A0A077YWY3_TRITR Loading...

Homeobox domain containing protein

AlphaFold DB , UniProt , Accession A0A077YWY3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 138 aa.

						>A0A077YWY3_TRITR|A0A077YWY3
MKRKITGGSEGKRQRTAYTRSQVLELEKEFHFNRYLTRRRRIEIAQTLGLSERQVKIWFQNRRMKLKKDQKSHHTAPSYGQAGSAIINPLQMGPLAAAAMQHVGRSTGSYLFNVPYDITGNMSSSCGSINGPKLFLHE
					

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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	45.6	Very low	51.2	Low	244 Å²	244	146.9 Å²	146.9	100%	1.202	81%	0.807	S	S	*	*				0	110.9	0	-69.4	171.8	174.6	0	0	109.8
2	K	45.1	Very low	52.6	Low	217 Å²	217	151.8 Å²	151.8	94%	0.943	82%	0.815	S	S	*	*			trans	-76.4	116.7	179.2	-80.1	164.4	168.3	169.8	0	109.3	K4	K2-K4 PolarHBondContact O-N 3.47Å; K2-K4 VanDerWaalsContact O-N 3.11Å
3	R	49.3	Very low	54.4	Low	217 Å²	217	156.2 Å²	156.2	82%	0.819	81%	0.812	S	S	*	*			trans	-69.7	105.7	169.5	-77.2	-176.7	-79.3	113.7	-2.8	107.8	I5	R3-I5 VanDerWaalsContact C-N 3.34Å; R3-I5 PolarHBondContact O-N 2.81Å
4	K	52.5	Low	56.7	Low	185 Å²	185	157.2 Å²	157.2	80%	0.804	81%	0.811	S	S	*	*			trans	-61.6	97.5	168.7	-178	179.4	-95.8	-99.3	0	107.5	K2 T6	K2-K4 PolarHBondContact O-N 3.47Å; K2-K4 VanDerWaalsContact O-N 3.11Å; K4-T6 VanDerWaalsContact C-N 3.31Å; K4-T6 HydrophobicContact CD-CG2 3.84Å; K4-T6 HydrophobicContact CG-CG2 3.79Å; K4-T6 PolarHBondContact O-N 3.23Å; K4-T6 VanDerWaalsContact O-N 3.14Å
5	I	54.4	Low	58.8	Low	136 Å²	136	162.1 Å²	162.1	70%	0.697	82%	0.815	S	S	*	*			trans	-74.8	95.5	162.6	-55.7	-60.6	0	0	0	104.2	R3 G7	R3-I5 VanDerWaalsContact C-N 3.34Å; R3-I5 PolarHBondContact O-N 2.81Å; I5-G7 PolarHBondContact O-N 2.87Å
6	T	54.2	Low	61	Low	112 Å²	112	158.9 Å²	158.9	69%	0.687	81%	0.807	S	S	*	*			trans	-66.3	86.1	167.5	50	0	0	0	0	107.2	K4 G8	K4-T6 VanDerWaalsContact C-N 3.31Å; K4-T6 HydrophobicContact CD-CG2 3.84Å; K4-T6 HydrophobicContact CG-CG2 3.79Å; K4-T6 PolarHBondContact O-N 3.23Å; K4-T6 VanDerWaalsContact O-N 3.14Å; T6-G8 PolarHBondContact O-N 3.16Å
7	G	48.5	Very low	63	Low	76 Å²	76	154.8 Å²	154.8	78%	0.784	80%	0.802	S	S	*	*			trans	-77.6	32.9	167.1	0	0	0	0	0	112.2	I5	I5-G7 PolarHBondContact O-N 2.87Å
8	G	45.3	Very low	65	Low	47 Å²	47	150.1 Å²	150.1	49%	0.485	77%	0.773	S	S	.	*	S	Bend	trans	-91.5	139	174.4	0	0	0	0	0	109.6	T6 E10	T6-G8 PolarHBondContact O-N 3.16Å; G8-E10 PolarHBondContact O-N 3.06Å
9	S	58.1	Low	66.7	Low	130 Å²	130	146.3 Å²	146.3	91%	0.909	76%	0.758	S	S	*	*	S	Bend	trans	-61	24.2	-177.2	-35.2	0	0	0	0	115.4	G11	S9-G11 PolarHBondContact O-N 2.67Å
10	E	50.6	Low	68.3	Low	186 Å²	186	149.2 Å²	149.2	87%	0.869	76%	0.758	S	S	*	*	S	Bend	trans	-94.5	96.4	-179.2	-68.3	-172.1	132	0	0	109.7	G8 K12	G8-E10 PolarHBondContact O-N 3.06Å; E10-K12 PolarHBondContact O-N 3.05Å
11	G	59.4	Low	69.8	Low	66 Å²	66	146.1 Å²	146.1	68%	0.68	75%	0.75	S	S	*	*			trans	56	56.3	157.2	0	0	0	0	0	115.3	S9 R13	S9-G11 PolarHBondContact O-N 2.67Å; G11-R13 VanDerWaalsContact C-N 3.3Å; G11-R13 PolarHBondContact O-N 2.79Å
12	K	68.4	Low	72.3	Confident	206 Å²	206	136 Å²	136	90%	0.896	70%	0.7	S	S	*	*			trans	-49.5	101.4	162.7	-77.3	177.5	-174.6	168.9	0	107.3	E10 Q14	E10-K12 PolarHBondContact O-N 3.05Å; K12-Q14 PolarHBondContact O-N 3.33Å; K12-Q14 VanDerWaalsContact O-N 3.12Å
13	R	75.8	Confident	74.8	Confident	208 Å²	208	128.2 Å²	128.2	79%	0.785	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-48.4	125.1	-177	-67.7	-179.2	-179.5	-174.8	-1.9	108.1	G11 R15	G11-R13 VanDerWaalsContact C-N 3.3Å; G11-R13 PolarHBondContact O-N 2.79Å; R13-R15 PolarHBondContact O-N 3.01Å
14	Q	86.3	Confident	77.2	Confident	171 Å²	171	122.2 Å²	122.2	80%	0.799	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-51	131.7	178.5	-178.6	59.2	49.8	0	0	108.6	K12 T16	K12-Q14 PolarHBondContact O-N 3.33Å; K12-Q14 VanDerWaalsContact O-N 3.12Å; Q14-T16 PolarHBondContact O-N 3.05Å
15	R	88.6	Confident	79.4	Confident	231 Å²	231	117.1 Å²	117.1	87%	0.872	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-69.5	128.5	177.8	-65.2	-176.6	-175	-166.3	3.2	108.2	R13	R13-R15 PolarHBondContact O-N 3.01Å
16	T	93.2	Very high	81.5	Confident	110 Å²	110	110.6 Å²	110.6	68%	0.675	60%	0.6	S	S	*	*			trans	-104.9	131.3	170.7	-49	0	0	0	0	108.4	Q14	Q14-T16 PolarHBondContact O-N 3.05Å
17	A	96.2	Very high	83.6	Confident	89 Å²	89	107.3 Å²	107.3	74%	0.736	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-78.6	138.7	171.2	0	0	0	0	0	109.7
18	Y	98.1	Very high	86	Confident	71 Å²	71	109.7 Å²	109.7	28%	0.278	57%	0.565	S	S	.	*	P	Polyproline II helix	trans	-77.3	145.5	170.7	-59	-44.5	0	0	0	110	L50 Q54 W58	Y18-L50 HydrophobicContact CD1-CD1 4.36Å; Y18-L50 HydrophobicContact CD1-CD2 3.96Å; Y18-L50 HydrophobicContact CE1-CD1 4.23Å; Y18-L50 HydrophobicContact CE1-CD2 3.76Å; Y18-Q54 WeakPolarHBondContact OH-CB 3.32Å; Y18-W58 AromaticContact CD2-CD1 3.99Å; Y18-W58 AromaticContact CE2-CD1 3.76Å
19	T	98.5	Very high	88.5	Confident	78 Å²	78	108.5 Å²	108.5	48%	0.479	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-67.2	159.3	174.8	70.7	0	0	0	0	110.3	S21 Q22 V23	T19-S21 VanDerWaalsContact C-N 3.27Å; T19-S21 PolarHBondContact O-N 3.39Å; T19-Q22 WeakPolarHBondContact O-CB 3.4Å; T19-Q22 PolarHBondContact O-N 2.99Å; T19-Q22 VanDerWaalsContact O-N 3.16Å; T19-Q22 WeakPolarHBondContact OG1-CG 3.32Å; T19-Q22 PolarHBondContact OG1-N 3.34Å; T19-V23 WeakPolarHBondContact O-CG2 3.33Å; T19-V23 PolarHBondContact O-N 3.19Å
20	R	98.5	Very high	90.5	Very high	204 Å²	204	102.3 Å²	102.3	77%	0.77	50%	0.504	S	S	*	.	H	α-helix	trans	-55.3	-43.8	177.1	-175.8	174.1	179.7	-108.1	1.6	111.8	Q22 V23 L24	R20-Q22 PolarHBondContact O-N 3.29Å; R20-V23 PolarHBondContact O-N 3.04Å; R20-L24 HydrophobicContact CG-CD1 4.3Å; R20-L24 WeakPolarHBondContact O-CG 3.49Å; R20-L24 PolarHBondContact O-N 3.49Å
21	S	98.3	Very high	92.7	Very high	84 Å²	84	99.2 Å²	99.2	59%	0.587	49%	0.489	S	S	*	.	H	α-helix	trans	-62.2	-41.6	178.7	-46.4	0	0	0	0	112.2	T19 V23 L24 E25	T19-S21 VanDerWaalsContact C-N 3.27Å; T19-S21 PolarHBondContact O-N 3.39Å; S21-V23 VanDerWaalsContact C-N 3.35Å; S21-V23 PolarHBondContact O-N 3.44Å; S21-L24 PolarHBondContact O-N 3.39Å; S21-E25 PolarHBondContact O-N 3.05Å; S21-E25 VanDerWaalsContact O-N 3.13Å
22	Q	98.6	Very high	94.6	Very high	33 Å²	33	104.1 Å²	104.1	15%	0.154	49%	0.492	C	S	.	.	H	α-helix	trans	-61.4	-43.5	174.9	-73.6	172.8	-31.2	0	0	111.7	T19 R20 L26 L48	T19-Q22 WeakPolarHBondContact O-CB 3.4Å; T19-Q22 PolarHBondContact O-N 2.99Å; T19-Q22 VanDerWaalsContact O-N 3.16Å; T19-Q22 WeakPolarHBondContact OG1-CG 3.32Å; T19-Q22 PolarHBondContact OG1-N 3.34Å; R20-Q22 PolarHBondContact O-N 3.29Å; Q22-L26 WeakPolarHBondContact O-CB 3.17Å; Q22-L26 WeakPolarHBondContact O-CD1 3.38Å; Q22-L26 WeakPolarHBondContact O-CG 3.49Å; Q22-L26 PolarHBondContact O-N 3.49Å; Q22-L48 HydrophobicContact CG-CB 4.41Å; Q22-L48 PolarHBondContact NE2-O 3.21Å
23	V	98.7	Very high	96	Very high	53 Å²	53	97.9 Å²	97.9	32%	0.321	47%	0.469	S	S	.	.	H	α-helix	trans	-64.1	-42.3	177.9	176.1	0	0	0	0	111.4	T19 R20 S21 L26 E27	T19-V23 WeakPolarHBondContact O-CG2 3.33Å; T19-V23 PolarHBondContact O-N 3.19Å; R20-V23 PolarHBondContact O-N 3.04Å; S21-V23 VanDerWaalsContact C-N 3.35Å; S21-V23 PolarHBondContact O-N 3.44Å; V23-L26 PolarHBondContact O-N 3.28Å; V23-E27 HydrophobicContact CG1-CG 4.31Å; V23-E27 WeakPolarHBondContact O-CG 3.49Å; V23-E27 PolarHBondContact O-N 3.03Å
