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NADH dehydrogenase [ubiquinone] 1 alpha subcomplex subunit 8

Accessory subunit of the mitochondrial membrane respiratory chain NADH dehydrogenase (Complex I), that is believed not to be involved in catalysis. Complex I functions in the transfer of electrons from NADH to the respiratory chain. The immediate electron acceptor for the enzyme is believed to be ubiquinone.

AlphaFold DB , UniProt , Accession G4VIB9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 178 aa.

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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	39.1	Very low	74.2	Confident	242 Å²	242	117.9 Å²	117.9	100%	1.192	63%	0.633	S	S	*	*				0	119.3	0	-70.2	166.8	85.3	0	0	106.6	S3	M1-S3 PolarHBondContact O-N 3.45Å
2	V	53.1	Low	75.8	Confident	117 Å²	117	121.6 Å²	121.6	71%	0.709	64%	0.644	S	S	*	*			trans	-76.3	114.9	170	-177.1	0	0	0	0	105.5	V6 L8	V2-V6 HydrophobicContact CG1-CB 4.39Å; V2-L8 HydrophobicContact CG1-CD1 4.33Å
3	S	53.1	Low	76.9	Confident	63 Å²	63	119.2 Å²	119.2	44%	0.441	63%	0.627	S	S	.	*			trans	-67	149.6	174.4	46	0	0	0	0	109.7	M1 D5 V6	M1-S3 PolarHBondContact O-N 3.45Å; S3-D5 PolarHBondContact O-N 3.06Å; S3-V6 PolarHBondContact O-N 3.33Å
4	L	64.4	Low	78	Confident	181 Å²	181	116.9 Å²	116.9	95%	0.948	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	-17.8	-179.8	-76.9	154.6	0	0	0	113.3	V6	L4-V6 VanDerWaalsContact C-N 3.3Å; L4-V6 PolarHBondContact O-N 3.31Å
5	D	76.2	Confident	79	Confident	148 Å²	148	115.5 Å²	115.5	79%	0.791	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-5.6	-174.1	-50.3	-41.2	0	0	0	114	S3 H7	S3-D5 PolarHBondContact O-N 3.06Å; D5-H7 PolarHBondContact O-N 3.07Å
6	V	81.9	Confident	79.9	Confident	55 Å²	55	110.5 Å²	110.5	33%	0.333	59%	0.588	S	S	.	*			trans	-93.1	104.3	-172.8	-178.7	0	0	0	0	110.6	V2 S3 L4 L8	V2-V6 HydrophobicContact CG1-CB 4.39Å; S3-V6 PolarHBondContact O-N 3.33Å; L4-V6 VanDerWaalsContact C-N 3.3Å; L4-V6 PolarHBondContact O-N 3.31Å; V6-L8 PolarHBondContact O-N 3.27Å
7	H	83	Confident	80.7	Confident	157 Å²	157	109.4 Å²	109.4	73%	0.727	59%	0.588	S	S	*	*			trans	-66.6	102.4	178.5	179.1	66.5	0	0	0	112.6	D5 R55	D5-H7 PolarHBondContact O-N 3.07Å; H7-R55 VanDerWaalsContact O-CD 3.29Å; H7-R55 WeakPolarHBondContact O-CD 3.37Å; H7-R55 VanDerWaalsContact O-CZ 3.29Å; H7-R55 PolarHBondContact O-NE 3.22Å; H7-R55 PolarHBondContact O-NH1 3.02Å
8	L	89.2	Confident	81.4	Confident	98 Å²	98	110.5 Å²	110.5	51%	0.513	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-93.6	143.2	176	-69.7	166.5	0	0	0	110.9	V2 V6 R55	V2-L8 HydrophobicContact CG1-CD1 4.33Å; V6-L8 PolarHBondContact O-N 3.27Å; L8-R55 VanDerWaalsContact CD2-NH2 3.27Å
9	P	91.1	Very high	82	Confident	24 Å²	24	107.6 Å²	107.6	16%	0.156	57%	0.574	C	S	.	*	P	Polyproline II helix	trans	-64.2	155.9	174.8	29.5	-36	0	0	0	111	E13 L14 L58	P9-E13 HydrophobicContact CB-CB 4.41Å; P9-E13 WeakPolarHBondContact CB-OE2 2.98Å; P9-L14 HydrophobicContact CB-CG 4.48Å; P9-L14 HydrophobicContact CG-CD1 4.17Å; P9-L14 HydrophobicContact CG-CD2 3.92Å; P9-L14 HydrophobicContact CG-CG 4.07Å; P9-L58 HydrophobicContact CB-CD1 3.92Å; P9-L58 HydrophobicContact CG-CD1 4.03Å
10	T	92.6	Very high	82.6	Confident	70 Å²	70	112.2 Å²	112.2	43%	0.429	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-69.1	157.7	176.7	62.8	0	0	0	0	111.5	E12 E13 L14	T10-E12 PolarHBondContact O-N 2.92Å; T10-E13 PolarHBondContact O-N 3.34Å; T10-E13 VanDerWaalsContact OG1-CG 3.28Å; T10-E13 WeakPolarHBondContact OG1-CG 3Å; T10-E13 PolarHBondContact OG1-N 3.36Å; T10-E13 PolarHBondContact OG1-OE1 2.94Å; T10-L14 PolarHBondContact O-N 2.71Å
