarHBondContact O-N 2.97Å; I37-Q41 VanDerWaalsContact O-N 3.1Å; E38-Q41 PolarHBondContact O-N 3.27Å; L39-Q41 VanDerWaalsContact C-N 3.34Å; L39-Q41 PolarHBondContact O-N 2.84Å
42	Y	98.1	Very high	97.9	Very high	156 Å²	156	77.3 Å²	77.3	61%	0.612	36%	0.359	S	S	*	.	H	α-helix	trans	-67.1	-43.1	-177.4	-175.5	-115.5	0	0	0	113.5	E20 E38 L39	E20-Y42 HydrophobicContact CB-CD1 4.44Å; E20-Y42 HydrophobicContact CB-CE1 4.21Å; E20-Y42 HydrophobicContact CG-CD1 4.31Å; E20-Y42 HydrophobicContact CG-CE1 3.65Å; E38-Y42 WeakPolarHBondContact O-CB 3.48Å; E38-Y42 PolarHBondContact O-N 3.09Å; L39-Y42 PolarHBondContact O-N 3Å
43	V	97.7	Very high	97.9	Very high	14 Å²	14	74.9 Å²	74.9	9%	0.085	34%	0.341	C	S	.	.	H	α-helix	trans	-88.7	-5.1	-179	-54.1	0	0	0	0	114	Q17 E20 L39 L45 V50	Q17-V43 PolarHBondContact NE2-O 3.48Å; E20-V43 HydrophobicContact CB-CG1 3.74Å; L39-V43 HydrophobicContact CD1-CG1 3.96Å; L39-V43 HydrophobicContact CG-CG1 4.47Å; L39-V43 WeakPolarHBondContact O-CG2 3.48Å; L39-V43 PolarHBondContact O-N 3.48Å; V43-L45 HydrophobicContact CG2-CB 3.83Å; V43-L45 HydrophobicContact CG2-CD1 3.82Å; V43-L45 HydrophobicContact CG2-CG 3.72Å; V43-V50 HydrophobicContact CG2-CG2 4.42Å
44	G	97.7	Very high	98	Very high	61 Å²	61	67.6 Å²	67.6	63%	0.629	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	38.9	-177.1	0	0	0	0	0	113.6	A40	A40-G44 PolarHBondContact O-N 3.35Å; A40-G44 VanDerWaalsContact O-N 3.08Å
45	L	97.1	Very high	97.9	Very high	16 Å²	16	61.9 Å²	61.9	8%	0.084	30%	0.295	C	S	.	.			trans	-122.2	160.8	176.3	-64.1	-179.8	0	0	0	110.6	Y13 L21 A40 V43 Q49 V50	Y13-L45 HydrophobicContact CD1-CD1 3.82Å; Y13-L45 HydrophobicContact CD1-CD2 3.76Å; Y13-L45 HydrophobicContact CD1-CG 4.46Å; Y13-L45 HydrophobicContact CE1-CD1 3.71Å; Y13-L45 HydrophobicContact CE1-CD2 3.66Å; Y13-L45 HydrophobicContact CE1-CG 4.36Å; Y13-L45 HydrophobicContact CG-CD1 4.36Å; L21-L45 HydrophobicContact CD1-CD1 4.18Å; A40-L45 CarbonylContact C-O 2.97Å; A40-L45 WeakPolarHBondContact CA-O 3.42Å; A40-L45 VanDerWaalsContact CB-O 3.24Å; A40-L45 WeakPolarHBondContact CB-O 3.44Å; A40-L45 PolarHBondContact O-N 3.08Å; A40-L45 VanDerWaalsContact O-O 3.05Å; V43-L45 HydrophobicContact CG2-CB 3.83Å; V43-L45 HydrophobicContact CG2-CD1 3.82Å; V43-L45 HydrophobicContact CG2-CG 3.72Å; L45-Q49 HydrophobicContact CB-CB 4.24Å; L45-V50 HydrophobicContact CB-CG2 4.1Å
46	T	97.9	Very high	97.9	Very high	79 Å²	79	62.7 Å²	62.7	49%	0.485	31%	0.305	S	S	.	.			trans	-73.1	151.5	172.4	62.9	0	0	0	0	111.7	R48 Q49 V50	T46-R48 PolarHBondContact O-N 3.21Å; T46-R48 VanDerWaalsContact O-N 3.09Å; T46-Q49 WeakPolarHBondContact O-CB 3.39Å; T46-Q49 PolarHBondContact O-N 3.42Å; T46-Q49 WeakPolarHBondContact OG1-CB 3.39Å; T46-Q49 VanDerWaalsContact OG1-CG 3.28Å; T46-Q49 WeakPolarHBondContact OG1-CG 3.41Å; T46-Q49 PolarHBondContact OG1-N 3.25Å; T46-Q49 PolarHBondContact OG1-OE1 3.34Å; T46-V50 PolarHBondContact O-N 3.01Å
47	E	98.4	Very high	97.9	Very high	68 Å²	68	61.6 Å²	61.6	32%	0.318	30%	0.301	S	S	.	.	H	α-helix	trans	-50.9	-36.7	173.1	-75.9	-173.9	-104.1	0	0	112.4	R33 R36 I37 A40 K51	R33-E47 IonicContact NH1-OE2 3.08Å; R33-E47 PolarHBondContact NH1-OE2 3.36Å; R33-E47 VanDerWaalsContact NH1-OE2 3.08Å; R36-E47 HydrophobicContact CG-CB 4.15Å; R36-E47 HydrophobicContact CG-CG 4.22Å; I37-E47 HydrophobicContact CG1-CG 4.28Å; A40-E47 HydrophobicContact CB-CG 4.27Å; E47-K51 WeakPolarHBondContact O-CB 3.36Å; E47-K51 PolarHBondContact O-N 3.37Å
48	R	97.4	Very high	97.8	Very high	157 Å²	157	61.7 Å²	61.7	59%	0.592	30%	0.297	S	S	*	.	H	α-helix	trans	-64.8	-46.6	177.4	-177	179.7	-177	-83.5	-2.6	111.7	T46 K51 I52	T46-R48 PolarHBondContact O-N 3.21Å; T46-R48 VanDerWaalsContact O-N 3.09Å; R48-K51 PolarHBondContact O-N 3.07Å; R48-I52 HydrophobicContact CG-CD1 3.97Å; R48-I52 VanDerWaalsContact NH1-CD1 3.34Å; R48-I52 WeakPolarHBondContact O-CG1 3.36Å; R48-I52 PolarHBondContact O-N 3.11Å