24	L	98.6	Very high	97.1	Very high	90 Å²	90	92.4 Å²	92.4	47%	0.471	45%	0.448	S	S	.	.	H	α-helix	trans	-60.9	-47.6	179.3	-73.3	174.8	0	0	0	112.2	R20 S21 E27 K28	R20-L24 HydrophobicContact CG-CD1 4.3Å; R20-L24 WeakPolarHBondContact O-CG 3.49Å; R20-L24 PolarHBondContact O-N 3.49Å; S21-L24 PolarHBondContact O-N 3.39Å; L24-E27 PolarHBondContact O-N 3.29Å; L24-K28 WeakPolarHBondContact O-CB 3.46Å; L24-K28 PolarHBondContact O-N 3.27Å
25	E	98.7	Very high	97.6	Very high	78 Å²	78	91.2 Å²	91.2	36%	0.364	44%	0.437	S	S	.	.	H	α-helix	trans	-66.8	-37.5	178	-69.3	-52.3	141.3	0	0	112.3	S21 K28 E29 L48	S21-E25 PolarHBondContact O-N 3.05Å; S21-E25 VanDerWaalsContact O-N 3.13Å; E25-K28 PolarHBondContact O-N 3.41Å; E25-K28 WeakPolarHBondContact OE2-CD 3.25Å; E25-K28 IonicContact OE2-NZ 3.7Å; E25-E29 WeakPolarHBondContact O-CG 3.42Å; E25-E29 PolarHBondContact O-N 3.12Å; E25-L48 HydrophobicContact CB-CD1 4.32Å; E25-L48 HydrophobicContact CB-CD2 3.77Å; E25-L48 HydrophobicContact CG-CD2 4.08Å
26	L	98.8	Very high	98.1	Very high	0 Å²	0	81.4 Å²	81.4	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-63.3	-41.8	174.8	-73.2	167.6	0	0	0	112.5	Q22 V23 F30 I44 L48 L50 V55 W58 F59	Q22-L26 WeakPolarHBondContact O-CB 3.17Å; Q22-L26 WeakPolarHBondContact O-CD1 3.38Å; Q22-L26 WeakPolarHBondContact O-CG 3.49Å; Q22-L26 PolarHBondContact O-N 3.49Å; V23-L26 PolarHBondContact O-N 3.28Å; L26-F30 WeakPolarHBondContact O-CB 3.35Å; L26-F30 PolarHBondContact O-N 2.87Å; L26-I44 HydrophobicContact CD2-CG2 4.05Å; L26-L48 HydrophobicContact CD1-CD1 4.4Å; L26-L48 HydrophobicContact CD2-CD1 3.87Å; L26-L48 HydrophobicContact CG-CD1 3.71Å; L26-L50 HydrophobicContact CD1-CD1 4.35Å; L26-V55 HydrophobicContact CD2-CG1 4.39Å; L26-W58 VanDerWaalsContact C-CH2 3.44Å; L26-W58 HydrophobicContact CB-CD2 3.92Å; L26-W58 HydrophobicContact CB-CE3 3.93Å; L26-W58 HydrophobicContact CB-CH2 3.66Å; L26-W58 HydrophobicContact CB-CZ2 3.62Å; L26-W58 HydrophobicContact CB-CZ3 3.8Å; L26-W58 HydrophobicContact CD1-CD2 3.88Å; L26-W58 HydrophobicContact CD1-CG 3.86Å; L26-W58 HydrophobicContact CD2-CD2 4.28Å; L26-W58 HydrophobicContact CD2-CE3 4.15Å; L26-W58 HydrophobicContact CG-CD2 4.25Å; L26-W58 HydrophobicContact CG-CE3 4.43Å; L26-W58 WeakPolarHBondContact O-CH2 3.42Å; L26-W58 WeakPolarHBondContact O-CZ3 3.42Å; L26-F59 HydrophobicContact CD2-CE2 4.17Å
27	E	98.8	Very high	98.3	Very high	43 Å²	43	80.4 Å²	80.4	20%	0.201	40%	0.396	C	S	.	.	H	α-helix	trans	-66	-44.8	175.3	-71.2	-69.5	166.1	0	0	111.2	V23 L24 E29 F30 H31 W58 R62	V23-E27 HydrophobicContact CG1-CG 4.31Å; V23-E27 WeakPolarHBondContact O-CG 3.49Å; V23-E27 PolarHBondContact O-N 3.03Å; L24-E27 PolarHBondContact O-N 3.29Å; E27-E29 VanDerWaalsContact C-N 3.32Å; E27-E29 PolarHBondContact O-N 3.14Å; E27-F30 WeakPolarHBondContact O-CB 3.38Å; E27-F30 PolarHBondContact O-N 3.46Å; E27-H31 PolarHBondContact O-CD2 3.47Å; E27-H31 PolarHBondContact O-N 3Å; E27-W58 HydrophobicContact CG-CH2 4.15Å; E27-W58 HydrophobicContact CG-CZ2 4.08Å; E27-W58 WeakPolarHBondContact OE1-CZ2 3.49Å; E27-R62 VanDerWaalsContact CD-NE 3.31Å; E27-R62 VanDerWaalsContact OE1-CD 3.26Å; E27-R62 WeakPolarHBondContact OE1-CD 3.4Å; E27-R62 IonicContact OE1-CZ 2.67Å; E27-R62 IonicContact OE1-NE 3.14Å; E27-R62 PolarHBondContact OE1-NE 3.31Å; E27-R62 IonicContact OE2-CZ 3.05Å; E27-R62 IonicContact OE2-NE 3.94Å; E27-R62 PolarHBondContact OE2-NE 3.12Å; E27-R62 IonicContact OE2-NH2 2.79Å; E27-R62 PolarHBondContact OE2-NH2 3.42Å
28	K	98.6	Very high	98.5	Very high	125 Å²	125	83.9 Å²	83.9	54%	0.543	39%	0.39	S	S	.	.	H	α-helix	trans	-54.6	-47.6	175.8	-179.4	-174.5	170.7	-169.2	0	111.7	L24 E25 F30 H31 F32	L24-K28 WeakPolarHBondContact O-CB 3.46Å; L24-K28 PolarHBondContact O-N 3.27Å; E25-K28 PolarHBondContact O-N 3.41Å; E25-K28 WeakPolarHBondContact OE2-CD 3.25Å; E25-K28 IonicContact OE2-NZ 3.7Å; K28-F30 PolarHBondContact O-N 3.46Å; K28-H31 PolarHBondContact O-N 2.96Å; K28-F32 PolarHBondContact O-N 2.91Å; K28-F32 VanDerWaalsContact O-N 3.12Å
29	E	98.6	Very high	98.5	Very high	22 Å²	22	89.4 Å²	89.4	10%	0.103	41%	0.41	C	S	.	.	H	α-helix	trans	-64.6	-37.8	175.8	-71.9	-63.2	133.6	0	0	112.8	E25 E27 H31 F32 N33 R40 I44 F59	E25-E29 WeakPolarHBondContact O-CG 3.42Å; E25-E29 PolarHBondContact O-N 3.12Å; E27-E29 VanDerWaalsContact C-N 3.32Å; E27-E29 PolarHBondContact O-N 3.14Å; E29-H31 VanDerWaalsContact C-N 3.31Å; E29-H31 PolarHBondContact O-N 3.13Å; E29-F32 PolarHBondContact O-N 2.93Å; E29-N33 PolarHBondContact O-N 3.43Å; E29-R40 IonicContact OE1-CZ 2.81Å; E29-R40 IonicContact OE1-NE 3.33Å; E29-R40 IonicContact OE1-NH2 3.47Å; E29-R40 PolarHBondContact OE1-NH2 3.17Å; E29-R40 IonicContact OE2-CZ 3.81Å; E29-R40 IonicContact OE2-NE 2.87Å; E29-R40 PolarHBondContact OE2-NE 3.36Å; E29-R40 IonicContact OE2-NH2 3.58Å; E29-R40 PolarHBondContact OE2-NH2 2.97Å; E29-I44 HydrophobicContact CB-CD1 3.99Å; E29-I44 HydrophobicContact CG-CD1 3.69Å; E29-I44 HydrophobicContact CG-CG1 4.1Å; E29-F59 HydrophobicContact CB-CZ 4.05Å
30	F	98.7	Very high	98.5	Very high	1 Å²	1	89.7 Å²	89.7	0%	0.004	40%	0.403	C	S	.	.	H	α-helix	trans	-64.5	-36.6	175.8	-174.6	-104.1	0	0	0	112.4	L26 E27 K28 N33 R34 W58 F59 R62 R63 L66	L26-F30 WeakPolarHBondContact O-CB 3.35Å; L26-F30 PolarHBondContact O-N 2.87Å; E27-F30 WeakPolarHBondContact O-CB 3.38Å; E27-F30 PolarHBondContact O-N 3.46Å; K28-F30 PolarHBondContact O-N 3.46Å; F30-N33 CarbonylContact O-C 3.59Å; F30-R34 HydrophobicContact CE2-CB 4.11Å; F30-R34 HydrophobicContact CZ-CB 4.4Å; F30-R34 HydrophobicContact CZ-CG 4.39Å; F30-R34 WeakPolarHBondContact O-CD 3.29Å; F30-R34 PolarHBondContact O-NE 3.08Å; F30-W58 HydrophobicContact CB-CH2 4.17Å; F30-W58 HydrophobicContact CB-CZ3 4.02Å; F30-W58 HydrophobicContact CD2-CZ3 4.48Å; F30-W58 HydrophobicContact CG-CZ3 4.45Å; F30-F59 HydrophobicContact CB-CE1 4.27Å; F30-F59 HydrophobicContact CB-CZ 4.44Å; F30-F59 AromaticContact CD2-CD1 3.94Å; F30-F59 HydrophobicContact CD2-CD1 3.94Å; F30-F59 AromaticContact CD2-CE1 3.94Å; F30-F59 HydrophobicContact CD2-CE1 3.94Å; F30-R62 HydrophobicContact CB-CG 4.46Å; F30-R62 HydrophobicContact CD1-CG 3.66Å; F30-R62 HydrophobicContact CD2-CB 4.23Å; F30-R62 HydrophobicContact CD2-CG 3.65Å; F30-R62 HydrophobicContact CE1-CG 3.66Å; F30-R62 HydrophobicContact CE2-CB 4.12Å; F30-R62 HydrophobicContact CE2-CG 3.65Å; F30-R62 HydrophobicContact CG-CG 3.65Å; F30-R62 HydrophobicContact CZ-CB 4.43Å; F30-R62 HydrophobicContact CZ-CG 3.64Å; F30-R63 HydrophobicContact CE2-CG 3.76Å; F30-R63 HydrophobicContact CZ-CG 4.17Å; F30-L66 HydrophobicContact CE1-CD2 4.28Å; F30-L66 HydrophobicContact CZ-CB 4.42Å; F30-L66 HydrophobicContact CZ-CD2 4.05Å
31	H	98.1	Very high	98.5	Very high	120 Å²	120	82.7 Å²	82.7	56%	0.556	38%	0.376	S	S	*	.	H	α-helix	trans	-65.2	-40.7	173.7	-76	-71.1	0	0	0	111.7	E27 K28 E29	E27-H31 PolarHBondContact O-CD2 3.47Å; E27-H31 PolarHBondContact O-N 3Å; K28-H31 PolarHBondContact O-N 2.96Å; E29-H31 VanDerWaalsContact C-N 3.31Å; E29-H31 PolarHBondContact O-N 3.13Å