11	I	92.6	Very high	83	Confident	142 Å²	142	109.9 Å²	109.9	73%	0.728	58%	0.576	S	S	*	*	H	α-helix	trans	-60.8	-38.6	177.7	-63	167.3	0	0	0	110.2	E13 L14 T15	I11-E13 VanDerWaalsContact C-N 3.35Å; I11-E13 PolarHBondContact O-N 3.44Å; I11-L14 PolarHBondContact O-N 3.43Å; I11-L14 VanDerWaalsContact O-N 3.09Å; I11-T15 HydrophobicContact CG2-CG2 4.41Å; I11-T15 VanDerWaalsContact O-CG2 3.26Å; I11-T15 WeakPolarHBondContact O-CG2 3.08Å; I11-T15 PolarHBondContact O-N 3.34Å
12	E	92.7	Very high	85.6	Confident	162 Å²	162	102 Å²	102	76%	0.757	54%	0.544	S	S	*	.	H	α-helix	trans	-60.5	-42.5	178.4	-61.9	-178.4	179.3	0	0	111.8	T10 L14 T15	T10-E12 PolarHBondContact O-N 2.92Å; E12-L14 VanDerWaalsContact C-N 3.26Å; E12-L14 PolarHBondContact O-N 3.44Å; E12-T15 PolarHBondContact O-N 3.3Å; E12-T15 PolarHBondContact O-OG1 3.06Å
13	E	90.9	Very high	87.4	Confident	90 Å²	90	102.7 Å²	102.7	42%	0.421	54%	0.538	S	S	.	.	H	α-helix	trans	-62.9	-32.7	174.3	-76.4	161.3	-132.2	0	0	112.8	P9 T10 I11 K62	P9-E13 HydrophobicContact CB-CB 4.41Å; P9-E13 WeakPolarHBondContact CB-OE2 2.98Å; T10-E13 PolarHBondContact O-N 3.34Å; T10-E13 VanDerWaalsContact OG1-CG 3.28Å; T10-E13 WeakPolarHBondContact OG1-CG 3Å; T10-E13 PolarHBondContact OG1-N 3.36Å; T10-E13 PolarHBondContact OG1-OE1 2.94Å; I11-E13 VanDerWaalsContact C-N 3.35Å; I11-E13 PolarHBondContact O-N 3.44Å; E13-K62 WeakPolarHBondContact O-CE 3.48Å; E13-K62 PolarHBondContact O-NZ 3.24Å
14	L	92.3	Very high	89.3	Confident	87 Å²	87	100 Å²	100	46%	0.455	52%	0.519	S	S	.	.	H	α-helix	trans	-79.9	-18.4	178.4	-67	172.1	0	0	0	113	P9 T10 I11 E12 V16 L58	P9-L14 HydrophobicContact CB-CG 4.48Å; P9-L14 HydrophobicContact CG-CD1 4.17Å; P9-L14 HydrophobicContact CG-CD2 3.92Å; P9-L14 HydrophobicContact CG-CG 4.07Å; T10-L14 PolarHBondContact O-N 2.71Å; I11-L14 PolarHBondContact O-N 3.43Å; I11-L14 VanDerWaalsContact O-N 3.09Å; E12-L14 VanDerWaalsContact C-N 3.26Å; E12-L14 PolarHBondContact O-N 3.44Å; L14-V16 PolarHBondContact O-N 2.87Å; L14-L58 HydrophobicContact CD2-CD1 4.07Å; L14-L58 HydrophobicContact CD2-CD2 3.95Å
15	T	92.7	Very high	90.7	Very high	96 Å²	96	91.9 Å²	91.9	59%	0.589	48%	0.477	S	S	*	.			trans	-69.2	117.6	-180	61.7	0	0	0	0	112.2	I11 E12	I11-T15 HydrophobicContact CG2-CG2 4.41Å; I11-T15 VanDerWaalsContact O-CG2 3.26Å; I11-T15 WeakPolarHBondContact O-CG2 3.08Å; I11-T15 PolarHBondContact O-N 3.34Å; E12-T15 PolarHBondContact O-N 3.3Å; E12-T15 PolarHBondContact O-OG1 3.06Å
16	V	93.1	Very high	91.6	Very high	36 Å²	36	88.5 Å²	88.5	22%	0.218	46%	0.459	C	S	.	.			trans	-138.1	145.6	179.3	-176.9	0	0	0	0	108.2	L14 E18 K62 T65	L14-V16 PolarHBondContact O-N 2.87Å; V16-E18 PolarHBondContact O-N 3.37Å; V16-E18 VanDerWaalsContact O-N 3.08Å; V16-K62 HydrophobicContact CG1-CG 4.4Å; V16-K62 HydrophobicContact CG2-CD 4.06Å; V16-K62 HydrophobicContact CG2-CG 3.53Å; V16-T65 WeakPolarHBondContact CG1-OG1 3.35Å
17	P	93.4	Very high	92.2	Very high	91 Å²	91	88.8 Å²	88.8	59%	0.591	46%	0.458	S	S	*	.			trans	-60.5	115.4	170.6	25	-34.8	0	0	0	110.2	H69	P17-H69 PolarHBondContact O-NE2 3.31Å
18	E	93.5	Very high	92.7	Very high	130 Å²	130	81.5 Å²	81.5	61%	0.607	43%	0.425	S	S	*	.			trans	-78.1	150.2	-178.9	-64.8	-62.5	168.7	0	0	113.3	V16 K20 H69	V16-E18 PolarHBondContact O-N 3.37Å; V16-E18 VanDerWaalsContact O-N 3.08Å; E18-K20 PolarHBondContact O-N 3.28Å; E18-H69 PolarHBondContact O-CE1 3Å