49	Q	97.3	Very high	97.7	Very high	47 Å²	47	62.1 Å²	62.1	22%	0.22	30%	0.301	C	S	.	.	H	α-helix	trans	-61.4	-44.7	177.5	-78.3	164.7	-45.5	0	0	111.2	L45 T46 K51 I52 W53	L45-Q49 HydrophobicContact CB-CB 4.24Å; T46-Q49 WeakPolarHBondContact O-CB 3.39Å; T46-Q49 PolarHBondContact O-N 3.42Å; T46-Q49 WeakPolarHBondContact OG1-CB 3.39Å; T46-Q49 VanDerWaalsContact OG1-CG 3.28Å; T46-Q49 WeakPolarHBondContact OG1-CG 3.41Å; T46-Q49 PolarHBondContact OG1-N 3.25Å; T46-Q49 PolarHBondContact OG1-OE1 3.34Å; Q49-K51 PolarHBondContact O-N 3.24Å; Q49-I52 PolarHBondContact O-N 3.44Å; Q49-W53 WeakPolarHBondContact O-CB 2.83Å; Q49-W53 PolarHBondContact O-N 3.23Å
50	V	97.9	Very high	97.6	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-61.1	-44.5	175.5	178.2	0	0	0	0	110.9	L21 L31 R36 L39 A40 V43 L45 T46 I52 W53 F54	L21-V50 HydrophobicContact CD2-CG1 4.2Å; L21-V50 HydrophobicContact CD2-CG2 4.45Å; L31-V50 HydrophobicContact CD1-CG1 3.43Å; L31-V50 VanDerWaalsContact CD1-CG1 3.43Å; R36-V50 HydrophobicContact CG-CG1 4.39Å; L39-V50 HydrophobicContact CD2-CG1 4.05Å; A40-V50 HydrophobicContact CB-CG2 4.11Å; V43-V50 HydrophobicContact CG2-CG2 4.42Å; L45-V50 HydrophobicContact CB-CG2 4.1Å; T46-V50 PolarHBondContact O-N 3.01Å; V50-I52 PolarHBondContact O-N 3.01Å; V50-W53 PolarHBondContact O-N 2.67Å; V50-F54 HydrophobicContact CG1-CD2 4.05Å; V50-F54 HydrophobicContact CG1-CE2 4.24Å; V50-F54 WeakPolarHBondContact O-CD2 3.33Å; V50-F54 PolarHBondContact O-N 2.76Å
51	K	97.6	Very high	97.5	Very high	117 Å²	117	70.9 Å²	70.9	51%	0.509	34%	0.335	S	S	.	.	H	α-helix	trans	-58.2	-47	176.2	-176.4	-178.2	178.4	-176.7	0	111.8	E47 R48 Q49 F54 Q55	E47-K51 WeakPolarHBondContact O-CB 3.36Å; E47-K51 PolarHBondContact O-N 3.37Å; R48-K51 PolarHBondContact O-N 3.07Å; Q49-K51 PolarHBondContact O-N 3.24Å; K51-F54 PolarHBondContact O-N 3.15Å; K51-Q55 PolarHBondContact O-N 3.45Å; K51-Q55 VanDerWaalsContact O-N 3.08Å
52	I	97.1	Very high	97.3	Very high	52 Å²	52	69.2 Å²	69.2	27%	0.267	33%	0.326	S	S	.	.	H	α-helix	trans	-65.2	-42.2	178.4	-69.5	168.5	0	0	0	110.8	R48 Q49 V50 F54 Q55 N56	R48-I52 HydrophobicContact CG-CD1 3.97Å; R48-I52 VanDerWaalsContact NH1-CD1 3.34Å; R48-I52 WeakPolarHBondContact O-CG1 3.36Å; R48-I52 PolarHBondContact O-N 3.11Å; Q49-I52 PolarHBondContact O-N 3.44Å; V50-I52 PolarHBondContact O-N 3.01Å; I52-F54 PolarHBondContact O-N 3.31Å; I52-Q55 WeakPolarHBondContact O-CB 3.43Å; I52-Q55 PolarHBondContact O-N 2.91Å; I52-N56 PolarHBondContact O-N 3.22Å
53	W	98	Very high	97	Very high	31 Å²	31	69.2 Å²	69.2	12%	0.117	33%	0.329	C	S	.	.	H	α-helix	trans	-59.8	-47.1	177.6	-173.8	98.6	0	0	0	111.1	Y13 L21 E22 F25 Q49 V50 Q55 N56 R57	Y13-W53 AromaticContact CD2-CD1 3.83Å; Y13-W53 AromaticContact CE2-CD1 3.67Å; Y13-W53 HydrophobicContact CE2-CG 4.47Å; L21-W53 VanDerWaalsContact C-CH2 3.45Å; L21-W53 HydrophobicContact CB-CD2 3.91Å; L21-W53 HydrophobicContact CB-CE3 3.89Å; L21-W53 HydrophobicContact CB-CH2 3.64Å; L21-W53 HydrophobicContact CB-CZ2 3.63Å; L21-W53 HydrophobicContact CB-CZ3 3.76Å; L21-W53 HydrophobicContact CD1-CD2 3.84Å; L21-W53 HydrophobicContact CD1-CE3 4.47Å; L21-W53 HydrophobicContact CD1-CG 3.81Å; L21-W53 HydrophobicContact CD2-CD2 4.44Å; L21-W53 HydrophobicContact CD2-CE3 4.3Å; L21-W53 HydrophobicContact CG-CD2 4.29Å; L21-W53 HydrophobicContact CG-CE3 4.46Å; L21-W53 WeakPolarHBondContact O-CH2 3.47Å; L21-W53 WeakPolarHBondContact O-CZ3 3.42Å; E22-W53 HydrophobicContact CG-CH2 4.07Å; E22-W53 HydrophobicContact CG-CZ2 4.01Å; F25-W53 HydrophobicContact CB-CH2 4.22Å; F25-W53 HydrophobicContact CB-CZ3 4.08Å; Q49-W53 WeakPolarHBondContact O-CB 2.83Å; Q49-W53 PolarHBondContact O-N 3.23Å; V50-W53 PolarHBondContact O-N 2.67Å; W53-Q55 VanDerWaalsContact C-N 3.29Å; W53-Q55 PolarHBondContact O-N 2.78Å; W53-N56 PolarHBondContact O-N 2.88Å; W53-R57 HydrophobicContact CD2-CB 4.43Å; W53-R57 HydrophobicContact CE3-CB 4Å; W53-R57 HydrophobicContact CH2-CB 3.93Å; W53-R57 HydrophobicContact CH2-CG 3.72Å; W53-R57 HydrophobicContact CZ2-CB 4.38Å; W53-R57 HydrophobicContact CZ2-CG 4.38Å; W53-R57 HydrophobicContact CZ3-CB 3.73Å; W53-R57 HydrophobicContact CZ3-CG 3.85Å; W53-R57 WeakPolarHBondContact O-CB 3.03Å; W53-R57 PolarHBondContact O-N 3.44Å