32	F	98.2	Very high	98.5	Very high	170 Å²	170	81.1 Å²	81.1	75%	0.746	36%	0.36	S	S	*	.	H	α-helix	trans	-64.3	-49.9	174.6	179.7	-102.9	0	0	0	112.4	K28 E29	K28-F32 PolarHBondContact O-N 2.91Å; K28-F32 VanDerWaalsContact O-N 3.12Å; E29-F32 PolarHBondContact O-N 2.93Å
33	N	98.2	Very high	98.5	Very high	74 Å²	74	82 Å²	82	40%	0.396	37%	0.365	S	S	.	.			trans	-147.9	126.1	175	-170	-13.1	0	0	0	112	E29 F30 Y35 F59	E29-N33 PolarHBondContact O-N 3.43Å; F30-N33 CarbonylContact O-C 3.59Å; N33-Y35 PolarHBondContact ND2-O 3.13Å; N33-Y35 VanDerWaalsContact ND2-O 3.13Å; N33-Y35 PolarHBondContact O-N 3.38Å; N33-Y35 PolarHBondContact OD1-N 3.23Å; N33-Y35 PolarHBondContact OD1-O 2.79Å; N33-Y35 VanDerWaalsContact OD1-O 3.08Å; N33-F59 WeakPolarHBondContact O-CE1 3.35Å
34	R	98	Very high	98.5	Very high	93 Å²	93	79.8 Å²	79.8	35%	0.351	35%	0.351	S	S	.	.	S	Bend	trans	-70.6	-10.5	-179.5	-52.7	-64.6	160.2	92	3.5	113.7	F30 R63	F30-R34 HydrophobicContact CE2-CB 4.11Å; F30-R34 HydrophobicContact CZ-CB 4.4Å; F30-R34 HydrophobicContact CZ-CG 4.39Å; F30-R34 WeakPolarHBondContact O-CD 3.29Å; F30-R34 PolarHBondContact O-NE 3.08Å; R34-R63 PolarHBondContact O-NH1 2.94Å; R34-R63 VanDerWaalsContact O-NH1 3.08Å
35	Y	98.7	Very high	98.5	Very high	147 Å²	147	75.9 Å²	75.9	58%	0.576	33%	0.331	S	S	*	.	S	Bend	trans	-132	134.2	179.2	-63.4	-91.8	0	0	0	110.7	N33 R63	N33-Y35 PolarHBondContact ND2-O 3.13Å; N33-Y35 VanDerWaalsContact ND2-O 3.13Å; N33-Y35 PolarHBondContact O-N 3.38Å; N33-Y35 PolarHBondContact OD1-N 3.23Å; N33-Y35 PolarHBondContact OD1-O 2.79Å; N33-Y35 VanDerWaalsContact OD1-O 3.08Å; Y35-R63 VanDerWaalsContact CE1-CZ 3.44Å
36	L	98.3	Very high	98.5	Very high	25 Å²	25	79.1 Å²	79.1	13%	0.131	35%	0.346	C	S	.	.			trans	-94.7	130.4	176.9	-67.1	-179	0	0	0	112	R40 R41 I44 V55 F59	L36-R40 HydrophobicContact CD2-CB 4.34Å; L36-R40 HydrophobicContact CD2-CG 3.85Å; L36-R41 HydrophobicContact CB-CB 4.46Å; L36-R41 HydrophobicContact CD1-CB 4.28Å; L36-R41 HydrophobicContact CD1-CG 4.46Å; L36-I44 HydrophobicContact CD1-CD1 4.12Å; L36-I44 HydrophobicContact CD2-CD1 3.67Å; L36-V55 HydrophobicContact CD1-CG1 3.43Å; L36-V55 VanDerWaalsContact CD1-CG1 3.43Å; L36-F59 HydrophobicContact CD1-CD1 4.16Å; L36-F59 HydrophobicContact CD1-CD2 3.41Å; L36-F59 VanDerWaalsContact CD1-CD2 3.41Å; L36-F59 HydrophobicContact CD1-CE1 4.1Å; L36-F59 HydrophobicContact CD1-CE2 3.38Å; L36-F59 HydrophobicContact CD1-CG 3.83Å; L36-F59 HydrophobicContact CD1-CZ 3.74Å; L36-F59 HydrophobicContact CD2-CD1 4.38Å; L36-F59 HydrophobicContact CD2-CE1 3.71Å; L36-F59 HydrophobicContact CD2-CE2 4.1Å; L36-F59 HydrophobicContact CD2-CZ 3.56Å; L36-F59 HydrophobicContact CG-CD1 3.71Å; L36-F59 HydrophobicContact CG-CD2 3.92Å; L36-F59 HydrophobicContact CG-CE1 3.54Å; L36-F59 HydrophobicContact CG-CE2 3.8Å; L36-F59 HydrophobicContact CG-CG 3.89Å; L36-F59 HydrophobicContact CG-CZ 3.6Å
37	T	98.4	Very high	98.5	Very high	88 Å²	88	84.6 Å²	84.6	54%	0.54	38%	0.38	S	S	.	.			trans	-67.3	166.4	160.8	66.9	0	0	0	0	110.5	R40 R41	T37-R40 WeakPolarHBondContact OG1-CB 3.44Å; T37-R40 PolarHBondContact OG1-N 3.05Å; T37-R41 WeakPolarHBondContact O-CB 3.3Å; T37-R41 PolarHBondContact O-N 2.89Å
38	R	98.6	Very high	98.5	Very high	163 Å²	163	83.7 Å²	83.7	62%	0.615	38%	0.377	S	S	*	.	H	α-helix	trans	-60.2	-50.3	177.1	174.7	163.4	178.4	63.8	-3.1	111.6	R40 R41 I42 E52	R38-R40 PolarHBondContact O-N 3.48Å; R38-R41 WeakPolarHBondContact O-CB 3.49Å; R38-R41 PolarHBondContact O-N 3.07Å; R38-I42 HydrophobicContact CG-CD1 4.18Å; R38-I42 PolarHBondContact O-N 2.98Å; R38-E52 IonicContact NH1-OE2 3.02Å; R38-E52 PolarHBondContact NH1-OE2 3.47Å; R38-E52 VanDerWaalsContact NH1-OE2 3.14Å
39	R	98.5	Very high	98.5	Very high	187 Å²	187	81 Å²	81	71%	0.706	38%	0.384	S	S	*	.	H	α-helix	trans	-57.3	-51	-179.8	177.8	176.7	163.2	-164.8	-0	111.6	R41 I42 E43	R39-R41 PolarHBondContact O-N 3.24Å; R39-I42 WeakPolarHBondContact O-CB 3.49Å; R39-I42 PolarHBondContact O-N 3.12Å; R39-E43 WeakPolarHBondContact CG-OE1 3.46Å; R39-E43 IonicContact CZ-OE1 3.96Å; R39-E43 IonicContact NE-OE1 2.79Å; R39-E43 PolarHBondContact NE-OE1 2.93Å; R39-E43 IonicContact NH2-OE1 3.3Å; R39-E43 PolarHBondContact NH2-OE1 3.35Å; R39-E43 PolarHBondContact O-N 3.28Å; R39-E43 VanDerWaalsContact O-N 3.16Å
40	R	98.6	Very high	98.5	Very high	84 Å²	84	80.9 Å²	80.9	32%	0.317	38%	0.384	S	S	.	.	H	α-helix	trans	-62.4	-33.3	-177.7	-170.8	58	-178.3	164.8	-1.1	112.8	E29 L36 T37 R38 E43 I44	E29-R40 IonicContact OE1-CZ 2.81Å; E29-R40 IonicContact OE1-NE 3.33Å; E29-R40 IonicContact OE1-NH2 3.47Å; E29-R40 PolarHBondContact OE1-NH2 3.17Å; E29-R40 IonicContact OE2-CZ 3.81Å; E29-R40 IonicContact OE2-NE 2.87Å; E29-R40 PolarHBondContact OE2-NE 3.36Å; E29-R40 IonicContact OE2-NH2 3.58Å; E29-R40 PolarHBondContact OE2-NH2 2.97Å; L36-R40 HydrophobicContact CD2-CB 4.34Å; L36-R40 HydrophobicContact CD2-CG 3.85Å; T37-R40 WeakPolarHBondContact OG1-CB 3.44Å; T37-R40 PolarHBondContact OG1-N 3.05Å; R38-R40 PolarHBondContact O-N 3.48Å; R40-E43 WeakPolarHBondContact CD-OE2 3.4Å; R40-E43 IonicContact CZ-OE2 3.51Å; R40-E43 IonicContact NH1-OE2 3.5Å; R40-E43 PolarHBondContact NH1-OE2 3.07Å; R40-E43 PolarHBondContact O-N 2.93Å; R40-I44 HydrophobicContact CG-CD1 3.89Å; R40-I44 HydrophobicContact CG-CG1 4.42Å; R40-I44 VanDerWaalsContact O-CG1 3.32Å; R40-I44 WeakPolarHBondContact O-CG1 3.38Å; R40-I44 PolarHBondContact O-N 3.39Å
41	R	98.8	Very high	98.4	Very high	56 Å²	56	83.4 Å²	83.4	21%	0.211	40%	0.402	C	S	.	.	H	α-helix	trans	-63.2	-40.7	174.9	-174	-171.2	-46.7	-177.5	8.2	112.8	L36 T37 R38 R39 A45 E52 V55	L36-R41 HydrophobicContact CB-CB 4.46Å; L36-R41 HydrophobicContact CD1-CB 4.28Å; L36-R41 HydrophobicContact CD1-CG 4.46Å; T37-R41 WeakPolarHBondContact O-CB 3.3Å; T37-R41 PolarHBondContact O-N 2.89Å; R38-R41 WeakPolarHBondContact O-CB 3.49Å; R38-R41 PolarHBondContact O-N 3.07Å; R39-R41 PolarHBondContact O-N 3.24Å; R41-A45 WeakPolarHBondContact O-CB 3.42Å; R41-A45 PolarHBondContact O-N 3.33Å; R41-E52 WeakPolarHBondContact CD-O 3.4Å; R41-E52 HydrophobicContact CG-CB 4.19Å; R41-E52 HydrophobicContact CG-CG 4.33Å; R41-V55 HydrophobicContact CG-CB 4.33Å; R41-V55 HydrophobicContact CG-CG1 4.25Å
42	I	98.8	Very high	98.5	Very high	51 Å²	51	81 Å²	81	26%	0.262	39%	0.391	S	S	.	.	H	α-helix	trans	-65	-47.2	177.9	-64.6	164.9	0	0	0	109.4	R38 R39 I44 A45 Q46 E52	R38-I42 HydrophobicContact CG-CD1 4.18Å; R38-I42 PolarHBondContact O-N 2.98Å; R39-I42 WeakPolarHBondContact O-CB 3.49Å; R39-I42 PolarHBondContact O-N 3.12Å; I42-I44 PolarHBondContact O-N 3.13Å; I42-A45 WeakPolarHBondContact O-CB 3.12Å; I42-A45 PolarHBondContact O-N 2.96Å; I42-Q46 WeakPolarHBondContact O-CG 3.39Å; I42-Q46 PolarHBondContact O-N 3.36Å; I42-E52 HydrophobicContact CG1-CG 4.17Å