19	L	93.2	Very high	93	Very high	56 Å²	56	76.8 Å²	76.8	29%	0.293	40%	0.4	S	S	.	.			trans	-79.3	96.1	170.8	-66.1	171.1	0	0	0	109.9	I21 A68 F72	L19-I21 PolarHBondContact O-N 3.09Å; L19-A68 HydrophobicContact CD1-CB 3.53Å; L19-A68 HydrophobicContact CD2-CB 4.01Å; L19-A68 HydrophobicContact CG-CB 4.33Å; L19-F72 HydrophobicContact CD2-CD2 4.07Å; L19-F72 HydrophobicContact CD2-CE2 4.44Å
20	K	93.3	Very high	93.1	Very high	199 Å²	199	78 Å²	78	87%	0.865	41%	0.409	S	S	*	.			trans	-78.3	61.1	179.3	-61	-177.6	-178.3	-179.5	0	112.4	E18	E18-K20 PolarHBondContact O-N 3.28Å
21	I	92.6	Very high	93.2	Very high	64 Å²	64	76.7 Å²	76.7	33%	0.328	40%	0.399	S	S	.	.			trans	-126.5	140.7	-173.7	-59.6	176.1	0	0	0	109.3	L19 P25 L26 F72	L19-I21 PolarHBondContact O-N 3.09Å; I21-P25 HydrophobicContact CG2-CB 3.7Å; I21-P25 HydrophobicContact CG2-CG 3.46Å; I21-P25 VanDerWaalsContact CG2-CG 3.46Å; I21-L26 HydrophobicContact CG2-CB 4.49Å; I21-F72 HydrophobicContact CD1-CB 4.44Å; I21-F72 HydrophobicContact CD1-CD1 3.76Å; I21-F72 HydrophobicContact CD1-CD2 3.46Å; I21-F72 VanDerWaalsContact CD1-CD2 3.46Å; I21-F72 HydrophobicContact CD1-CE1 3.76Å; I21-F72 HydrophobicContact CD1-CE2 3.48Å; I21-F72 VanDerWaalsContact CD1-CE2 3.48Å; I21-F72 HydrophobicContact CD1-CG 3.62Å; I21-F72 HydrophobicContact CD1-CZ 3.63Å
22	S	92.7	Very high	93.4	Very high	76 Å²	76	69.9 Å²	69.9	53%	0.531	36%	0.364	S	S	.	.			trans	-78.9	166.9	177.3	64.3	0	0	0	0	112.4	C24 P25 L26	S22-C24 VanDerWaalsContact C-N 3.31Å; S22-C24 PolarHBondContact O-N 3.42Å; S22-P25 VanDerWaalsContact O-CD 3.28Å; S22-P25 WeakPolarHBondContact O-CD 3.38Å; S22-P25 WeakPolarHBondContact O-CG 3.29Å; S22-P25 WeakPolarHBondContact OG-CD 3.47Å; S22-P25 VanDerWaalsContact OG-CG 3.31Å; S22-P25 WeakPolarHBondContact OG-CG 3.47Å; S22-L26 PolarHBondContact O-N 2.05Å
23	K	91	Very high	93.5	Very high	132 Å²	132	63.5 Å²	63.5	57%	0.574	34%	0.335	S	S	*	.	H	α-helix	trans	-54.3	-41.4	-176.7	-179.6	176.2	176.8	176.4	0	114	L26 L27 Y98	K23-L26 PolarHBondContact O-N 3.03Å; K23-L27 WeakPolarHBondContact O-CB 3.49Å; K23-L27 PolarHBondContact O-N 3.38Å; K23-Y98 HydrophobicContact CD-CE2 3.8Å
24	C	93	Very high	93.8	Very high	6 Å²	6	60.1 Å²	60.1	4%	0.041	33%	0.325	C	S	.	.	H	α-helix	trans	-64.5	-55.1	-175.6	-62.4	0	0	0	0	113.4	S22 L26 L27 A28 H91 Y98	S22-C24 VanDerWaalsContact C-N 3.31Å; S22-C24 PolarHBondContact O-N 3.42Å; C24-L26 VanDerWaalsContact C-N 3.29Å; C24-L26 PolarHBondContact O-N 2.88Å; C24-L27 PolarHBondContact O-N 3.17Å; C24-A28 WeakPolarHBondContact O-CB 3.48Å; C24-A28 PolarHBondContact O-N 3.14Å; C24-H91 HydrophobicContact CB-CB 4.47Å; C24-Y98 WeakPolarHBondContact SG-CE1 3.03Å
25	P	94.1	Very high	93.9	Very high	11 Å²	11	59.2 Å²	59.2	7%	0.071	32%	0.317	C	S	.	.	H	α-helix	trans	-60.7	-36.4	175.4	15.9	-26.9	0	0	0	112.8	I21 S22 A28 A29 F83 F87	I21-P25 HydrophobicContact CG2-CB 3.7Å; I21-P25 HydrophobicContact CG2-CG 3.46Å; I21-P25 VanDerWaalsContact CG2-CG 3.46Å; S22-P25 VanDerWaalsContact O-CD 3.28Å; S22-P25 WeakPolarHBondContact O-CD 3.38Å; S22-P25 WeakPolarHBondContact O-CG 3.29Å; S22-P25 WeakPolarHBondContact OG-CD 3.47Å; S22-P25 VanDerWaalsContact OG-CG 3.31Å; S22-P25 WeakPolarHBondContact OG-CG 3.47Å; P25-A28 PolarHBondContact O-N 2.78Å; P25-A29 WeakPolarHBondContact O-CB 3.39Å; P25-A29 PolarHBondContact O-N 3.34Å; P25-F83 HydrophobicContact CB-CE1 3.96Å; P25-F83 HydrophobicContact CB-CZ 3.66Å; P25-F83 WeakPolarHBondContact O-CZ 3.41Å; P25-F87 HydrophobicContact CB-CB 4.28Å; P25-F87 HydrophobicContact CB-CD1 4.07Å; P25-F87 HydrophobicContact CB-CG 4.12Å