54	F	98.5	Very high	96.8	Very high	3 Å²	3	72.7 Å²	72.7	1%	0.013	34%	0.344	C	S	.	.	H	α-helix	trans	-62.2	-36.7	177.3	-95.7	-99.7	0	0	0	112.5	L21 E24 F25 N28 L31 L39 V50 K51 I52 R58	L21-F54 HydrophobicContact CD2-CE2 4.21Å; E24-F54 HydrophobicContact CB-CZ 4.06Å; F25-F54 HydrophobicContact CB-CE1 4.25Å; F25-F54 HydrophobicContact CB-CZ 4.38Å; F25-F54 HydrophobicContact CD2-CD1 4.08Å; F25-F54 HydrophobicContact CD2-CE1 4Å; N28-F54 WeakPolarHBondContact O-CE1 3.35Å; L31-F54 HydrophobicContact CD1-CD1 4.14Å; L31-F54 HydrophobicContact CD1-CD2 3.33Å; L31-F54 HydrophobicContact CD1-CE1 4.15Å; L31-F54 HydrophobicContact CD1-CE2 3.38Å; L31-F54 HydrophobicContact CD1-CG 3.74Å; L31-F54 HydrophobicContact CD1-CZ 3.8Å; L31-F54 HydrophobicContact CD2-CD1 4.49Å; L31-F54 HydrophobicContact CD2-CE1 3.84Å; L31-F54 HydrophobicContact CD2-CE2 4.02Å; L31-F54 HydrophobicContact CD2-CZ 3.57Å; L31-F54 HydrophobicContact CG-CD1 3.73Å; L31-F54 HydrophobicContact CG-CD2 3.87Å; L31-F54 HydrophobicContact CG-CE1 3.57Å; L31-F54 HydrophobicContact CG-CE2 3.75Å; L31-F54 HydrophobicContact CG-CG 3.87Å; L31-F54 HydrophobicContact CG-CZ 3.58Å; L39-F54 HydrophobicContact CD2-CE2 3.85Å; L39-F54 HydrophobicContact CD2-CZ 4.29Å; V50-F54 HydrophobicContact CG1-CD2 4.05Å; V50-F54 HydrophobicContact CG1-CE2 4.24Å; V50-F54 WeakPolarHBondContact O-CD2 3.33Å; V50-F54 PolarHBondContact O-N 2.76Å; K51-F54 PolarHBondContact O-N 3.15Å; I52-F54 PolarHBondContact O-N 3.31Å; F54-R58 WeakPolarHBondContact O-CG 3.42Å; F54-R58 PolarHBondContact O-N 3.11Å; F54-R58 PolarHBondContact O-NH1 3.44Å
55	Q	97.5	Very high	96.3	Very high	70 Å²	70	75 Å²	75	33%	0.327	34%	0.338	S	S	.	.	H	α-helix	trans	-62.9	-51.8	173.5	-176.6	174.9	47.2	0	0	111.2	K51 I52 W53 R57 R58 M59	K51-Q55 PolarHBondContact O-N 3.45Å; K51-Q55 VanDerWaalsContact O-N 3.08Å; I52-Q55 WeakPolarHBondContact O-CB 3.43Å; I52-Q55 PolarHBondContact O-N 2.91Å; W53-Q55 VanDerWaalsContact C-N 3.29Å; W53-Q55 PolarHBondContact O-N 2.78Å; Q55-R57 VanDerWaalsContact C-N 3.31Å; Q55-R57 PolarHBondContact O-N 3.38Å; Q55-R58 PolarHBondContact O-N 3.06Å; Q55-M59 WeakPolarHBondContact O-CG 3.26Å; Q55-M59 PolarHBondContact O-N 2.99Å
56	N	97.3	Very high	95.4	Very high	96 Å²	96	82.3 Å²	82.3	51%	0.513	37%	0.369	S	S	.	.	H	α-helix	trans	-60.6	-40.5	177.9	-70.6	-18.7	0	0	0	111.9	I52 W53 M59 K60	I52-N56 PolarHBondContact O-N 3.22Å; W53-N56 PolarHBondContact O-N 2.88Å; N56-M59 WeakPolarHBondContact O-CB 3.36Å; N56-M59 PolarHBondContact O-N 3.43Å; N56-K60 PolarHBondContact O-N 3.42Å
57	R	98.1	Very high	93.8	Very high	33 Å²	33	86.3 Å²	86.3	13%	0.125	38%	0.383	C	S	.	.	H	α-helix	trans	-64	-43.5	178.2	-178.6	61.1	-170.2	116.6	-10.3	111.8	F25 W53 Q55 M59 K60 W61 E64	F25-R57 HydrophobicContact CB-CG 4.41Å; F25-R57 HydrophobicContact CD1-CG 3.76Å; F25-R57 HydrophobicContact CD2-CB 4.26Å; F25-R57 HydrophobicContact CD2-CG 3.57Å; F25-R57 HydrophobicContact CE1-CG 3.83Å; F25-R57 HydrophobicContact CE2-CB 4.28Å; F25-R57 HydrophobicContact CE2-CG 3.65Å; F25-R57 HydrophobicContact CG-CG 3.62Å; F25-R57 HydrophobicContact CZ-CG 3.79Å; W53-R57 HydrophobicContact CD2-CB 4.43Å; W53-R57 HydrophobicContact CE3-CB 4Å; W53-R57 HydrophobicContact CH2-CB 3.93Å; W53-R57 HydrophobicContact CH2-CG 3.72Å; W53-R57 HydrophobicContact CZ2-CB 4.38Å; W53-R57 HydrophobicContact CZ2-CG 4.38Å; W53-R57 HydrophobicContact CZ3-CB 3.73Å; W53-R57 HydrophobicContact CZ3-CG 3.85Å; W53-R57 WeakPolarHBondContact O-CB 3.03Å; W53-R57 PolarHBondContact O-N 3.44Å; Q55-R57 VanDerWaalsContact C-N 3.31Å; Q55-R57 PolarHBondContact O-N 3.38Å; R57-M59 VanDerWaalsContact C-N 3.31Å; R57-M59 PolarHBondContact O-N 3.08Å; R57-K60 PolarHBondContact O-N 3.19Å; R57-W61 WeakPolarHBondContact O-CB 3.28Å; R57-W61 PolarHBondContact O-N 3.3Å; R57-E64 IonicContact CZ-OE2 2.67Å; R57-E64 IonicContact NH1-OE2 3.77Å; R57-E64 PolarHBondContact NH1-OE2 2.71Å; R57-E64 IonicContact NH2-OE2 2.76Å