43	E	98.8	Very high	98.5	Very high	53 Å²	53	80.2 Å²	80.2	25%	0.248	38%	0.383	C	S	.	.	H	α-helix	trans	-57.4	-52.3	178.8	-66.8	169.5	-176	0	0	111.6	R39 R40 A45 Q46 T47	R39-E43 WeakPolarHBondContact CG-OE1 3.46Å; R39-E43 IonicContact CZ-OE1 3.96Å; R39-E43 IonicContact NE-OE1 2.79Å; R39-E43 PolarHBondContact NE-OE1 2.93Å; R39-E43 IonicContact NH2-OE1 3.3Å; R39-E43 PolarHBondContact NH2-OE1 3.35Å; R39-E43 PolarHBondContact O-N 3.28Å; R39-E43 VanDerWaalsContact O-N 3.16Å; R40-E43 WeakPolarHBondContact CD-OE2 3.4Å; R40-E43 IonicContact CZ-OE2 3.51Å; R40-E43 IonicContact NH1-OE2 3.5Å; R40-E43 PolarHBondContact NH1-OE2 3.07Å; R40-E43 PolarHBondContact O-N 2.93Å; E43-A45 VanDerWaalsContact C-N 3.33Å; E43-A45 PolarHBondContact O-N 3.47Å; E43-Q46 PolarHBondContact O-N 2.99Å; E43-T47 PolarHBondContact O-N 3.16Å; E43-T47 PolarHBondContact O-OG1 3.08Å; E43-T47 VanDerWaalsContact O-OG1 3.05Å
44	I	98.8	Very high	98.5	Very high	6 Å²	6	79.6 Å²	79.6	3%	0.031	38%	0.378	C	S	.	.	H	α-helix	trans	-61.9	-41.6	179.5	-65.4	166.7	0	0	0	111.5	L26 E29 L36 R40 I42 Q46 T47 L48 V55	L26-I44 HydrophobicContact CD2-CG2 4.05Å; E29-I44 HydrophobicContact CB-CD1 3.99Å; E29-I44 HydrophobicContact CG-CD1 3.69Å; E29-I44 HydrophobicContact CG-CG1 4.1Å; L36-I44 HydrophobicContact CD1-CD1 4.12Å; L36-I44 HydrophobicContact CD2-CD1 3.67Å; R40-I44 HydrophobicContact CG-CD1 3.89Å; R40-I44 HydrophobicContact CG-CG1 4.42Å; R40-I44 VanDerWaalsContact O-CG1 3.32Å; R40-I44 WeakPolarHBondContact O-CG1 3.38Å; R40-I44 PolarHBondContact O-N 3.39Å; I42-I44 PolarHBondContact O-N 3.13Å; I44-Q46 VanDerWaalsContact C-N 3.33Å; I44-Q46 PolarHBondContact O-N 3.48Å; I44-T47 PolarHBondContact O-N 3.31Å; I44-L48 HydrophobicContact CG2-CD1 3.69Å; I44-L48 HydrophobicContact CG2-CG 4.21Å; I44-L48 WeakPolarHBondContact O-CB 3.41Å; I44-L48 WeakPolarHBondContact O-CG 3.41Å; I44-L48 PolarHBondContact O-N 3.11Å; I44-V55 HydrophobicContact CB-CG1 4.43Å; I44-V55 HydrophobicContact CG2-CG1 4.04Å; I44-V55 HydrophobicContact CG2-CG2 4.21Å
45	A	98.7	Very high	98.5	Very high	7 Å²	7	75.1 Å²	75.1	6%	0.058	36%	0.361	C	S	.	.	H	α-helix	trans	-58.8	-46.3	179	0	0	0	0	0	111.3	R41 I42 E43 G49 L50 E52 V55	R41-A45 WeakPolarHBondContact O-CB 3.42Å; R41-A45 PolarHBondContact O-N 3.33Å; I42-A45 WeakPolarHBondContact O-CB 3.12Å; I42-A45 PolarHBondContact O-N 2.96Å; E43-A45 VanDerWaalsContact C-N 3.33Å; E43-A45 PolarHBondContact O-N 3.47Å; A45-G49 PolarHBondContact O-N 3.23Å; A45-G49 VanDerWaalsContact O-N 3.12Å; A45-L50 CarbonylContact C-O 3.36Å; A45-L50 WeakPolarHBondContact CA-O 3.37Å; A45-L50 VanDerWaalsContact CB-O 3.25Å; A45-L50 WeakPolarHBondContact CB-O 3.41Å; A45-L50 PolarHBondContact O-N 3.06Å; A45-E52 HydrophobicContact CB-CG 4.27Å; A45-V55 HydrophobicContact CB-CG2 4.08Å
46	Q	98.6	Very high	98.5	Very high	146 Å²	146	73.7 Å²	73.7	68%	0.682	36%	0.358	S	S	*	.	H	α-helix	trans	-64.1	-48.1	177	-70.8	172.6	-27	0	0	111.8	I42 E43 I44 L48 G49	I42-Q46 WeakPolarHBondContact O-CG 3.39Å; I42-Q46 PolarHBondContact O-N 3.36Å; E43-Q46 PolarHBondContact O-N 2.99Å; I44-Q46 VanDerWaalsContact C-N 3.33Å; I44-Q46 PolarHBondContact O-N 3.48Å; Q46-L48 VanDerWaalsContact C-N 3.3Å; Q46-L48 PolarHBondContact O-N 3.35Å; Q46-G49 PolarHBondContact O-N 3.29Å
47	T	98.4	Very high	98.5	Very high	116 Å²	116	75 Å²	75	71%	0.712	36%	0.364	S	S	*	.	H	α-helix	trans	-61.6	-36.3	-179.2	-56.1	0	0	0	0	112.9	E43 I44	E43-T47 PolarHBondContact O-N 3.16Å; E43-T47 PolarHBondContact O-OG1 3.08Å; E43-T47 VanDerWaalsContact O-OG1 3.05Å; I44-T47 PolarHBondContact O-N 3.31Å
48	L	98.5	Very high	98.5	Very high	23 Å²	23	72.1 Å²	72.1	12%	0.12	34%	0.344	C	S	.	.	H	α-helix	trans	-95.8	-2.9	-175.2	-60.1	-175.1	0	0	0	114.5	Q22 E25 L26 I44 Q46 L50	Q22-L48 HydrophobicContact CG-CB 4.41Å; Q22-L48 PolarHBondContact NE2-O 3.21Å; E25-L48 HydrophobicContact CB-CD1 4.32Å; E25-L48 HydrophobicContact CB-CD2 3.77Å; E25-L48 HydrophobicContact CG-CD2 4.08Å; L26-L48 HydrophobicContact CD1-CD1 4.4Å; L26-L48 HydrophobicContact CD2-CD1 3.87Å; L26-L48 HydrophobicContact CG-CD1 3.71Å; I44-L48 HydrophobicContact CG2-CD1 3.69Å; I44-L48 HydrophobicContact CG2-CG 4.21Å; I44-L48 WeakPolarHBondContact O-CB 3.41Å; I44-L48 WeakPolarHBondContact O-CG 3.41Å; I44-L48 PolarHBondContact O-N 3.11Å; Q46-L48 VanDerWaalsContact C-N 3.3Å; Q46-L48 PolarHBondContact O-N 3.35Å; L48-L50 VanDerWaalsContact C-N 3.29Å; L48-L50 HydrophobicContact CB-CD1 4.07Å; L48-L50 HydrophobicContact CB-CG 4.02Å; L48-L50 HydrophobicContact CD1-CD1 4.34Å; L48-L50 PolarHBondContact O-N 3.49Å
49	G	98.3	Very high	98.5	Very high	68 Å²	68	64.6 Å²	64.6	70%	0.701	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.5	35.2	-173.6	0	0	0	0	0	112.9	A45 Q46	A45-G49 PolarHBondContact O-N 3.23Å; A45-G49 VanDerWaalsContact O-N 3.12Å; Q46-G49 PolarHBondContact O-N 3.29Å
50	L	98.2	Very high	98.5	Very high	20 Å²	20	60.5 Å²	60.5	11%	0.105	30%	0.304	C	S	.	.			trans	-115.3	157.4	179.9	-63.1	179.8	0	0	0	110.4	Y18 L26 A45 L48 Q54 V55	Y18-L50 HydrophobicContact CD1-CD1 4.36Å; Y18-L50 HydrophobicContact CD1-CD2 3.96Å; Y18-L50 HydrophobicContact CE1-CD1 4.23Å; Y18-L50 HydrophobicContact CE1-CD2 3.76Å; L26-L50 HydrophobicContact CD1-CD1 4.35Å; A45-L50 CarbonylContact C-O 3.36Å; A45-L50 WeakPolarHBondContact CA-O 3.37Å; A45-L50 VanDerWaalsContact CB-O 3.25Å; A45-L50 WeakPolarHBondContact CB-O 3.41Å; A45-L50 PolarHBondContact O-N 3.06Å; L48-L50 VanDerWaalsContact C-N 3.29Å; L48-L50 HydrophobicContact CB-CD1 4.07Å; L48-L50 HydrophobicContact CB-CG 4.02Å; L48-L50 HydrophobicContact CD1-CD1 4.34Å; L48-L50 PolarHBondContact O-N 3.49Å; L50-Q54 HydrophobicContact CB-CB 4.45Å; L50-V55 HydrophobicContact CB-CG2 4.17Å
51	S	98.2	Very high	98.5	Very high	55 Å²	55	61.2 Å²	61.2	39%	0.385	31%	0.314	S	S	.	.			trans	-75	149.3	170.3	64.1	0	0	0	0	111.9	R53 Q54 V55	S51-R53 PolarHBondContact O-N 3.49Å; S51-Q54 WeakPolarHBondContact O-CB 3.5Å; S51-Q54 PolarHBondContact O-N 3.03Å; S51-Q54 VanDerWaalsContact OG-CG 3.29Å; S51-Q54 WeakPolarHBondContact OG-CG 3.42Å; S51-Q54 PolarHBondContact OG-N 3.28Å; S51-Q54 PolarHBondContact OG-OE1 2.85Å; S51-V55 PolarHBondContact O-N 2.88Å; S51-V55 VanDerWaalsContact O-N 3.13Å
52	E	98.6	Very high	98.5	Very high	68 Å²	68	60.2 Å²	60.2	32%	0.318	31%	0.31	S	S	.	.	H	α-helix	trans	-50.8	-35	172.4	-74.6	-174.6	-113.6	0	0	112.4	R38 R41 I42 A45 K56	R38-E52 IonicContact NH1-OE2 3.02Å; R38-E52 PolarHBondContact NH1-OE2 3.47Å; R38-E52 VanDerWaalsContact NH1-OE2 3.14Å; R41-E52 WeakPolarHBondContact CD-O 3.4Å; R41-E52 HydrophobicContact CG-CB 4.19Å; R41-E52 HydrophobicContact CG-CG 4.33Å; I42-E52 HydrophobicContact CG1-CG 4.17Å; A45-E52 HydrophobicContact CB-CG 4.27Å; E52-K56 WeakPolarHBondContact O-CB 3.47Å; E52-K56 PolarHBondContact O-N 3.4Å
53	R	97.9	Very high	98.5	Very high	155 Å²	155	61.1 Å²	61.1	59%	0.585	31%	0.311	S	S	*	.	H	α-helix	trans	-66.6	-43.5	177.6	-176	178.7	-176.5	-86	2.1	111.8	S51 K56 I57	S51-R53 PolarHBondContact O-N 3.49Å; R53-K56 PolarHBondContact O-N 3.24Å; R53-I57 HydrophobicContact CG-CD1 3.89Å; R53-I57 WeakPolarHBondContact O-CB 3.19Å; R53-I57 VanDerWaalsContact O-CG1 3.3Å; R53-I57 WeakPolarHBondContact O-CG1 3.49Å; R53-I57 PolarHBondContact O-N 2.73Å
54	Q	98.2	Very high	98.4	Very high	60 Å²	60	63.2 Å²	63.2	28%	0.28	32%	0.322	S	S	.	.	H	α-helix	trans	-61.6	-47.2	176.9	-79.5	164.7	-55.1	0	0	110.6	Y18 L50 S51 K56 I57 W58	Y18-Q54 WeakPolarHBondContact OH-CB 3.32Å; L50-Q54 HydrophobicContact CB-CB 4.45Å; S51-Q54 WeakPolarHBondContact O-CB 3.5Å; S51-Q54 PolarHBondContact O-N 3.03Å; S51-Q54 VanDerWaalsContact OG-CG 3.29Å; S51-Q54 WeakPolarHBondContact OG-CG 3.42Å; S51-Q54 PolarHBondContact OG-N 3.28Å; S51-Q54 PolarHBondContact OG-OE1 2.85Å; Q54-K56 PolarHBondContact O-N 2.95Å; Q54-I57 PolarHBondContact O-N 3.37Å; Q54-W58 WeakPolarHBondContact O-CB 3.49Å; Q54-W58 PolarHBondContact O-N 2.79Å