26	L	95.1	Very high	94.1	Very high	77 Å²	77	57.7 Å²	57.7	40%	0.403	30%	0.302	S	S	.	.	H	α-helix	trans	-62.4	-45.7	174.6	-175	64	0	0	0	111.6	I21 S22 K23 C24 A29 S30 L33 F72	I21-L26 HydrophobicContact CG2-CB 4.49Å; S22-L26 PolarHBondContact O-N 2.05Å; K23-L26 PolarHBondContact O-N 3.03Å; C24-L26 VanDerWaalsContact C-N 3.29Å; C24-L26 PolarHBondContact O-N 2.88Å; L26-A29 PolarHBondContact O-N 3.09Å; L26-S30 PolarHBondContact O-N 2.94Å; L26-L33 HydrophobicContact CD1-CD2 4.15Å; L26-F72 HydrophobicContact CD1-CZ 4.24Å
27	L	93.3	Very high	94.3	Very high	61 Å²	61	56.2 Å²	56.2	32%	0.319	29%	0.294	S	S	.	.	H	α-helix	trans	-64.1	-42.3	176.8	-175.1	70.7	0	0	0	111.8	K23 C24 A29 S30 Y98	K23-L27 WeakPolarHBondContact O-CB 3.49Å; K23-L27 PolarHBondContact O-N 3.38Å; C24-L27 PolarHBondContact O-N 3.17Å; L27-A29 VanDerWaalsContact C-N 3.29Å; L27-A29 PolarHBondContact O-N 3.33Å; L27-S30 WeakPolarHBondContact O-CB 3.08Å; L27-S30 PolarHBondContact O-N 3.1Å; L27-S30 PolarHBondContact O-OG 2.7Å; L27-Y98 HydrophobicContact CD2-CD1 4.47Å; L27-Y98 HydrophobicContact CD2-CD2 4.5Å; L27-Y98 HydrophobicContact CD2-CG 3.86Å
28	A	94.2	Very high	94.3	Very high	3 Å²	3	52.5 Å²	52.5	3%	0.025	27%	0.269	C	S	.	.	H	α-helix	trans	-57.3	-43.6	177.4	0	0	0	0	0	111.5	C24 P25 F83 Y86 F87 L90	C24-A28 WeakPolarHBondContact O-CB 3.48Å; C24-A28 PolarHBondContact O-N 3.14Å; P25-A28 PolarHBondContact O-N 2.78Å; A28-F83 HydrophobicContact CB-CE2 3.89Å; A28-Y86 HydrophobicContact CB-CD1 3.68Å; A28-Y86 HydrophobicContact CB-CE1 3.65Å; A28-Y86 WeakPolarHBondContact O-CE1 3.14Å; A28-F87 HydrophobicContact CB-CB 3.91Å; A28-L90 HydrophobicContact CB-CD1 3.77Å
29	A	94.9	Very high	94.4	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-85.9	-14.4	-177.4	0	0	0	0	0	114.2	P25 L26 L27 I31 H32 L33 F71 F72 F83	P25-A29 WeakPolarHBondContact O-CB 3.39Å; P25-A29 PolarHBondContact O-N 3.34Å; L26-A29 PolarHBondContact O-N 3.09Å; L27-A29 VanDerWaalsContact C-N 3.29Å; L27-A29 PolarHBondContact O-N 3.33Å; A29-I31 VanDerWaalsContact C-N 3.32Å; A29-I31 PolarHBondContact O-N 2.89Å; A29-I31 VanDerWaalsContact O-N 3.12Å; A29-H32 PolarHBondContact O-N 3.17Å; A29-L33 WeakPolarHBondContact O-CB 3.19Å; A29-L33 PolarHBondContact O-N 3.09Å; A29-F71 HydrophobicContact CB-CE1 3.88Å; A29-F71 HydrophobicContact CB-CZ 4.46Å; A29-F72 HydrophobicContact CB-CE1 3.84Å; A29-F72 HydrophobicContact CB-CZ 4.13Å; A29-F83 HydrophobicContact CB-CE2 3.79Å; A29-F83 HydrophobicContact CB-CZ 4.13Å
30	S	94.3	Very high	94.5	Very high	48 Å²	48	52.2 Å²	52.2	34%	0.336	27%	0.269	S	S	.	.	H	α-helix	trans	-47.2	-45.5	-168.8	60.1	0	0	0	0	115.2	L26 L27 G34	L26-S30 PolarHBondContact O-N 2.94Å; L27-S30 WeakPolarHBondContact O-CB 3.08Å; L27-S30 PolarHBondContact O-N 3.1Å; L27-S30 PolarHBondContact O-OG 2.7Å; S30-G34 PolarHBondContact O-N 2.93Å
31	I	94.6	Very high	94.6	Very high	43 Å²	43	44.4 Å²	44.4	22%	0.221	24%	0.24	C	C	.	.	H	α-helix	trans	-68.3	-38.2	-176.5	-71.8	168.7	0	0	0	111.6	A29 K35 R122 P123 F128	A29-I31 VanDerWaalsContact C-N 3.32Å; A29-I31 PolarHBondContact O-N 2.89Å; A29-I31 VanDerWaalsContact O-N 3.12Å; I31-K35 PolarHBondContact O-N 3.36Å; I31-R122 HydrophobicContact CG2-CG 3.87Å; I31-P123 HydrophobicContact CG2-CG 3.99Å; I31-F128 HydrophobicContact CG2-CE2 4.43Å