58	R	97.8	Very high	92.1	Very high	61 Å²	61	91.1 Å²	91.1	23%	0.23	40%	0.402	C	S	.	.	H	α-helix	trans	-60.8	-39.4	172.4	-77	-168.2	-62	-83.1	-1.9	112.1	F25 R29 F54 Q55 W61 K62	F25-R58 HydrophobicContact CE2-CG 3.81Å; F25-R58 HydrophobicContact CZ-CG 4.41Å; R29-R58 WeakPolarHBondContact O-CD 3.13Å; R29-R58 PolarHBondContact O-NH1 3.1Å; R29-R58 VanDerWaalsContact O-NH1 3.1Å; F54-R58 WeakPolarHBondContact O-CG 3.42Å; F54-R58 PolarHBondContact O-N 3.11Å; F54-R58 PolarHBondContact O-NH1 3.44Å; Q55-R58 PolarHBondContact O-N 3.06Å; R58-W61 PolarHBondContact O-N 3.49Å; R58-K62 WeakPolarHBondContact O-CB 3.42Å; R58-K62 PolarHBondContact O-N 2.88Å
59	M	96.3	Very high	90.3	Very high	84 Å²	84	92.1 Å²	92.1	41%	0.414	41%	0.414	S	S	.	.	H	α-helix	trans	-62.4	-42.7	175.6	-67.1	-57.6	-71.3	0	0	111.8	Q55 N56 R57 K63	Q55-M59 WeakPolarHBondContact O-CG 3.26Å; Q55-M59 PolarHBondContact O-N 2.99Å; N56-M59 WeakPolarHBondContact O-CB 3.36Å; N56-M59 PolarHBondContact O-N 3.43Å; R57-M59 VanDerWaalsContact C-N 3.31Å; R57-M59 PolarHBondContact O-N 3.08Å; M59-K63 WeakPolarHBondContact O-CG 3.48Å; M59-K63 PolarHBondContact O-N 3.34Å
60	K	95	Very high	88.6	Confident	118 Å²	118	95.1 Å²	95.1	51%	0.513	44%	0.438	S	S	.	.	H	α-helix	trans	-63.9	-48.2	174.4	-179.1	174.1	170.7	178.2	0	111.7	N56 R57 K62 K63 E64	N56-K60 PolarHBondContact O-N 3.42Å; R57-K60 PolarHBondContact O-N 3.19Å; K60-K62 VanDerWaalsContact C-N 3.34Å; K60-K62 PolarHBondContact O-N 3.01Å; K60-K63 WeakPolarHBondContact O-CB 3.49Å; K60-K63 PolarHBondContact O-N 2.76Å; K60-E64 WeakPolarHBondContact CE-OE1 3.28Å; K60-E64 HydrophobicContact CG-CG 4.42Å; K60-E64 WeakPolarHBondContact CG-OE1 3.39Å; K60-E64 IonicContact NZ-OE1 3.23Å; K60-E64 WeakPolarHBondContact O-CG 3.43Å; K60-E64 PolarHBondContact O-N 2.91Å
61	W	96.1	Very high	86.7	Confident	74 Å²	74	102 Å²	102	28%	0.28	47%	0.474	S	S	.	.	H	α-helix	trans	-55.7	-46.7	177.9	180	76.5	0	0	0	111.8	F25 R57 R58 K63 E64 H65	F25-W61 HydrophobicContact CE1-CB 4.25Å; F25-W61 HydrophobicContact CE1-CG 4.17Å; F25-W61 HydrophobicContact CZ-CB 3.89Å; F25-W61 AromaticContact CZ-CG 3.96Å; F25-W61 HydrophobicContact CZ-CG 3.96Å; R57-W61 WeakPolarHBondContact O-CB 3.28Å; R57-W61 PolarHBondContact O-N 3.3Å; R58-W61 PolarHBondContact O-N 3.49Å; W61-K63 VanDerWaalsContact C-N 3.27Å; W61-K63 PolarHBondContact O-N 2.88Å; W61-E64 PolarHBondContact O-N 2.86Å; W61-H65 AromaticContact CD1-CD2 3.31Å; W61-H65 AromaticContact CD1-NE2 3.34Å; W61-H65 VanDerWaalsContact CD1-NE2 3.34Å; W61-H65 AromaticContact CD2-CD2 3.88Å; W61-H65 AromaticContact CE2-CD2 3.42Å; W61-H65 VanDerWaalsContact CE2-CD2 3.42Å; W61-H65 AromaticContact CE2-NE2 3.62Å; W61-H65 AromaticContact CG-CD2 3.81Å; W61-H65 AromaticContact NE1-CD2 3.04Å; W61-H65 PolarHBondContact NE1-CD2 3.09Å; W61-H65 AromaticContact NE1-CE1 3.86Å; W61-H65 AromaticContact NE1-NE2 2.85Å; W61-H65 PolarHBondContact NE1-NE2 3.23Å; W61-H65 PolarHBondContact O-CD2 2.93Å; W61-H65 PolarHBondContact O-N 3.17Å
62	K	94.6	Very high	84.7	Confident	116 Å²	116	102.6 Å²	102.6	50%	0.504	48%	0.483	S	S	.	.	H	α-helix	trans	-59.4	-36.5	177	-172.9	178	67.4	178.5	0	113	R58 K60 K66	R58-K62 WeakPolarHBondContact O-CB 3.42Å; R58-K62 PolarHBondContact O-N 2.88Å; K60-K62 VanDerWaalsContact C-N 3.34Å; K60-K62 PolarHBondContact O-N 3.01Å; K62-K66 WeakPolarHBondContact O-CB 3.37Å; K62-K66 PolarHBondContact O-N 2.86Å
63	K	92.7	Very high	82.6	Confident	156 Å²	156	108.8 Å²	108.8	68%	0.678	51%	0.511	S	S	*	.	H	α-helix	trans	-69.6	-44.8	176.9	-69.9	-180	177.6	-171.6	0	111.3	M59 K60 W61 H65 K66	M59-K63 WeakPolarHBondContact O-CG 3.48Å; M59-K63 PolarHBondContact O-N 3.34Å; K60-K63 WeakPolarHBondContact O-CB 3.49Å; K60-K63 PolarHBondContact O-N 2.76Å; W61-K63 VanDerWaalsContact C-N 3.27Å; W61-K63 PolarHBondContact O-N 2.88Å; K63-H65 VanDerWaalsContact C-N 3.27Å; K63-H65 PolarHBondContact O-N 3.08Å; K63-K66 PolarHBondContact O-N 2.78Å