55	V	98.7	Very high	98.4	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-59.3	-46.4	176.4	-179.2	0	0	0	0	110.8	L26 L36 R41 I44 A45 L50 S51 I57 W58 F59	L26-V55 HydrophobicContact CD2-CG1 4.39Å; L36-V55 HydrophobicContact CD1-CG1 3.43Å; L36-V55 VanDerWaalsContact CD1-CG1 3.43Å; R41-V55 HydrophobicContact CG-CB 4.33Å; R41-V55 HydrophobicContact CG-CG1 4.25Å; I44-V55 HydrophobicContact CB-CG1 4.43Å; I44-V55 HydrophobicContact CG2-CG1 4.04Å; I44-V55 HydrophobicContact CG2-CG2 4.21Å; A45-V55 HydrophobicContact CB-CG2 4.08Å; L50-V55 HydrophobicContact CB-CG2 4.17Å; S51-V55 PolarHBondContact O-N 2.88Å; S51-V55 VanDerWaalsContact O-N 3.13Å; V55-I57 PolarHBondContact O-N 3.02Å; V55-W58 PolarHBondContact O-N 3.02Å; V55-F59 HydrophobicContact CG1-CD2 4.09Å; V55-F59 HydrophobicContact CG1-CE2 4.18Å; V55-F59 WeakPolarHBondContact O-CD2 3.45Å; V55-F59 PolarHBondContact O-N 3.5Å
56	K	98.5	Very high	98.3	Very high	117 Å²	117	70.4 Å²	70.4	51%	0.509	35%	0.353	S	S	.	.	H	α-helix	trans	-56	-48.3	176	-178.1	-169	178.4	-177.7	0	112.2	E52 R53 Q54 F59 Q60	E52-K56 WeakPolarHBondContact O-CB 3.47Å; E52-K56 PolarHBondContact O-N 3.4Å; R53-K56 PolarHBondContact O-N 3.24Å; Q54-K56 PolarHBondContact O-N 2.95Å; K56-F59 PolarHBondContact O-N 3.34Å; K56-Q60 PolarHBondContact O-N 3.31Å; K56-Q60 VanDerWaalsContact O-N 3.11Å
57	I	98.3	Very high	98.1	Very high	51 Å²	51	68.5 Å²	68.5	26%	0.262	34%	0.343	S	S	.	.	H	α-helix	trans	-66.4	-41.5	-179.1	-71.2	170.1	0	0	0	110.5	R53 Q54 V55 F59 Q60 N61	R53-I57 HydrophobicContact CG-CD1 3.89Å; R53-I57 WeakPolarHBondContact O-CB 3.19Å; R53-I57 VanDerWaalsContact O-CG1 3.3Å; R53-I57 WeakPolarHBondContact O-CG1 3.49Å; R53-I57 PolarHBondContact O-N 2.73Å; Q54-I57 PolarHBondContact O-N 3.37Å; V55-I57 PolarHBondContact O-N 3.02Å; I57-F59 PolarHBondContact O-N 3.05Å; I57-Q60 WeakPolarHBondContact O-CB 3.26Å; I57-Q60 PolarHBondContact O-N 3.46Å; I57-N61 WeakPolarHBondContact O-CB 3.44Å; I57-N61 VanDerWaalsContact O-CG 3.3Å; I57-N61 PolarHBondContact O-N 3.3Å
58	W	98.7	Very high	97.9	Very high	29 Å²	29	68.4 Å²	68.4	11%	0.11	33%	0.332	C	S	.	.	H	α-helix	trans	-59.4	-47.5	177.6	-172.8	97.2	0	0	0	111.2	Y18 L26 E27 F30 Q54 V55 Q60 N61 R62	Y18-W58 AromaticContact CD2-CD1 3.99Å; Y18-W58 AromaticContact CE2-CD1 3.76Å; L26-W58 VanDerWaalsContact C-CH2 3.44Å; L26-W58 HydrophobicContact CB-CD2 3.92Å; L26-W58 HydrophobicContact CB-CE3 3.93Å; L26-W58 HydrophobicContact CB-CH2 3.66Å; L26-W58 HydrophobicContact CB-CZ2 3.62Å; L26-W58 HydrophobicContact CB-CZ3 3.8Å; L26-W58 HydrophobicContact CD1-CD2 3.88Å; L26-W58 HydrophobicContact CD1-CG 3.86Å; L26-W58 HydrophobicContact CD2-CD2 4.28Å; L26-W58 HydrophobicContact CD2-CE3 4.15Å; L26-W58 HydrophobicContact CG-CD2 4.25Å; L26-W58 HydrophobicContact CG-CE3 4.43Å; L26-W58 WeakPolarHBondContact O-CH2 3.42Å; L26-W58 WeakPolarHBondContact O-CZ3 3.42Å; E27-W58 HydrophobicContact CG-CH2 4.15Å; E27-W58 HydrophobicContact CG-CZ2 4.08Å; E27-W58 WeakPolarHBondContact OE1-CZ2 3.49Å; F30-W58 HydrophobicContact CB-CH2 4.17Å; F30-W58 HydrophobicContact CB-CZ3 4.02Å; F30-W58 HydrophobicContact CD2-CZ3 4.48Å; F30-W58 HydrophobicContact CG-CZ3 4.45Å; Q54-W58 WeakPolarHBondContact O-CB 3.49Å; Q54-W58 PolarHBondContact O-N 2.79Å; V55-W58 PolarHBondContact O-N 3.02Å; W58-Q60 VanDerWaalsContact C-N 3.31Å; W58-Q60 PolarHBondContact O-N 3.14Å; W58-N61 PolarHBondContact O-N 3.04Å; W58-R62 HydrophobicContact CD2-CB 4.46Å; W58-R62 HydrophobicContact CE3-CB 4.04Å; W58-R62 HydrophobicContact CH2-CB 3.96Å; W58-R62 HydrophobicContact CH2-CG 3.65Å; W58-R62 HydrophobicContact CZ2-CB 4.4Å; W58-R62 HydrophobicContact CZ2-CG 4.29Å; W58-R62 HydrophobicContact CZ3-CB 3.78Å; W58-R62 HydrophobicContact CZ3-CG 3.82Å; W58-R62 VanDerWaalsContact O-CB 3.31Å; W58-R62 WeakPolarHBondContact O-CB 3.48Å; W58-R62 PolarHBondContact O-N 2.78Å
59	F	98.8	Very high	97.5	Very high	4 Å²	4	70 Å²	70	2%	0.018	34%	0.341	C	S	.	.	H	α-helix	trans	-61.4	-38.5	176.6	-91.6	-102.2	0	0	0	112.7	L26 E29 F30 N33 L36 V55 K56 I57 R62 R63	L26-F59 HydrophobicContact CD2-CE2 4.17Å; E29-F59 HydrophobicContact CB-CZ 4.05Å; F30-F59 HydrophobicContact CB-CE1 4.27Å; F30-F59 HydrophobicContact CB-CZ 4.44Å; F30-F59 AromaticContact CD2-CD1 3.94Å; F30-F59 HydrophobicContact CD2-CD1 3.94Å; F30-F59 AromaticContact CD2-CE1 3.94Å; F30-F59 HydrophobicContact CD2-CE1 3.94Å; N33-F59 WeakPolarHBondContact O-CE1 3.35Å; L36-F59 HydrophobicContact CD1-CD1 4.16Å; L36-F59 HydrophobicContact CD1-CD2 3.41Å; L36-F59 VanDerWaalsContact CD1-CD2 3.41Å; L36-F59 HydrophobicContact CD1-CE1 4.1Å; L36-F59 HydrophobicContact CD1-CE2 3.38Å; L36-F59 HydrophobicContact CD1-CG 3.83Å; L36-F59 HydrophobicContact CD1-CZ 3.74Å; L36-F59 HydrophobicContact CD2-CD1 4.38Å; L36-F59 HydrophobicContact CD2-CE1 3.71Å; L36-F59 HydrophobicContact CD2-CE2 4.1Å; L36-F59 HydrophobicContact CD2-CZ 3.56Å; L36-F59 HydrophobicContact CG-CD1 3.71Å; L36-F59 HydrophobicContact CG-CD2 3.92Å; L36-F59 HydrophobicContact CG-CE1 3.54Å; L36-F59 HydrophobicContact CG-CE2 3.8Å; L36-F59 HydrophobicContact CG-CG 3.89Å; L36-F59 HydrophobicContact CG-CZ 3.6Å; V55-F59 HydrophobicContact CG1-CD2 4.09Å; V55-F59 HydrophobicContact CG1-CE2 4.18Å; V55-F59 WeakPolarHBondContact O-CD2 3.45Å; V55-F59 PolarHBondContact O-N 3.5Å; K56-F59 PolarHBondContact O-N 3.34Å; I57-F59 PolarHBondContact O-N 3.05Å; F59-R62 PolarHBondContact O-N 2.93Å; F59-R63 WeakPolarHBondContact O-CG 3.34Å; F59-R63 PolarHBondContact O-N 3.11Å
60	Q	98.7	Very high	97.1	Very high	102 Å²	102	72.5 Å²	72.5	48%	0.477	33%	0.334	S	S	.	.	H	α-helix	trans	-62.1	-50.6	174.3	-174.6	175.3	22.8	0	0	111	K56 I57 W58 R62 R63 M64	K56-Q60 PolarHBondContact O-N 3.31Å; K56-Q60 VanDerWaalsContact O-N 3.11Å; I57-Q60 WeakPolarHBondContact O-CB 3.26Å; I57-Q60 PolarHBondContact O-N 3.46Å; W58-Q60 VanDerWaalsContact C-N 3.31Å; W58-Q60 PolarHBondContact O-N 3.14Å; Q60-R62 VanDerWaalsContact C-N 3.3Å; Q60-R62 PolarHBondContact O-N 2.9Å; Q60-R63 PolarHBondContact O-N 2.93Å; Q60-M64 WeakPolarHBondContact O-CG 3.42Å; Q60-M64 PolarHBondContact O-N 3.17Å
61	N	98.2	Very high	96.4	Very high	98 Å²	98	77 Å²	77	52%	0.524	35%	0.353	S	S	.	.	H	α-helix	trans	-61.3	-40.5	178.6	-69.6	-14.7	0	0	0	111.6	I57 W58 R63 M64 K65	I57-N61 WeakPolarHBondContact O-CB 3.44Å; I57-N61 VanDerWaalsContact O-CG 3.3Å; I57-N61 PolarHBondContact O-N 3.3Å; W58-N61 PolarHBondContact O-N 3.04Å; N61-R63 PolarHBondContact O-N 3.14Å; N61-M64 WeakPolarHBondContact O-CB 3.44Å; N61-M64 PolarHBondContact O-N 2.76Å; N61-M64 VanDerWaalsContact O-N 3.14Å; N61-K65 PolarHBondContact O-N 3.41Å