32	H	95.9	Very high	94.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-79	-39.9	177.2	-71.3	-65.2	0	0	0	111.9	A29 G34 K35 F36 F71 F110 D111 I114 Q120	A29-H32 PolarHBondContact O-N 3.17Å; H32-G34 VanDerWaalsContact C-N 3.32Å; H32-G34 PolarHBondContact O-N 2.03Å; H32-K35 PolarHBondContact O-N 3.43Å; H32-F36 WeakPolarHBondContact O-CB 3.03Å; H32-F36 PolarHBondContact O-N 3.26Å; H32-F71 HydrophobicContact CB-CE2 4.03Å; H32-F71 HydrophobicContact CB-CZ 3.77Å; H32-F110 AromaticContact CD2-CE1 3.69Å; H32-D111 IonicContact CD2-OD1 3.18Å; H32-D111 IonicContact CE1-OD1 2.7Å; H32-D111 IonicContact NE2-OD1 3.14Å; H32-D111 PolarHBondContact NE2-OD1 2.72Å; H32-I114 HydrophobicContact CB-CD1 3.92Å; H32-I114 WeakPolarHBondContact CD2-CD1 3.45Å; H32-Q120 PolarHBondContact O-NE2 3.26Å
33	L	96.1	Very high	94.8	Very high	27 Å²	27	41.4 Å²	41.4	14%	0.141	22%	0.215	C	C	.	.	H	α-helix	trans	-58.4	-45.4	174.6	179.3	67.4	0	0	0	110.9	L26 A29 K35 F36 C37 A68 F71 F72	L26-L33 HydrophobicContact CD1-CD2 4.15Å; A29-L33 WeakPolarHBondContact O-CB 3.19Å; A29-L33 PolarHBondContact O-N 3.09Å; L33-K35 VanDerWaalsContact C-N 3.29Å; L33-K35 PolarHBondContact O-N 2.91Å; L33-F36 PolarHBondContact O-N 3.08Å; L33-C37 PolarHBondContact O-N 3.38Å; L33-A68 HydrophobicContact CD1-CB 3.99Å; L33-F71 HydrophobicContact CB-CD1 4.17Å; L33-F71 HydrophobicContact CB-CE1 4.02Å; L33-F71 HydrophobicContact CB-CZ 4.44Å; L33-F71 HydrophobicContact CD1-CB 3.9Å; L33-F71 HydrophobicContact CD1-CD1 3.55Å; L33-F71 HydrophobicContact CD1-CE1 4.26Å; L33-F71 HydrophobicContact CD1-CG 3.78Å; L33-F71 HydrophobicContact CG-CD1 4.44Å; L33-F72 HydrophobicContact CD2-CE2 4.35Å
34	G	95.8	Very high	95.1	Very high	20 Å²	20	38 Å²	38	21%	0.206	20%	0.2	C	C	.	.	H	α-helix	trans	-66.8	-27.1	179.2	0	0	0	0	0	114	S30 H32 D38	S30-G34 PolarHBondContact O-N 2.93Å; H32-G34 VanDerWaalsContact C-N 3.32Å; H32-G34 PolarHBondContact O-N 2.03Å; G34-D38 WeakPolarHBondContact O-CA 3.47Å; G34-D38 WeakPolarHBondContact O-CB 3.49Å; G34-D38 PolarHBondContact O-N 3.1Å
35	K	95.6	Very high	95.2	Very high	67 Å²	67	41.3 Å²	41.3	29%	0.291	22%	0.216	S	C	.	.	H	α-helix	trans	-81	-37.9	172.7	-178.2	173.3	173.6	177.8	0	112	I31 H32 L33 D38 Q120 E121 P123	I31-K35 PolarHBondContact O-N 3.36Å; H32-K35 PolarHBondContact O-N 3.43Å; L33-K35 VanDerWaalsContact C-N 3.29Å; L33-K35 PolarHBondContact O-N 2.91Å; K35-D38 WeakPolarHBondContact O-CB 3.39Å; K35-Q120 HydrophobicContact CD-CG 3.69Å; K35-Q120 HydrophobicContact CG-CG 4.11Å; K35-E121 WeakPolarHBondContact CD-O 3.19Å; K35-E121 PolarHBondContact NZ-O 3.02Å; K35-P123 HydrophobicContact CB-CG 3.89Å; K35-P123 HydrophobicContact CD-CG 3.76Å; K35-P123 HydrophobicContact CG-CG 4.3Å
36	F	96.2	Very high	95.1	Very high	65 Å²	65	43 Å²	43	29%	0.285	22%	0.224	S	C	.	.	H	α-helix	trans	-68.3	-47.1	179.7	-174	-95.7	0	0	0	111.5	H32 L33 D38 F71 L118	H32-F36 WeakPolarHBondContact O-CB 3.03Å; H32-F36 PolarHBondContact O-N 3.26Å; L33-F36 PolarHBondContact O-N 3.08Å; F36-D38 VanDerWaalsContact C-N 3.34Å; F36-D38 PolarHBondContact O-N 3.06Å; F36-F71 HydrophobicContact CB-CD2 3.8Å; F36-F71 HydrophobicContact CB-CE2 4.27Å; F36-F71 HydrophobicContact CD1-CB 3.7Å; F36-F71 AromaticContact CD1-CD2 3.89Å; F36-F71 HydrophobicContact CD1-CD2 3.89Å; F36-F71 HydrophobicContact CD1-CG 4.21Å; F36-F71 HydrophobicContact CD2-CD2 4.19Å; F36-F71 HydrophobicContact CE1-CB 3.91Å; F36-F71 HydrophobicContact CG-CB 4.4Å; F36-F71 AromaticContact CG-CD2 3.7Å; F36-F71 HydrophobicContact CG-CD2 3.7Å; F36-F71 HydrophobicContact CG-CG 4.45Å; F36-L118 HydrophobicContact CD2-CD2 4.45Å; F36-L118 HydrophobicContact CE2-CD2 4.46Å