64	E	92.1	Very high	80.3	Confident	88 Å²	88	116.4 Å²	116.4	41%	0.411	55%	0.545	S	S	.	.	H	α-helix	trans	-61.7	-34.2	179.1	-68.3	166.3	162.4	0	0	112.4	R57 K60 W61	R57-E64 IonicContact CZ-OE2 2.67Å; R57-E64 IonicContact NH1-OE2 3.77Å; R57-E64 PolarHBondContact NH1-OE2 2.71Å; R57-E64 IonicContact NH2-OE2 2.76Å; K60-E64 WeakPolarHBondContact CE-OE1 3.28Å; K60-E64 HydrophobicContact CG-CG 4.42Å; K60-E64 WeakPolarHBondContact CG-OE1 3.39Å; K60-E64 IonicContact NZ-OE1 3.23Å; K60-E64 WeakPolarHBondContact O-CG 3.43Å; K60-E64 PolarHBondContact O-N 2.91Å; W61-E64 PolarHBondContact O-N 2.86Å
65	H	88.1	Confident	78.1	Confident	109 Å²	109	122.4 Å²	122.4	51%	0.505	57%	0.573	S	S	.	*	H	α-helix	trans	-90.1	-11.9	-177.6	-77.8	-82.7	0	0	0	115.2	W61 K63 Q67	W61-H65 AromaticContact CD1-CD2 3.31Å; W61-H65 AromaticContact CD1-NE2 3.34Å; W61-H65 VanDerWaalsContact CD1-NE2 3.34Å; W61-H65 AromaticContact CD2-CD2 3.88Å; W61-H65 AromaticContact CE2-CD2 3.42Å; W61-H65 VanDerWaalsContact CE2-CD2 3.42Å; W61-H65 AromaticContact CE2-NE2 3.62Å; W61-H65 AromaticContact CG-CD2 3.81Å; W61-H65 AromaticContact NE1-CD2 3.04Å; W61-H65 PolarHBondContact NE1-CD2 3.09Å; W61-H65 AromaticContact NE1-CE1 3.86Å; W61-H65 AromaticContact NE1-NE2 2.85Å; W61-H65 PolarHBondContact NE1-NE2 3.23Å; W61-H65 PolarHBondContact O-CD2 2.93Å; W61-H65 PolarHBondContact O-N 3.17Å; K63-H65 VanDerWaalsContact C-N 3.27Å; K63-H65 PolarHBondContact O-N 3.08Å; H65-Q67 VanDerWaalsContact C-N 3.33Å
66	K	77.4	Confident	75.5	Confident	169 Å²	169	123 Å²	123	74%	0.735	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	6.9	-178.9	-164	160.6	-179	-173.1	0	113.7	K62 K63	K62-K66 WeakPolarHBondContact O-CB 3.37Å; K62-K66 PolarHBondContact O-N 2.86Å; K63-K66 PolarHBondContact O-N 2.78Å
67	Q	65.3	Low	72.9	Confident	163 Å²	163	123.7 Å²	123.7	76%	0.762	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.9	23.2	-175.1	-63	-68.6	-85.5	0	0	113	H65	H65-Q67 VanDerWaalsContact C-N 3.33Å
68	K	62.2	Low	70.4	Confident	169 Å²	169	125 Å²	125	74%	0.735	60%	0.597	S	S	*	*			trans	-119.4	43.7	178.7	-68.8	-169.9	176.9	-173.2	0	113	P70	K68-P70 WeakPolarHBondContact O-CD 3.24Å
69	E	60.3	Low	68.3	Low	178 Å²	178	130.8 Å²	130.8	83%	0.832	63%	0.627	S	S	*	*			trans	-90.7	108.2	152.6	-68.8	-63.3	136.8	0	0	105.9	D71	E69-D71 PolarHBondContact O-N 3.18Å
70	P	61.4	Low	66	Low	111 Å²	111	134.1 Å²	134.1	72%	0.721	64%	0.641	S	S	*	*			trans	-73.1	104.2	170	29.2	-29	0	0	0	108.2	K68 D72	K68-P70 WeakPolarHBondContact O-CD 3.24Å; P70-D72 PolarHBondContact O-N 3.05Å
71	D	57.7	Low	63.9	Low	143 Å²	143	134.3 Å²	134.3	77%	0.765	65%	0.648	S	S	*	*			trans	-63.6	124.5	162.9	-156.7	25.5	0	0	0	108.2	E69	E69-D71 PolarHBondContact O-N 3.18Å
72	D	54.9	Low	62.1	Low	131 Å²	131	138.6 Å²	138.6	70%	0.701	68%	0.676	S	S	*	*			trans	59.6	89	162.3	-67.1	-41	0	0	0	120.3	P70	P70-D72 PolarHBondContact O-N 3.05Å
73	Q	53.8	Low	59.7	Low	182 Å²	182	138.7 Å²	138.7	85%	0.85	69%	0.689	S	S	*	*			trans	-81.4	103.4	146.5	-70.4	-175.3	5.4	0	0	109.5
74	K	49.7	Very low	57.6	Low	190 Å²	190	136 Å²	136	83%	0.826	70%	0.696	S	S	*	*			trans	-111	117.9	167.5	-137.6	175.6	-170.3	176.2	0	108.4
75	Q	51.3	Low	55.5	Low	129 Å²	129	138.8 Å²	138.8	60%	0.603	71%	0.714	S	S	*	*			trans	-104.7	121.7	-172.8	-85.7	-169.3	-36.4	0	0	112.3	T96	Q75-T96 CarbonylContact C-O 2.99Å; Q75-T96 HydrophobicContact CB-CG2 3.43Å; Q75-T96 VanDerWaalsContact CB-CG2 3.43Å; Q75-T96 VanDerWaalsContact CG-CB 3.45Å; Q75-T96 HydrophobicContact CG-CG2 3.13Å; Q75-T96 WeakPolarHBondContact CG-OG1 3.37Å
76	P	44.3	Very low	53.7	Low	82 Å²	82	138.9 Å²	138.9	53%	0.532	72%	0.722	S	S	.	*			trans	-142.9	90.8	162.7	44.1	-39.9	0	0	0	124.4	T95 T96	P76-T95 CarbonylContact C-O 3.21Å; P76-T96 VanDerWaalsContact C-C 3.46Å; P76-T96 CarbonylContact C-O 2.63Å; P76-T96 WeakPolarHBondContact CA-O 3.41Å