62	R	98.6	Very high	95.2	Very high	35 Å²	35	77 Å²	77	13%	0.132	35%	0.353	C	S	.	.	H	α-helix	trans	-63.9	-41.7	179.5	-175.7	63.2	-171.3	98.7	-7.1	112.3	E27 F30 W58 F59 Q60 K65 L66	E27-R62 VanDerWaalsContact CD-NE 3.31Å; E27-R62 VanDerWaalsContact OE1-CD 3.26Å; E27-R62 WeakPolarHBondContact OE1-CD 3.4Å; E27-R62 IonicContact OE1-CZ 2.67Å; E27-R62 IonicContact OE1-NE 3.14Å; E27-R62 PolarHBondContact OE1-NE 3.31Å; E27-R62 IonicContact OE2-CZ 3.05Å; E27-R62 IonicContact OE2-NE 3.94Å; E27-R62 PolarHBondContact OE2-NE 3.12Å; E27-R62 IonicContact OE2-NH2 2.79Å; E27-R62 PolarHBondContact OE2-NH2 3.42Å; F30-R62 HydrophobicContact CB-CG 4.46Å; F30-R62 HydrophobicContact CD1-CG 3.66Å; F30-R62 HydrophobicContact CD2-CB 4.23Å; F30-R62 HydrophobicContact CD2-CG 3.65Å; F30-R62 HydrophobicContact CE1-CG 3.66Å; F30-R62 HydrophobicContact CE2-CB 4.12Å; F30-R62 HydrophobicContact CE2-CG 3.65Å; F30-R62 HydrophobicContact CG-CG 3.65Å; F30-R62 HydrophobicContact CZ-CB 4.43Å; F30-R62 HydrophobicContact CZ-CG 3.64Å; W58-R62 HydrophobicContact CD2-CB 4.46Å; W58-R62 HydrophobicContact CE3-CB 4.04Å; W58-R62 HydrophobicContact CH2-CB 3.96Å; W58-R62 HydrophobicContact CH2-CG 3.65Å; W58-R62 HydrophobicContact CZ2-CB 4.4Å; W58-R62 HydrophobicContact CZ2-CG 4.29Å; W58-R62 HydrophobicContact CZ3-CB 3.78Å; W58-R62 HydrophobicContact CZ3-CG 3.82Å; W58-R62 VanDerWaalsContact O-CB 3.31Å; W58-R62 WeakPolarHBondContact O-CB 3.48Å; W58-R62 PolarHBondContact O-N 2.78Å; F59-R62 PolarHBondContact O-N 2.93Å; Q60-R62 VanDerWaalsContact C-N 3.3Å; Q60-R62 PolarHBondContact O-N 2.9Å; R62-K65 WeakPolarHBondContact O-CB 3.31Å; R62-K65 PolarHBondContact O-N 3.19Å; R62-L66 PolarHBondContact O-N 3.38Å
63	R	98.1	Very high	93.5	Very high	71 Å²	71	81.2 Å²	81.2	27%	0.268	37%	0.372	S	S	.	.	H	α-helix	trans	-62.8	-40.2	171	-73.3	-165.4	-61.4	-101.3	3.3	112.2	F30 R34 Y35 F59 Q60 N61 K65 L66 K67	F30-R63 HydrophobicContact CE2-CG 3.76Å; F30-R63 HydrophobicContact CZ-CG 4.17Å; R34-R63 PolarHBondContact O-NH1 2.94Å; R34-R63 VanDerWaalsContact O-NH1 3.08Å; Y35-R63 VanDerWaalsContact CE1-CZ 3.44Å; F59-R63 WeakPolarHBondContact O-CG 3.34Å; F59-R63 PolarHBondContact O-N 3.11Å; Q60-R63 PolarHBondContact O-N 2.93Å; N61-R63 PolarHBondContact O-N 3.14Å; R63-K65 VanDerWaalsContact C-N 3.3Å; R63-K65 PolarHBondContact O-N 2.82Å; R63-L66 PolarHBondContact O-N 3Å; R63-K67 WeakPolarHBondContact O-CB 3.44Å; R63-K67 PolarHBondContact O-N 2.91Å
64	M	98.1	Very high	91.8	Very high	97 Å²	97	82 Å²	82	48%	0.478	38%	0.382	S	S	.	.	H	α-helix	trans	-62.1	-40.4	175.8	-66.3	-52.4	-62.4	0	0	111.8	Q60 N61 K67 K68	Q60-M64 WeakPolarHBondContact O-CG 3.42Å; Q60-M64 PolarHBondContact O-N 3.17Å; N61-M64 WeakPolarHBondContact O-CB 3.44Å; N61-M64 PolarHBondContact O-N 2.76Å; N61-M64 VanDerWaalsContact O-N 3.14Å; M64-K67 PolarHBondContact O-N 3.25Å; M64-K68 PolarHBondContact O-N 3.36Å
65	K	97.4	Very high	90	Very high	120 Å²	120	84 Å²	84	52%	0.522	40%	0.399	S	S	.	.	H	α-helix	trans	-62.5	-51.3	173.4	-173.2	-179	176.3	-174.2	0	111.5	N61 R62 R63 K67 K68 D69	N61-K65 PolarHBondContact O-N 3.41Å; R62-K65 WeakPolarHBondContact O-CB 3.31Å; R62-K65 PolarHBondContact O-N 3.19Å; R63-K65 VanDerWaalsContact C-N 3.3Å; R63-K65 PolarHBondContact O-N 2.82Å; K65-K67 VanDerWaalsContact C-N 3.27Å; K65-K67 PolarHBondContact O-N 3.1Å; K65-K68 CarbonylContact O-C 3.41Å; K65-K68 WeakPolarHBondContact O-CA 3.41Å; K65-K68 VanDerWaalsContact O-CB 3.32Å; K65-K68 WeakPolarHBondContact O-CB 3.32Å; K65-K68 PolarHBondContact O-N 2.89Å; K65-D69 PolarHBondContact O-N 3.39Å
66	L	96.6	Very high	87.9	Confident	44 Å²	44	88.5 Å²	88.5	23%	0.23	44%	0.436	C	S	.	.	H	α-helix	trans	-53.4	-46.3	176.2	175.9	65.6	0	0	0	111.6	F30 R62 R63 K68 D69 Q70	F30-L66 HydrophobicContact CE1-CD2 4.28Å; F30-L66 HydrophobicContact CZ-CB 4.42Å; F30-L66 HydrophobicContact CZ-CD2 4.05Å; R62-L66 PolarHBondContact O-N 3.38Å; R63-L66 PolarHBondContact O-N 3Å; L66-K68 VanDerWaalsContact C-N 3.29Å; L66-K68 PolarHBondContact O-N 3.04Å; L66-D69 PolarHBondContact O-N 2.85Å; L66-Q70 WeakPolarHBondContact O-CG 3.13Å; L66-Q70 PolarHBondContact O-N 3.47Å; L66-Q70 VanDerWaalsContact O-N 3.1Å
67	K	95.7	Very high	85.6	Confident	106 Å²	106	87.3 Å²	87.3	46%	0.461	44%	0.44	S	S	.	.	H	α-helix	trans	-58.2	-44.6	175.3	-162.7	-178.5	63.4	170.1	0	109.9	R63 M64 K65 K71	R63-K67 WeakPolarHBondContact O-CB 3.44Å; R63-K67 PolarHBondContact O-N 2.91Å; M64-K67 PolarHBondContact O-N 3.25Å; K65-K67 VanDerWaalsContact C-N 3.27Å; K65-K67 PolarHBondContact O-N 3.1Å; K67-K71 HydrophobicContact CG-CD 4.38Å; K67-K71 WeakPolarHBondContact O-CD 3.36Å; K67-K71 WeakPolarHBondContact O-CE 3.39Å; K67-K71 PolarHBondContact O-NZ 3.31Å
68	K	93.5	Very high	83.2	Confident	114 Å²	114	90 Å²	90	50%	0.496	46%	0.464	S	S	.	.	H	α-helix	trans	-61.1	-48.4	178.9	-170.5	179.2	175.6	-176.8	0	111.4	M64 K65 L66 Q70 K71 S72 A82	M64-K68 PolarHBondContact O-N 3.36Å; K65-K68 CarbonylContact O-C 3.41Å; K65-K68 WeakPolarHBondContact O-CA 3.41Å; K65-K68 VanDerWaalsContact O-CB 3.32Å; K65-K68 WeakPolarHBondContact O-CB 3.32Å; K65-K68 PolarHBondContact O-N 2.89Å; L66-K68 VanDerWaalsContact C-N 3.29Å; L66-K68 PolarHBondContact O-N 3.04Å; K68-Q70 VanDerWaalsContact C-N 3.27Å; K68-Q70 PolarHBondContact O-N 3.43Å; K68-K71 VanDerWaalsContact CA-NZ 3.33Å; K68-K71 PolarHBondContact O-N 3.41Å; K68-K71 VanDerWaalsContact O-N 3.13Å; K68-S72 PolarHBondContact O-N 3.42Å; K68-A82 PolarHBondContact NZ-O 3.13Å
69	D	91.4	Very high	80.8	Confident	57 Å²	57	99.4 Å²	99.4	31%	0.305	50%	0.5	S	S	.	.	H	α-helix	trans	-58.4	-39.3	-178	-55.5	-18.1	0	0	0	111.2	K65 L66 K71 S72 H73	K65-D69 PolarHBondContact O-N 3.39Å; L66-D69 PolarHBondContact O-N 2.85Å; D69-K71 PolarHBondContact O-N 2.69Å; D69-S72 PolarHBondContact O-N 3.3Å; D69-S72 PolarHBondContact O-OG 2.87Å; D69-H73 PolarHBondContact O-CD2 3.13Å
70	Q	89.3	Confident	78.1	Confident	119 Å²	119	101.3 Å²	101.3	56%	0.556	52%	0.522	S	S	*	.	H	α-helix	trans	-64.8	-33.6	177.7	-72	176.9	-45.3	0	0	114.7	L66 K68	L66-Q70 WeakPolarHBondContact O-CG 3.13Å; L66-Q70 PolarHBondContact O-N 3.47Å; L66-Q70 VanDerWaalsContact O-N 3.1Å; K68-Q70 VanDerWaalsContact C-N 3.27Å; K68-Q70 PolarHBondContact O-N 3.43Å
71	K	82.4	Confident	75.6	Confident	116 Å²	116	105.5 Å²	105.5	50%	0.504	54%	0.541	S	S	.	.	H	α-helix	trans	-78.8	-27.7	179.8	-78.8	101.6	65.1	-151.5	0	113	K67 K68 D69 H73 H74	K67-K71 HydrophobicContact CG-CD 4.38Å; K67-K71 WeakPolarHBondContact O-CD 3.36Å; K67-K71 WeakPolarHBondContact O-CE 3.39Å; K67-K71 PolarHBondContact O-NZ 3.31Å; K68-K71 VanDerWaalsContact CA-NZ 3.33Å; K68-K71 PolarHBondContact O-N 3.41Å; K68-K71 VanDerWaalsContact O-N 3.13Å; D69-K71 PolarHBondContact O-N 2.69Å; K71-H73 PolarHBondContact O-N 2.77Å; K71-H74 PolarHBondContact O-N 3.24Å
72	S	73.5	Confident	73.2	Confident	54 Å²	54	104.9 Å²	104.9	38%	0.378	55%	0.55	S	S	.	.	H	α-helix	trans	-72.4	-12.6	-179.5	41.6	0	0	0	0	113.9	K68 D69	K68-S72 PolarHBondContact O-N 3.42Å; D69-S72 PolarHBondContact O-N 3.3Å; D69-S72 PolarHBondContact O-OG 2.87Å
73	H	63.3	Low	70.8	Confident	156 Å²	156	106.5 Å²	106.5	72%	0.722	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-13.1	177.4	-71.9	-72.9	0	0	0	114.1	D69 K71	D69-H73 PolarHBondContact O-CD2 3.13Å; K71-H73 PolarHBondContact O-N 2.77Å
74	H	62.4	Low	68.5	Low	172 Å²	172	108 Å²	108	80%	0.796	60%	0.598	S	S	*	*	S	Bend	trans	-91.3	-12	178.6	-71.1	-66.2	0	0	0	114.6	K71	K71-H74 PolarHBondContact O-N 3.24Å