37	C	96.5	Very high	95.1	Very high	5 Å²	5	39.4 Å²	39.4	3%	0.034	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	28.1	179.9	-61.9	0	0	0	0	113.3	L33 N39 S41 C67	L33-C37 PolarHBondContact O-N 3.38Å; C37-N39 VanDerWaalsContact C-N 3.33Å; C37-N39 PolarHBondContact O-N 3.36Å; C37-S41 VanDerWaalsContact O-CB 3.28Å; C37-S41 WeakPolarHBondContact O-CB 3.33Å; C37-S41 PolarHBondContact O-N 3.48Å; C37-S41 PolarHBondContact O-OG 2.86Å; C37-C67 WeakPolarHBondContact CA-SG 3.49Å; C37-C67 HydrophobicContact CB-CB 4Å; C37-C67 WeakPolarHBondContact CB-SG 3.49Å; C37-C67 WeakPolarHBondContact SG-CB 3.45Å; C37-C67 CovalentContact SG-SG 2.05Å; C37-C67 PolarHBondContact SG-SG 3.04Å
38	D	95	Very high	95.1	Very high	13 Å²	13	40.2 Å²	40.2	7%	0.07	21%	0.208	C	C	.	.	H	α-helix	trans	-63.4	-38.3	-172.9	-166.5	9.9	0	0	0	112.4	G34 K35 F36 K42 Y127 R132	G34-D38 WeakPolarHBondContact O-CA 3.47Å; G34-D38 WeakPolarHBondContact O-CB 3.49Å; G34-D38 PolarHBondContact O-N 3.1Å; K35-D38 WeakPolarHBondContact O-CB 3.39Å; F36-D38 VanDerWaalsContact C-N 3.34Å; F36-D38 PolarHBondContact O-N 3.06Å; D38-K42 WeakPolarHBondContact O-CD 3.49Å; D38-K42 VanDerWaalsContact O-CG 3.25Å; D38-K42 WeakPolarHBondContact O-CG 3.5Å; D38-K42 PolarHBondContact O-N 3.25Å; D38-K42 VanDerWaalsContact O-N 3.07Å; D38-K42 WeakPolarHBondContact OD1-CE 2.99Å; D38-K42 IonicContact OD1-NZ 2.8Å; D38-K42 PolarHBondContact OD1-NZ 2.92Å; D38-K42 IonicContact OD2-NZ 2.65Å; D38-K42 PolarHBondContact OD2-NZ 3.39Å; D38-Y127 PolarHBondContact OD2-OH 3.06Å; D38-R132 IonicContact OD1-CZ 3.69Å; D38-R132 IonicContact OD1-NH1 3.84Å; D38-R132 PolarHBondContact OD1-NH1 3.16Å; D38-R132 IonicContact OD2-CZ 3.6Å; D38-R132 IonicContact OD2-NH1 3.81Å; D38-R132 PolarHBondContact OD2-NH1 3.12Å
39	N	94.6	Very high	95	Very high	104 Å²	104	47.4 Å²	47.4	56%	0.556	24%	0.235	S	C	*	.	H	α-helix	trans	-66.6	-53.5	179.6	-68.6	-21	0	0	0	111.9	C37 S41 K42 E43 H134	C37-N39 VanDerWaalsContact C-N 3.33Å; C37-N39 PolarHBondContact O-N 3.36Å; N39-S41 VanDerWaalsContact C-N 3.27Å; N39-S41 PolarHBondContact O-N 3.36Å; N39-K42 PolarHBondContact O-N 3.1Å; N39-E43 PolarHBondContact O-N 2.85Å; N39-H134 PolarHBondContact O-CE1 3.39Å
40	E	95.8	Very high	94.9	Very high	76 Å²	76	49.9 Å²	49.9	36%	0.355	25%	0.247	S	C	.	.	H	α-helix	trans	-62	-36.6	179.6	-53.4	-55	150.6	0	0	112	E43 F44 A63 L64 C67	E40-E43 PolarHBondContact O-N 3.32Å; E40-F44 WeakPolarHBondContact O-CB 3.46Å; E40-F44 PolarHBondContact O-N 3.07Å; E40-A63 WeakPolarHBondContact OE2-CB 3.5Å; E40-L64 HydrophobicContact CB-CB 4.39Å; E40-C67 HydrophobicContact CG-CB 4.12Å
41	S	95.4	Very high	94.6	Very high	35 Å²	35	48.4 Å²	48.4	25%	0.245	24%	0.236	C	C	.	.	H	α-helix	trans	-65.9	-41.4	177.4	-55.6	0	0	0	0	112.1	C37 N39 M45 L64	C37-S41 VanDerWaalsContact O-CB 3.28Å; C37-S41 WeakPolarHBondContact O-CB 3.33Å; C37-S41 PolarHBondContact O-N 3.48Å; C37-S41 PolarHBondContact O-OG 2.86Å; N39-S41 VanDerWaalsContact C-N 3.27Å; N39-S41 PolarHBondContact O-N 3.36Å; S41-M45 WeakPolarHBondContact O-CB 3.43Å; S41-M45 WeakPolarHBondContact O-CG 3.08Å; S41-M45 PolarHBondContact O-N 3.36Å; S41-L64 VanDerWaalsContact CA-CD1 3.4Å; S41-L64 WeakPolarHBondContact OG-CD1 3.33Å