77	E	42.2	Very low	52.2	Low	112 Å²	112	135.8 Å²	135.8	52%	0.523	72%	0.721	S	S	.	*			trans	-171	115.3	174.1	-93.8	-179.3	110.2	0	0	115.4	T95 T96 L97	E77-T95 WeakPolarHBondContact CA-O 3.2Å; E77-T95 WeakPolarHBondContact CB-O 3.47Å; E77-T95 WeakPolarHBondContact CG-O 3.43Å; E77-T95 PolarHBondContact N-O 2.95Å; E77-T95 VanDerWaalsContact OE2-CA 3.23Å; E77-T95 WeakPolarHBondContact OE2-CA 3.32Å; E77-T95 PolarHBondContact OE2-N 3.43Å; E77-T96 PolarHBondContact N-O 3.04Å; E77-T96 CarbonylContact O-C 3.33Å; E77-T96 PolarHBondContact OE2-N 3.42Å; E77-L97 VanDerWaalsContact N-CG 3.28Å; E77-L97 WeakPolarHBondContact O-CA 3.44Å; E77-L97 WeakPolarHBondContact O-CB 3.41Å; E77-L97 PolarHBondContact O-N 2.95Å
78	S	44.9	Very low	51.4	Low	61 Å²	61	134.6 Å²	134.6	43%	0.427	73%	0.725	S	S	.	*			trans	-176.5	81.3	138.7	51.6	0	0	0	0	110.2	L97	S78-L97 WeakPolarHBondContact CB-O 3.41Å; S78-L97 VanDerWaalsContact OG-CB 3.31Å; S78-L97 WeakPolarHBondContact OG-CB 3.37Å; S78-L97 PolarHBondContact OG-O 3.15Å
79	Q	54	Low	50.7	Low	181 Å²	181	133.5 Å²	133.5	85%	0.846	73%	0.727	S	S	*	*			trans	-115.6	139.1	138.5	-67.2	175.8	-65.6	0	0	102.8
80	E	47.7	Very low	50.1	Low	154 Å²	154	131.4 Å²	131.4	72%	0.72	73%	0.726	S	S	*	*			cis	-173.4	149.6	25.6	-131.6	-173.3	121.6	0	0	106.6
81	N	50.7	Low	49.6	Very low	122 Å²	122	133.5 Å²	133.5	65%	0.652	73%	0.732	S	S	*	*			trans	80	111.9	142	-54.1	-27	0	0	0	125
82	N	58	Low	48.4	Very low	164 Å²	164	132 Å²	132	88%	0.877	73%	0.731	S	S	*	*			trans	52.5	135.9	130.4	-96.8	-26.1	0	0	0	123.3
83	P	45.3	Very low	48	Very low	118 Å²	118	130.9 Å²	130.9	77%	0.766	73%	0.733	S	S	*	*			trans	-101.3	127	-170.2	37.6	-27.3	0	0	0	113.1
84	A	49.2	Very low	47.6	Very low	100 Å²	100	127 Å²	127	83%	0.826	73%	0.726	S	S	*	*			trans	178.9	147.4	147.9	0	0	0	0	0	109.6
85	N	47.5	Very low	47.5	Very low	146 Å²	146	120.9 Å²	120.9	78%	0.781	71%	0.705	S	S	*	*			trans	96.4	92.5	156.8	-154.9	27	0	0	0	118.2
86	V	50.4	Low	47.4	Very low	112 Å²	112	117 Å²	117	68%	0.679	69%	0.69	S	S	*	*				52.5	120.1	127.6	101.1	0	0	0	0	120.2
87	S	46.4	Very low	47.8	Very low	104 Å²	104	117.3 Å²	117.3	73%	0.727	69%	0.687	S	S	*	*			trans	22.2	107.2	148.2	-52.2	0	0	0	0	118.7
88	T	46.6	Very low	48.1	Very low	138 Å²	138	117.4 Å²	117.4	85%	0.847	70%	0.695	S	S	*	*			trans	-164.1	149.9	140	-74.1	0	0	0	0	110
89	L	48.4	Very low	48.5	Very low	146 Å²	146	118.2 Å²	118.2	76%	0.764	71%	0.705	S	S	*	*			trans	-56	166.5	-166.6	-60.9	96.4	0	0	0	117.7
90	T	48.7	Very low	48.8	Very low	133 Å²	133	114.4 Å²	114.4	82%	0.816	70%	0.698	S	S	*	*			trans	87.3	102	141	20	0	0	0	0	120.8
91	N	49.2	Very low	49.4	Very low	156 Å²	156	114.2 Å²	114.2	83%	0.834	70%	0.702	S	S	*	*			trans	43.3	127.1	132.4	-123	42.6	0	0	0	123
92	C	33.3	Very low	49.7	Very low	110 Å²	110	113.4 Å²	113.4	74%	0.743	71%	0.713	S	S	*	*			trans	116	114.7	130.8	85.3	0	0	0	0	121.2
93	S	45.5	Very low	49.5	Very low	108 Å²	108	112.5 Å²	112.5	76%	0.755	71%	0.713	S	S	*	*			trans	64.7	116.8	133	-53.7	0	0	0	0	125
94	S	45.7	Very low	49.9	Very low	101 Å²	101	112 Å²	112	71%	0.706	72%	0.719	S	S	*	*			trans	78	134.2	144	-47.9	0	0	0	0	116.9
95	T	47.7	Very low	50	Low	62 Å²	62	113.6 Å²	113.6	38%	0.38	72%	0.718	S	S	.	*			cis	-178.7	122.2	14.2	-7.3	0	0	0	0	109.9	P76 E77	P76-T95 CarbonylContact C-O 3.21Å; E77-T95 WeakPolarHBondContact CA-O 3.2Å; E77-T95 WeakPolarHBondContact CB-O 3.47Å; E77-T95 WeakPolarHBondContact CG-O 3.43Å; E77-T95 PolarHBondContact N-O 2.95Å; E77-T95 VanDerWaalsContact OE2-CA 3.23Å; E77-T95 WeakPolarHBondContact OE2-CA 3.32Å; E77-T95 PolarHBondContact OE2-N 3.43Å
96	T	50.4	Low	50.6	Low	47 Å²	47	116.5 Å²	116.5	29%	0.288	72%	0.724	S	S	.	*			trans	37.1	123.4	142.2	-13.9	0	0	0	0	139.8	Q75 P76 E77	Q75-T96 CarbonylContact C-O 2.99Å; Q75-T96 HydrophobicContact CB-CG2 3.43Å; Q75-T96 VanDerWaalsContact CB-CG2 3.43Å; Q75-T96 VanDerWaalsContact CG-CB 3.45Å; Q75-T96 HydrophobicContact CG-CG2 3.13Å; Q75-T96 WeakPolarHBondContact CG-OG1 3.37Å; P76-T96 VanDerWaalsContact C-C 3.46Å; P76-T96 CarbonylContact C-O 2.63Å; P76-T96 WeakPolarHBondContact CA-O 3.41Å; E77-T96 PolarHBondContact N-O 3.04Å; E77-T96 CarbonylContact O-C 3.33Å; E77-T96 PolarHBondContact OE2-N 3.42Å