75	T	59.2	Low	66.1	Low	103 Å²	103	107.2 Å²	107.2	63%	0.632	61%	0.607	S	S	*	*	S	Bend	trans	-128.9	115.1	172.6	57.2	0	0	0	0	106.1
76	A	54.6	Low	63.9	Low	93 Å²	93	107.9 Å²	107.9	77%	0.769	62%	0.615	S	S	*	*			trans	-34.1	129.1	-177.5	0	0	0	0	0	112	S78	A76-S78 PolarHBondContact O-N 3.39Å
77	P	50.5	Low	62	Low	93 Å²	93	110.2 Å²	110.2	60%	0.604	63%	0.627	S	S	*	*			trans	-63.9	102.6	-177	26	-32.8	0	0	0	108.4	Y79	P77-Y79 VanDerWaalsContact C-N 3.33Å; P77-Y79 PolarHBondContact O-N 3.33Å
78	S	47.6	Very low	60	Low	108 Å²	108	110 Å²	110	76%	0.755	63%	0.631	S	S	*	*			trans	-57.4	108.8	153.3	180	0	0	0	0	105.4	A76 G80	A76-S78 PolarHBondContact O-N 3.39Å; S78-G80 PolarHBondContact O-N 3.48Å
79	Y	48.4	Very low	58.3	Low	225 Å²	225	109.1 Å²	109.1	88%	0.882	64%	0.636	S	S	*	*			trans	-61.6	9.4	176.6	-104.9	-98.1	0	0	0	112.9	P77	P77-Y79 VanDerWaalsContact C-N 3.33Å; P77-Y79 PolarHBondContact O-N 3.33Å
80	G	42.8	Very low	56.8	Low	45 Å²	45	114.5 Å²	114.5	46%	0.464	66%	0.664	S	S	.	*	S	Bend	trans	-94.6	103	174.1	0	0	0	0	0	112.7	S78	S78-G80 PolarHBondContact O-N 3.48Å
81	Q	45.8	Very low	55	Low	190 Å²	190	116.8 Å²	116.8	89%	0.888	68%	0.675	S	S	*	*			trans	45.1	84.8	136.6	-58	-165.6	53.8	0	0	118.3
82	A	47.4	Very low	53.8	Low	85 Å²	85	114.9 Å²	114.9	70%	0.702	67%	0.669	S	S	*	*	S	Bend	trans	-137	59.2	160	0	0	0	0	0	111	K68	K68-A82 PolarHBondContact NZ-O 3.13Å
83	G	49.3	Very low	53	Low	68 Å²	68	114.3 Å²	114.3	70%	0.701	67%	0.672	S	S	*	*	S	Bend	trans	-153.1	-21.4	177.7	0	0	0	0	0	115.8
84	S	48.7	Very low	52.9	Low	103 Å²	103	112.5 Å²	112.5	72%	0.72	67%	0.674	S	S	*	*			trans	-135.7	46.1	-175.1	-57.3	0	0	0	0	112.3	I86	S84-I86 PolarHBondContact O-N 2.91Å
85	A	48.3	Very low	52.7	Low	80 Å²	80	111.9 Å²	111.9	66%	0.661	68%	0.675	S	S	*	*			trans	-72.6	81.2	152.5	0	0	0	0	0	106.7	I87	A85-I87 HydrophobicContact CB-CD1 3.89Å; A85-I87 HydrophobicContact CB-CG1 4.16Å; A85-I87 PolarHBondContact O-N 2.76Å
86	I	52.3	Low	52.6	Low	134 Å²	134	109 Å²	109	69%	0.687	66%	0.663	S	S	*	*			trans	-57.2	93.5	138.6	-57.6	-69.2	0	0	0	102.1	S84 N88	S84-I86 PolarHBondContact O-N 2.91Å; I86-N88 PolarHBondContact O-N 2.9Å
87	I	55.2	Low	52.8	Low	94 Å²	94	106.6 Å²	106.6	48%	0.482	64%	0.642	S	S	.	*			trans	-61.7	96.8	172.3	-60.4	-80.3	0	0	0	103.2	A85 P89 M92	A85-I87 HydrophobicContact CB-CD1 3.89Å; A85-I87 HydrophobicContact CB-CG1 4.16Å; A85-I87 PolarHBondContact O-N 2.76Å; I87-P89 WeakPolarHBondContact O-CD 3.11Å; I87-P89 VanDerWaalsContact O-N 3.15Å; I87-M92 HydrophobicContact CD1-CE 3.49Å; I87-M92 VanDerWaalsContact CD1-CE 3.49Å; I87-M92 HydrophobicContact CG2-CE 3.85Å; I87-M92 HydrophobicContact CG2-CG 4.16Å
88	N	53.6	Low	53.1	Low	101 Å²	101	104.1 Å²	104.1	54%	0.54	63%	0.63	S	S	.	*			trans	-64.6	108.7	161.6	-70.4	-46.5	0	0	0	103.5	I86 L90 Q91	I86-N88 PolarHBondContact O-N 2.9Å; N88-L90 PolarHBondContact O-N 2.95Å; N88-Q91 PolarHBondContact O-N 3.48Å; N88-Q91 VanDerWaalsContact O-N 3.11Å
89	P	59.1	Low	53.7	Low	95 Å²	95	102.1 Å²	102.1	62%	0.617	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	-11.6	-176.2	25.1	-33	0	0	0	112.1	I87	I87-P89 WeakPolarHBondContact O-CD 3.11Å; I87-P89 VanDerWaalsContact O-N 3.15Å
90	L	58.3	Low	54.2	Low	170 Å²	170	98.3 Å²	98.3	89%	0.89	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-14.1	178.8	-57.4	-154.2	0	0	0	114.9	N88	N88-L90 PolarHBondContact O-N 2.95Å
91	Q	52.9	Low	55	Low	168 Å²	168	103.9 Å²	103.9	79%	0.785	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-13.2	176.4	-172.1	171.1	39.9	0	0	112.9	N88 G93	N88-Q91 PolarHBondContact O-N 3.48Å; N88-Q91 VanDerWaalsContact O-N 3.11Å; Q91-G93 PolarHBondContact O-N 2.84Å; Q91-G93 VanDerWaalsContact O-N 3.14Å
92	M	57.2	Low	55.4	Low	76 Å²	76	101.6 Å²	101.6	37%	0.374	61%	0.614	S	S	.	*	S	Bend	trans	-74.7	107.6	174.2	-64.9	-59	160.1	0	0	107.8	I87 A96	I87-M92 HydrophobicContact CD1-CE 3.49Å; I87-M92 VanDerWaalsContact CD1-CE 3.49Å; I87-M92 HydrophobicContact CG2-CE 3.85Å; I87-M92 HydrophobicContact CG2-CG 4.16Å; M92-A96 HydrophobicContact CB-CB 3.83Å; M92-A96 HydrophobicContact CG-CB 4.38Å; M92-A96 HydrophobicContact SD-CB 4.16Å
93	G	56.5	Low	55.5	Low	42 Å²	42	103.6 Å²	103.6	43%	0.433	62%	0.618	S	S	.	*			trans	-49.8	155.7	172.7	0	0	0	0	0	111.2	Q91 L95 A96 A97	Q91-G93 PolarHBondContact O-N 2.84Å; Q91-G93 VanDerWaalsContact O-N 3.14Å; G93-L95 PolarHBondContact O-N 2.85Å; G93-A96 PolarHBondContact O-N 2.91Å; G93-A97 PolarHBondContact O-N 3.11Å
94	P	62	Low	55.3	Low	118 Å²	118	103.9 Å²	103.9	77%	0.766	62%	0.621	S	S	*	*	H	α-helix	trans	-52.6	-30.3	-165	15.7	-29.6	0	0	0	114.7	A98	P94-A98 VanDerWaalsContact O-CB 3.3Å; P94-A98 WeakPolarHBondContact O-CB 3.36Å; P94-A98 PolarHBondContact O-N 3.37Å
95	L	56.7	Low	55	Low	158 Å²	158	110 Å²	110	83%	0.827	63%	0.628	S	S	*	*	H	α-helix	trans	-60.4	-45.2	173	-107.3	132.1	0	0	0	113.8	G93 A99	G93-L95 PolarHBondContact O-N 2.85Å; L95-A99 PolarHBondContact O-N 3.15Å; L95-A99 VanDerWaalsContact O-N 3.15Å
96	A	57.5	Low	54.7	Low	44 Å²	44	111.7 Å²	111.7	36%	0.364	64%	0.635	S	S	.	*	H	α-helix	trans	-73.4	-33.6	-178.9	0	0	0	0	0	112	M92 G93	M92-A96 HydrophobicContact CB-CB 3.83Å; M92-A96 HydrophobicContact CG-CB 4.38Å; M92-A96 HydrophobicContact SD-CB 4.16Å; G93-A96 PolarHBondContact O-N 2.91Å
97	A	58	Low	54.8	Low	41 Å²	41	110.4 Å²	110.4	34%	0.339	63%	0.634	S	S	.	*	H	α-helix	trans	-69.8	-41.2	173	0	0	0	0	0	112.4	G93 A99 M100	G93-A97 PolarHBondContact O-N 3.11Å; A97-A99 PolarHBondContact O-N 3.49Å; A97-M100 PolarHBondContact O-N 3.1Å
98	A	58.4	Low	54.1	Low	42 Å²	42	109.4 Å²	109.4	35%	0.347	65%	0.647	S	S	.	*	H	α-helix	trans	-62	-41.3	176.6	0	0	0	0	0	112	P94 M100 Q101 H102	P94-A98 VanDerWaalsContact O-CB 3.3Å; P94-A98 WeakPolarHBondContact O-CB 3.36Å; P94-A98 PolarHBondContact O-N 3.37Å; A98-M100 PolarHBondContact O-N 2.98Å; A98-M100 VanDerWaalsContact O-N 3.09Å; A98-Q101 PolarHBondContact O-N 3.09Å; A98-H102 PolarHBondContact O-CD2 3.2Å
99	A	59.5	Low	53.8	Low	65 Å²	65	109.4 Å²	109.4	54%	0.537	66%	0.655	S	S	.	*	H	α-helix	trans	-56.5	-28.3	176.4	0	0	0	0	0	113.4	L95 A97	L95-A99 PolarHBondContact O-N 3.15Å; L95-A99 VanDerWaalsContact O-N 3.15Å; A97-A99 PolarHBondContact O-N 3.49Å
100	M	59.8	Low	53.2	Low	145 Å²	145	114 Å²	114	71%	0.714	66%	0.661	S	S	*	*	H	α-helix	trans	-81.2	-14.9	178.2	-59.9	-130.8	111.7	0	0	114.2	A97 A98 H102 V103	A97-M100 PolarHBondContact O-N 3.1Å; A98-M100 PolarHBondContact O-N 2.98Å; A98-M100 VanDerWaalsContact O-N 3.09Å; M100-H102 VanDerWaalsContact C-N 3.29Å; M100-H102 PolarHBondContact O-N 2.94Å; M100-V103 WeakPolarHBondContact O-CG2 3.3Å
101	Q	58.3	Low	52.7	Low	162 Å²	162	115 Å²	115	76%	0.757	67%	0.666	S	S	*	*	H	α-helix	trans	-79.2	-12.6	178.9	-63.8	-173	46.8	0	0	113	A98	A98-Q101 PolarHBondContact O-N 3.09Å
102	H	54.7	Low	52.4	Low	142 Å²	142	115 Å²	115	66%	0.657	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-0.6	-175.6	-59.7	-75.6	0	0	0	114.8	A98 M100 G104	A98-H102 PolarHBondContact O-CD2 3.2Å; M100-H102 VanDerWaalsContact C-N 3.29Å; M100-H102 PolarHBondContact O-N 2.94Å; H102-G104 VanDerWaalsContact C-N 3.34Å; H102-G104 PolarHBondContact O-N 3.11Å; H102-G104 VanDerWaalsContact O-N 3.13Å