42	K	95.4	Very high	94.3	Very high	42 Å²	42	53 Å²	53	18%	0.183	26%	0.256	C	S	.	.	H	α-helix	trans	-66.5	-42.8	175.8	-73.8	166.1	-177.4	150.2	0	111.8	D38 N39 M45 L46 R132 H134	D38-K42 WeakPolarHBondContact O-CD 3.49Å; D38-K42 VanDerWaalsContact O-CG 3.25Å; D38-K42 WeakPolarHBondContact O-CG 3.5Å; D38-K42 PolarHBondContact O-N 3.25Å; D38-K42 VanDerWaalsContact O-N 3.07Å; D38-K42 WeakPolarHBondContact OD1-CE 2.99Å; D38-K42 IonicContact OD1-NZ 2.8Å; D38-K42 PolarHBondContact OD1-NZ 2.92Å; D38-K42 IonicContact OD2-NZ 2.65Å; D38-K42 PolarHBondContact OD2-NZ 3.39Å; N39-K42 PolarHBondContact O-N 3.1Å; K42-M45 PolarHBondContact O-N 2.95Å; K42-L46 WeakPolarHBondContact O-CB 3.24Å; K42-L46 PolarHBondContact O-N 3.38Å; K42-R132 HydrophobicContact CD-CB 4.49Å; K42-H134 HydrophobicContact CB-CB 3.93Å; K42-H134 HydrophobicContact CD-CB 4.26Å
43	E	95	Very high	94	Very high	35 Å²	35	57.4 Å²	57.4	16%	0.164	28%	0.279	C	S	.	.	H	α-helix	trans	-60.5	-47.8	179	-171.9	65	-178.3	0	0	110.7	N39 E40 L46 C47 E60 H134 T136 R138	N39-E43 PolarHBondContact O-N 2.85Å; E40-E43 PolarHBondContact O-N 3.32Å; E43-L46 PolarHBondContact O-N 3.41Å; E43-C47 WeakPolarHBondContact O-CB 3.34Å; E43-C47 PolarHBondContact O-N 3.38Å; E43-E60 HydrophobicContact CG-CG 3.81Å; E43-H134 IonicContact OE2-CD2 3.93Å; E43-H134 PolarHBondContact OE2-CD2 3.13Å; E43-H134 IonicContact OE2-NE2 3.75Å; E43-H134 PolarHBondContact OE2-NE2 3.24Å; E43-T136 WeakPolarHBondContact OE2-CG2 3.43Å; E43-R138 IonicContact OE1-NE 3.06Å
44	F	95.6	Very high	93.8	Very high	59 Å²	59	60 Å²	60	26%	0.259	30%	0.298	S	S	.	.	H	α-helix	trans	-61.9	-46.9	176.9	175.5	-102.7	0	0	0	112.5	E40 C47 H48 C57 E60 L64	E40-F44 WeakPolarHBondContact O-CB 3.46Å; E40-F44 PolarHBondContact O-N 3.07Å; F44-C47 WeakPolarHBondContact O-CB 3.39Å; F44-C47 PolarHBondContact O-N 2.7Å; F44-H48 PolarHBondContact O-N 3.12Å; F44-C57 HydrophobicContact CD2-CB 4.37Å; F44-C57 HydrophobicContact CE2-CB 4.21Å; F44-E60 HydrophobicContact CB-CB 4.06Å; F44-E60 HydrophobicContact CD2-CB 4.11Å; F44-L64 HydrophobicContact CB-CD1 4.36Å
45	M	94.9	Very high	93.6	Very high	76 Å²	76	64.1 Å²	64.1	37%	0.374	31%	0.307	S	S	.	.	H	α-helix	trans	-67	-40.8	-179.5	-70	-56.6	-58.4	0	0	111.6	S41 K42 C47 H48 Y49	S41-M45 WeakPolarHBondContact O-CB 3.43Å; S41-M45 WeakPolarHBondContact O-CG 3.08Å; S41-M45 PolarHBondContact O-N 3.36Å; K42-M45 PolarHBondContact O-N 2.95Å; M45-C47 VanDerWaalsContact C-N 3.28Å; M45-C47 PolarHBondContact O-N 3.18Å; M45-H48 PolarHBondContact O-N 3.04Å; M45-Y49 HydrophobicContact CB-CD2 4.38Å; M45-Y49 HydrophobicContact CB-CE2 4.36Å; M45-Y49 HydrophobicContact CE-CD2 4.27Å; M45-Y49 HydrophobicContact CE-CE2 3.47Å; M45-Y49 VanDerWaalsContact CE-CE2 3.47Å; M45-Y49 WeakPolarHBondContact O-CB 3.32Å; M45-Y49 WeakPolarHBondContact O-CD2 3.27Å; M45-Y49 PolarHBondContact O-N 2.98Å
46	L	93.8	Very high	93.3	Very high	47 Å²	47	63.9 Å²	63.9	25%	0.246	32%	0.318	C	S	.	.	H	α-helix	trans	-63.6	-37.5	175.3	-173.5	59.9	0	0	0	110.7	K42 E43 Y49 E50 H134 T136 R138	K42-L46 WeakPolarHBondContact O-CB 3.24Å; K42-L46 PolarHBondContact O-N 3.38Å; E43-L46 PolarHBondContact O-N 3.41Å; L46-Y49 PolarHBondContact O-N 3.22Å; L46-E50 HydrophobicContact CD1-CG 4.11Å; L46-E50 HydrophobicContact CG-CG 4.46Å; L46-E50 WeakPolarHBondContact O-CB 3.49Å; L46-E50 WeakPolarHBondContact O-CG 3.43Å; L46-E50 PolarHBondContact O-N 3.01Å; L46-H134 HydrophobicContact CD2-CB 4.35Å; L46-T136 HydrophobicContact CD2-CG2 3.28Å; L46-T136 HydrophobicContact CG-CG2 4.39Å; L46-R138 PolarHBondContact O-NH2 3.49Å