97	L	51.6	Low	50.5	Low	89 Å²	89	119 Å²	119	47%	0.466	73%	0.732	S	S	.	*			trans	-162.2	143.4	161.6	-75.4	166.7	0	0	0	112.5	E77 S78	E77-L97 VanDerWaalsContact N-CG 3.28Å; E77-L97 WeakPolarHBondContact O-CA 3.44Å; E77-L97 WeakPolarHBondContact O-CB 3.41Å; E77-L97 PolarHBondContact O-N 2.95Å; S78-L97 WeakPolarHBondContact CB-O 3.41Å; S78-L97 VanDerWaalsContact OG-CB 3.31Å; S78-L97 WeakPolarHBondContact OG-CB 3.37Å; S78-L97 PolarHBondContact OG-O 3.15Å
98	V	48.8	Very low	50.3	Low	113 Å²	113	122.7 Å²	122.7	69%	0.685	74%	0.739	S	S	*	*			trans	44.8	149.9	138	-48.5	0	0	0	0	121.3
99	A	54.4	Low	50.6	Low	79 Å²	79	120 Å²	120	65%	0.653	73%	0.73	S	S	*	*			cis	-165.7	165.6	19	0	0	0	0	0	112.6
100	S	60.5	Low	50.7	Low	100 Å²	100	120.3 Å²	120.3	70%	0.699	73%	0.732	S	S	*	*			trans	78.6	141.3	142.9	-56.7	0	0	0	0	120
101	N	59.1	Low	50.8	Low	150 Å²	150	120.7 Å²	120.7	80%	0.802	73%	0.729	S	S	*	*			cis	-170.9	143	-5.6	-90.9	-24.6	0	0	0	106
102	A	57.8	Low	50.7	Low	106 Å²	106	118 Å²	118	88%	0.876	72%	0.72	S	S	*	*			trans	-170.4	141.5	145.4	0	0	0	0	0	111.9
103	V	52.9	Low	50.8	Low	145 Å²	145	123.1 Å²	123.1	88%	0.879	72%	0.724	S	S	*	*			trans	-88.4	146.1	-165.8	-70.2	0	0	0	0	112.7
104	A	54.4	Low	51	Low	107 Å²	107	125.7 Å²	125.7	88%	0.884	72%	0.724	S	S	*	*			trans	-162.2	126.7	149.4	0	0	0	0	0	110.9
105	T	51.1	Low	51	Low	134 Å²	134	125.7 Å²	125.7	82%	0.822	72%	0.72	S	S	*	*			trans	-81.2	141.4	-178.7	43.4	0	0	0	0	111.9
106	K	59.1	Low	50.6	Low	207 Å²	207	132.6 Å²	132.6	90%	0.9	74%	0.741	S	S	*	*				177.3	119.5	122.7	-107.9	177.7	174.2	178.9	0	111.6
107	L	48.5	Very low	50.1	Low	163 Å²	163	133.9 Å²	133.9	85%	0.853	76%	0.764	S	S	*	*			trans	-79.9	162.4	162	-77.8	150.5	0	0	0	110
108	E	43	Very low	49.6	Very low	183 Å²	183	134.6 Å²	134.6	86%	0.855	78%	0.782	S	S	*	*			trans	113	92.8	145.8	-142	146.1	139.5	0	0	118.8
109	A	52.1	Low	49.6	Very low	81 Å²	81	136 Å²	136	67%	0.669	79%	0.791	S	S	*	*				57.6	138.3	117.6	0	0	0	0	0	123.9
110	N	51.8	Low	49.2	Very low	152 Å²	152	137 Å²	137	81%	0.813	80%	0.799	S	S	*	*			trans	86.6	106.6	147.5	-80.8	-57.2	0	0	0	121.7
111	N	49.9	Very low	48.9	Very low	141 Å²	141	140.3 Å²	140.3	75%	0.754	81%	0.809	S	S	*	*				34.6	142	125.4	-140.1	12.5	0	0	0	118.5
112	P	47.6	Very low	48.3	Very low	99 Å²	99	139 Å²	139	64%	0.643	81%	0.812	S	S	*	*			cis	-149.8	163.5	32.7	38.4	-13.9	0	0	0	121.1	Q114	P112-Q114 PolarHBondContact O-N 3.46Å
113	R	35.9	Very low	47.4	Very low	219 Å²	219	138.3 Å²	138.3	83%	0.826	81%	0.806	S	S	*	*			trans	-21	117.8	158.6	-177.9	178.8	179.5	-170.6	-0.5	114.6
114	Q	47.7	Very low	47.2	Very low	162 Å²	162	137.2 Å²	137.2	76%	0.757	80%	0.8	S	S	*	*			trans	-123.8	129.7	158.5	-71.9	-171.2	32	0	0	110.2	P112 Y116	P112-Q114 PolarHBondContact O-N 3.46Å; Q114-Y116 HydrophobicContact CB-CE2 4.4Å
115	T	46.1	Very low	46.5	Very low	100 Å²	100	140.1 Å²	140.1	61%	0.613	80%	0.795	S	S	*	*			trans	-98.8	116	177.3	48.8	0	0	0	0	109.2
116	Y	39.7	Very low	45.9	Very low	207 Å²	207	143 Å²	143	81%	0.812	80%	0.801	S	S	*	*			trans	-150.4	121.5	157.9	-61.6	-75.5	0	0	0	104.9	Q114	Q114-Y116 HydrophobicContact CB-CE2 4.4Å
117	G	39.7	Very low	45	Very low	75 Å²	75	139.8 Å²	139.8	77%	0.773	79%	0.794	S	S	*	*				102.6	105.8	66.3	0	0	0	0	0	107.3
118	A	42.4	Very low	44.8	Very low	103 Å²	103	139.9 Å²	139.9	85%	0.851	79%	0.79	S	S	*	*			trans	-58.3	144.4	-167.7	0	0	0	0	0	115.4
119	T	47.5	Very low	45.1	Very low	142 Å²	142	136.4 Å²	136.4	87%	0.871	79%	0.786	S	S	*	*			trans	-145	131	146.7	24.5	0	0	0	0	109.7
120	A	45.8	Very low	44.8	Very low	101 Å²	101	141 Å²	141	84%	0.835	79%	0.791	S	S	*	*			trans	-70.8	129.2	-169.5	0	0	0	0	0	112.4
121	N	54.7	Low	44.4	Very low	169 Å²	169	140 Å²	140	90%	0.904	78%	0.781	S	S	*	*			trans	-105.8	129.8	157.5	-84.9	-50.9	0	0	0	109.2