103	V	49.5	Very low	52.4	Low	127 Å²	127	119.2 Å²	119.2	77%	0.77	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	64	179.4	-65	0	0	0	0	112.1	M100	M100-V103 WeakPolarHBondContact O-CG2 3.3Å
104	G	44.2	Very low	52.1	Low	75 Å²	75	120.6 Å²	120.6	77%	0.773	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-177.5	-10.6	174.9	0	0	0	0	0	116.5	H102 S106	H102-G104 VanDerWaalsContact C-N 3.34Å; H102-G104 PolarHBondContact O-N 3.11Å; H102-G104 VanDerWaalsContact O-N 3.13Å; G104-S106 PolarHBondContact O-N 3.14Å
105	R	43.5	Very low	51.7	Low	231 Å²	231	120.7 Å²	120.7	87%	0.872	69%	0.689	S	S	*	*			trans	-85.9	106.1	173.5	-165.6	165.3	161.7	-173.4	-6.8	109.2	T107	R105-T107 PolarHBondContact O-N 2.83Å
106	S	41.6	Very low	51.2	Low	116 Å²	116	121.3 Å²	121.3	81%	0.811	68%	0.681	S	S	*	*			trans	-67.9	105.8	178.4	168.7	0	0	0	0	111.7	G104	G104-S106 PolarHBondContact O-N 3.14Å
107	T	54.3	Low	50.7	Low	106 Å²	106	123 Å²	123	65%	0.65	68%	0.684	S	S	*	*			trans	-152	123.7	146.9	45.1	0	0	0	0	107.3	R105	R105-T107 PolarHBondContact O-N 2.83Å
108	G	40.4	Very low	50.8	Low	74 Å²	74	129.5 Å²	129.5	76%	0.763	71%	0.711	S	S	*	*			trans	-65.5	169.7	177.6	0	0	0	0	0	113.2
109	S	48.1	Very low	50.6	Low	100 Å²	100	133.1 Å²	133.1	70%	0.699	73%	0.729	S	S	*	*			trans	69.2	120.5	-168.8	-159.9	0	0	0	0	109.4
110	Y	45.5	Very low	50	Low	192 Å²	192	132 Å²	132	75%	0.753	73%	0.725	S	S	*	*				-156.5	110.8	62.2	9.9	-93.2	0	0	0	107.7	F112	Y110-F112 VanDerWaalsContact C-N 3.29Å; Y110-F112 PolarHBondContact O-N 2.91Å; Y110-F112 VanDerWaalsContact O-N 3.11Å
111	L	47.6	Very low	49.3	Very low	191 Å²	191	130.5 Å²	130.5	100%	1	72%	0.719	S	S	*	*			trans	-72.2	89.3	158.8	-72.5	166.6	0	0	0	106.8
112	F	46.6	Very low	48.9	Very low	169 Å²	169	129.4 Å²	129.4	74%	0.741	72%	0.716	S	S	*	*			trans	-143.6	88.3	170	-164.3	-102.2	0	0	0	108.6	Y110 V114	Y110-F112 VanDerWaalsContact C-N 3.29Å; Y110-F112 PolarHBondContact O-N 2.91Å; Y110-F112 VanDerWaalsContact O-N 3.11Å; F112-V114 HydrophobicContact CD1-CG2 3.55Å; F112-V114 HydrophobicContact CD2-CG2 4.06Å; F112-V114 HydrophobicContact CE1-CB 4.5Å; F112-V114 HydrophobicContact CE1-CG2 2.98Å; F112-V114 HydrophobicContact CE2-CG2 3.55Å; F112-V114 HydrophobicContact CG-CG2 4.08Å; F112-V114 HydrophobicContact CZ-CB 4.45Å; F112-V114 HydrophobicContact CZ-CG2 3Å
113	N	57	Low	48.5	Very low	163 Å²	163	127.9 Å²	127.9	87%	0.872	72%	0.721	S	S	*	*			trans	-121.8	109.8	148.9	-139.9	-6.9	0	0	0	106.1
114	V	50.7	Low	48.2	Very low	71 Å²	71	126.7 Å²	126.7	43%	0.43	72%	0.719	S	S	.	*	P	Polyproline II helix	trans	-69.2	140.1	-170.9	-170.8	0	0	0	0	109.5	F112 Y116	F112-V114 HydrophobicContact CD1-CG2 3.55Å; F112-V114 HydrophobicContact CD2-CG2 4.06Å; F112-V114 HydrophobicContact CE1-CB 4.5Å; F112-V114 HydrophobicContact CE1-CG2 2.98Å; F112-V114 HydrophobicContact CE2-CG2 3.55Å; F112-V114 HydrophobicContact CG-CG2 4.08Å; F112-V114 HydrophobicContact CZ-CB 4.45Å; F112-V114 HydrophobicContact CZ-CG2 3Å; V114-Y116 PolarHBondContact O-N 2.92Å
115	P	53.3	Low	48.3	Very low	121 Å²	121	128.6 Å²	128.6	79%	0.786	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-66.1	128	173.1	-13.3	27.9	0	0	0	110.8
116	Y	47.4	Very low	48.1	Very low	170 Å²	170	124 Å²	124	67%	0.667	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-84.1	130.3	160.3	-79.3	-96.9	0	0	0	108.1	V114	V114-Y116 PolarHBondContact O-N 2.92Å
117	D	46.3	Very low	47.8	Very low	81 Å²	81	122.1 Å²	122.1	43%	0.433	72%	0.721	S	S	.	*	P	Polyproline II helix	trans	-78.9	169.7	164.2	70.3	-88.9	0	0	0	111	T119 G120 N121	D117-T119 PolarHBondContact O-N 2.84Å; D117-G120 PolarHBondContact O-N 3.46Å; D117-N121 VanDerWaalsContact OD1-O 3.11Å
118	I	60	Low	46.8	Very low	176 Å²	176	122.1 Å²	122.1	90%	0.903	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-8.8	-155.4	-140.8	163.5	0	0	0	115.2
119	T	55.4	Low	46.9	Very low	118 Å²	118	126.3 Å²	126.3	72%	0.724	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.6	3.9	173.1	62.3	0	0	0	0	114	D117 N121	D117-T119 PolarHBondContact O-N 2.84Å; T119-N121 VanDerWaalsContact C-N 3.33Å; T119-N121 PolarHBondContact O-N 3.24Å
120	G	46.6	Very low	46.2	Very low	43 Å²	43	128.9 Å²	128.9	44%	0.443	73%	0.734	S	S	.	*			trans	75.2	16.1	170.2	0	0	0	0	0	115.1	D117	D117-G120 PolarHBondContact O-N 3.46Å
121	N	44.3	Very low	45.6	Very low	112 Å²	112	123 Å²	123	60%	0.599	73%	0.733	S	S	*	*			trans	-98.5	137.2	176.3	-161.2	20	0	0	0	111.9	D117 T119 S123	D117-N121 VanDerWaalsContact OD1-O 3.11Å; T119-N121 VanDerWaalsContact C-N 3.33Å; T119-N121 PolarHBondContact O-N 3.24Å; N121-S123 PolarHBondContact O-N 3.42Å
122	M	49.8	Very low	45.3	Very low	139 Å²	139	120 Å²	120	69%	0.685	72%	0.724	S	S	*	*			trans	-80	96.6	-177.2	53.6	-178.3	88.2	0	0	110.7	S124	M122-S124 PolarHBondContact O-N 3.23Å
123	S	45.9	Very low	44.9	Very low	110 Å²	110	120.7 Å²	120.7	77%	0.769	73%	0.727	S	S	*	*			trans	-77.3	92.1	172	75.6	0	0	0	0	110.4	N121 S125	N121-S123 PolarHBondContact O-N 3.42Å; S123-S125 PolarHBondContact O-N 2.98Å
124	S	44.2	Very low	43.8	Very low	103 Å²	103	120 Å²	120	72%	0.72	72%	0.723	S	S	*	*			trans	-60.1	110.3	165	-48	0	0	0	0	109.7	M122	M122-S124 PolarHBondContact O-N 3.23Å
125	S	45.7	Very low	42.9	Very low	115 Å²	115	125.9 Å²	125.9	80%	0.804	74%	0.743	S	S	*	*			trans	-165	124.1	146.1	-90.7	0	0	0	0	112.3	S123	S123-S125 PolarHBondContact O-N 2.98Å
126	C	39.3	Very low	42.1	Very low	134 Å²	134	127.3 Å²	127.3	91%	0.905	74%	0.743	S	S	*	*			trans	-50.4	137.4	168.5	48.3	0	0	0	0	112
127	G	36	Very low	41.5	Very low	77 Å²	77	127.7 Å²	127.7	79%	0.794	75%	0.75	S	S	*	*			trans	-160.9	66.8	178.8	0	0	0	0	0	110.9
128	S	33.7	Very low	41.3	Very low	106 Å²	106	135.9 Å²	135.9	74%	0.741	79%	0.786	S	S	*	*			trans	-55	129	161.2	-177.8	0	0	0	0	109.4
129	I	42	Very low	40.4	Very low	161 Å²	161	133.9 Å²	133.9	83%	0.826	78%	0.78	S	S	*	*				-165.6	130.7	126.9	45.1	170	0	0	0	111.3
130	N	32.3	Very low	39.6	Very low	154 Å²	154	134.7 Å²	134.7	82%	0.824	78%	0.783	S	S	*	*			trans	-49.9	152.9	165.7	-61.8	-89.6	0	0	0	113.3
131	G	32.9	Very low	39.2	Very low	70 Å²	70	139.8 Å²	139.8	72%	0.722	80%	0.802	S	S	*	*			trans	132.3	124.2	138.2	0	0	0	0	0	115.9
132	P	42.3	Very low	38.9	Very low	127 Å²	127	141.4 Å²	141.4	83%	0.825	81%	0.814	S	S	*	*			trans	-89.4	-178.8	174.1	38.2	-33.4	0	0	0	111.6
133	K	38.1	Very low	38.2	Very low	183 Å²	183	141.6 Å²	141.6	80%	0.796	82%	0.822	S	S	*	*			trans	85.1	124.2	173.8	-129.7	179	179.8	177.8	0	110.7
134	L	33.2	Very low	37.7	Very low	149 Å²	149	143.7 Å²	143.7	78%	0.78	83%	0.826	S	S	*	*				-162.5	120.2	71.9	-73	163.7	0	0	0	107.3
135	F	31.4	Very low	37.2	Very low	195 Å²	195	146.6 Å²	146.6	86%	0.855	83%	0.833	S	S	*	*				65	117.8	103.7	-127	-93.9	0	0	0	115.3
136	L	36.8	Very low	36.6	Very low	150 Å²	150	149 Å²	149	79%	0.785	84%	0.835	S	S	*	*			trans	-52.8	142.3	172.1	-166.4	74.6	0	0	0	112.1
137	H	34.6	Very low	36.4	Very low	178 Å²	178	150.3 Å²	150.3	82%	0.824	83%	0.829	S	S	*	*			trans	-145	120.8	147.9	-125.9	-105.2	0	0	0	110
138	E	43.1	Very low	36.4	Very low	253 Å²	253	156.9 Å²	156.9	100%	1.182	83%	0.833	S	S	*	*			trans	28.9	0	163.6	-144	166.7	102.2	0	0	120.5

Retrieved 138 of 138 residues in 473.5 ms (Link to these results)

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