122	S	46.8	Very low	44.1	Very low	123 Å²	123	137.5 Å²	137.5	86%	0.86	76%	0.764	S	S	*	*			trans	-63.1	147.9	-161.6	-159.7	0	0	0	0	114.3
123	A	38.1	Very low	44.2	Very low	92 Å²	92	141.7 Å²	141.7	76%	0.76	77%	0.772	S	S	*	*			trans	-69.7	126.7	-172.7	0	0	0	0	0	113.6
124	V	49.4	Very low	44.8	Very low	121 Å²	121	138.9 Å²	138.9	73%	0.733	77%	0.766	S	S	*	*			trans	-150.7	130.2	152.1	-163.9	0	0	0	0	108.4
125	Q	39.6	Very low	45	Very low	168 Å²	168	135.1 Å²	135.1	79%	0.785	75%	0.754	S	S	*	*			trans	80	61.5	151.3	-106.7	166.5	-64.2	0	0	119.9
126	M	38.6	Very low	45.1	Very low	195 Å²	195	136 Å²	136	96%	0.961	75%	0.754	S	S	*	*			trans	-149.1	86.6	153.2	-71.7	-166.5	174.6	0	0	111.3
127	D	39.7	Very low	45.5	Very low	139 Å²	139	135.1 Å²	135.1	74%	0.743	76%	0.755	S	S	*	*			trans	-171.8	86.3	138.2	-156.8	33.4	0	0	0	111.6
128	E	44.5	Very low	45.8	Very low	165 Å²	165	138.3 Å²	138.3	77%	0.771	76%	0.755	S	S	*	*	S	Bend	trans	-148.3	19.8	158.4	-131.4	-173.8	141.2	0	0	110.8
129	S	49.9	Very low	46.2	Very low	111 Å²	111	143.6 Å²	143.6	78%	0.776	75%	0.752	S	S	*	*	S	Bend	trans	-98.6	1.4	-172.6	-72.3	0	0	0	0	114
130	K	46.1	Very low	45.7	Very low	176 Å²	176	144.2 Å²	144.2	77%	0.765	76%	0.761	S	S	*	*	S	Bend	trans	-105.4	-14.3	175.6	-66.4	-177.8	-178.5	176.6	0	114.1
131	E	43.4	Very low	45.7	Very low	131 Å²	131	146.4 Å²	146.4	61%	0.612	76%	0.757	S	S	*	*	S	Bend	trans	-82.2	-18.5	177.2	-150.1	67.1	-161.7	0	0	113.2	K133 T135	E131-K133 PolarHBondContact O-N 3.27Å; E131-T135 PolarHBondContact O-OG1 3.11Å; E131-T135 VanDerWaalsContact O-OG1 3.05Å
132	F	43.6	Very low	45.2	Very low	90 Å²	90	145.2 Å²	145.2	40%	0.395	75%	0.749	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.5	-17.9	-169.4	-164.7	-110.8	0	0	0	114.7	L136	F132-L136 HydrophobicContact CD1-CD1 4.09Å; F132-L136 HydrophobicContact CD2-CD1 3.96Å; F132-L136 HydrophobicContact CE1-CD1 3.61Å; F132-L136 HydrophobicContact CE2-CD1 3.43Å; F132-L136 VanDerWaalsContact CE2-CD1 3.43Å; F132-L136 HydrophobicContact CG-CD1 4.26Å; F132-L136 HydrophobicContact CZ-CD1 3.26Å
133	K	49	Very low	45.1	Very low	187 Å²	187	146.4 Å²	146.4	81%	0.813	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-15.9	177.8	-70.8	-171.6	179.1	-178.4	0	114	E131	E131-K133 PolarHBondContact O-N 3.27Å
134	K	48.3	Very low	45.5	Very low	159 Å²	159	149.6 Å²	149.6	69%	0.691	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-22	173.6	-73.3	-178.3	177.7	176.7	0	113.1	N138	K134-N138 PolarHBondContact O-ND2 3.32Å
135	T	52.2	Low	45.3	Very low	83 Å²	83	151.4 Å²	151.4	51%	0.509	74%	0.743	S	S	.	*	S	Bend	trans	-98.3	-9.8	-175.7	47.2	0	0	0	0	114.5	E131	E131-T135 PolarHBondContact O-OG1 3.11Å; E131-T135 VanDerWaalsContact O-OG1 3.05Å
136	L	48.4	Very low	45.7	Very low	118 Å²	118	150.3 Å²	150.3	62%	0.618	74%	0.74	S	S	*	*	S	Bend	trans	-95.2	-8.1	176	-107.3	96.4	0	0	0	115.4	F132	F132-L136 HydrophobicContact CD1-CD1 4.09Å; F132-L136 HydrophobicContact CD2-CD1 3.96Å; F132-L136 HydrophobicContact CE1-CD1 3.61Å; F132-L136 HydrophobicContact CE2-CD1 3.43Å; F132-L136 VanDerWaalsContact CE2-CD1 3.43Å; F132-L136 HydrophobicContact CG-CD1 4.26Å; F132-L136 HydrophobicContact CZ-CD1 3.26Å
137	F	46.8	Very low	46.2	Very low	189 Å²	189	147.1 Å²	147.1	83%	0.829	72%	0.724	S	S	*	*	S	Bend	trans	-106.7	-7.8	178.1	-162.7	-100.8	0	0	0	113.9
138	N	46.4	Very low	46.7	Very low	143 Å²	143	147.7 Å²	147.7	77%	0.765	72%	0.723	S	S	*	*	S	Bend	trans	-103.8	25.5	179.4	-80.1	-58.2	0	0	0	113.8	K134	K134-N138 PolarHBondContact O-ND2 3.32Å
139	R	50.9	Low	46.8	Very low	213 Å²	213	146.3 Å²	146.3	80%	0.804	72%	0.719	S	S	*	*			trans	-126.2	76.2	176	-151.1	155.4	-173	148.8	2.9	110
140	C	37.2	Very low	46.6	Very low	155 Å²	155	149.5 Å²	149.5	100%	1.047	71%	0.713	S	S	*	*			trans	-45.7	0	140.1	-69.5	0	0	0	0	110.4

Retrieved 140 of 140 residues in 265.7 ms (Link to these results)

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