47	C	94.1	Very high	93.2	Very high	2 Å²	2	60.8 Å²	60.8	1%	0.014	31%	0.305	C	S	.	.	H	α-helix	trans	-56.1	-55	169.4	-170	0	0	0	0	112.9	E43 F44 M45 Y49 E50 T51 C57 E60 R138	E43-C47 WeakPolarHBondContact O-CB 3.34Å; E43-C47 PolarHBondContact O-N 3.38Å; F44-C47 WeakPolarHBondContact O-CB 3.39Å; F44-C47 PolarHBondContact O-N 2.7Å; M45-C47 VanDerWaalsContact C-N 3.28Å; M45-C47 PolarHBondContact O-N 3.18Å; C47-Y49 VanDerWaalsContact C-N 3.27Å; C47-Y49 PolarHBondContact O-N 3.36Å; C47-E50 PolarHBondContact O-N 3.06Å; C47-T51 PolarHBondContact O-N 3.46Å; C47-T51 PolarHBondContact O-OG1 2.97Å; C47-C57 HydrophobicContact CB-CB 3.77Å; C47-C57 WeakPolarHBondContact CB-SG 3.41Å; C47-C57 WeakPolarHBondContact SG-CA 3.4Å; C47-C57 WeakPolarHBondContact SG-CB 3.4Å; C47-C57 CovalentContact SG-SG 2.03Å; C47-C57 PolarHBondContact SG-SG 2.97Å; C47-E60 HydrophobicContact CB-CG 4.41Å; C47-E60 PolarHBondContact SG-OE1 3.28Å; C47-R138 VanDerWaalsContact CA-CZ 3.42Å; C47-R138 VanDerWaalsContact N-NH2 3.11Å; C47-R138 PolarHBondContact SG-NH1 3.38Å
48	H	93.4	Very high	93.1	Very high	77 Å²	77	63 Å²	63	36%	0.356	32%	0.316	S	S	.	.	H	α-helix	trans	-62	-37.7	-176.4	-170.3	55.9	0	0	0	112.6	F44 M45 H52	F44-H48 PolarHBondContact O-N 3.12Å; M45-H48 PolarHBondContact O-N 3.04Å; H48-H52 WeakPolarHBondContact O-CA 3.38Å; H48-H52 PolarHBondContact O-N 2.65Å
49	Y	92.4	Very high	93	Very high	154 Å²	154	64.8 Å²	64.8	60%	0.604	34%	0.337	S	S	*	.	H	α-helix	trans	-74.3	-32.4	177.8	-77.9	-59.7	0	0	0	114	M45 L46 C47 H52	M45-Y49 HydrophobicContact CB-CD2 4.38Å; M45-Y49 HydrophobicContact CB-CE2 4.36Å; M45-Y49 HydrophobicContact CE-CD2 4.27Å; M45-Y49 HydrophobicContact CE-CE2 3.47Å; M45-Y49 VanDerWaalsContact CE-CE2 3.47Å; M45-Y49 WeakPolarHBondContact O-CB 3.32Å; M45-Y49 WeakPolarHBondContact O-CD2 3.27Å; M45-Y49 PolarHBondContact O-N 2.98Å; L46-Y49 PolarHBondContact O-N 3.22Å; C47-Y49 VanDerWaalsContact C-N 3.27Å; C47-Y49 PolarHBondContact O-N 3.36Å; Y49-H52 PolarHBondContact O-CE1 3.03Å; Y49-H52 PolarHBondContact O-NE2 2.64Å
50	E	91.6	Very high	93	Very high	53 Å²	53	61.6 Å²	61.6	25%	0.248	32%	0.319	C	S	.	.	H	α-helix	trans	-80	-48.7	179.9	-75.6	-177.9	175.1	0	0	112	L46 C47 R138 Y141	L46-E50 HydrophobicContact CD1-CG 4.11Å; L46-E50 HydrophobicContact CG-CG 4.46Å; L46-E50 WeakPolarHBondContact O-CB 3.49Å; L46-E50 WeakPolarHBondContact O-CG 3.43Å; L46-E50 PolarHBondContact O-N 3.01Å; C47-E50 PolarHBondContact O-N 3.06Å; E50-R138 VanDerWaalsContact CD-NH2 3.32Å; E50-R138 IonicContact OE2-CZ 2.88Å; E50-R138 IonicContact OE2-NE 3.51Å; E50-R138 IonicContact OE2-NH2 3.01Å; E50-R138 PolarHBondContact OE2-NH2 3.07Å; E50-Y141 WeakPolarHBondContact O-CD1 3.42Å
51	T	89.7	Confident	93	Very high	17 Å²	17	58.8 Å²	58.8	10%	0.104	31%	0.31	C	S	.	.	H	α-helix	trans	-83.7	-24.3	-173	63.4	0	0	0	0	113.4	C47 D53 A56 C57 Y141	C47-T51 PolarHBondContact O-N 3.46Å; C47-T51 PolarHBondContact O-OG1 2.97Å; T51-D53 PolarHBondContact O-N 3.24Å; T51-D53 PolarHBondContact OG1-N 2.71Å; T51-D53 PolarHBondContact OG1-O 2.76Å; T51-A56 HydrophobicContact CG2-CB 4.27Å; T51-C57 PolarHBondContact OG1-SG 3.33Å; T51-Y141 HydrophobicContact CG2-CD2 4.06Å; T51-Y141 HydrophobicContact CG2-CG 4.32Å
52	H	88.4	Confident	93	Very high	140 Å²	140	60.9 Å²	60.9	65%	0.648	32%	0.315	S	S	*	.			trans	54.2	10	-168.9	-60.7	-54.3	0	0	0	115.2	H48 Y49	H48-H52 WeakPolarHBondContact O-CA 3.38Å; H48-H52 PolarHBondContact O-N 2.65Å; Y49-H52 PolarHBondContact O-CE1 3.03Å; Y49-H52 PolarHBondContact O-NE2 2.64Å
53	D	88.7	Confident	93	Very high	91 Å²	91	60.2 Å²	60.2	49%	0.487	32%	0.317	S	S	.	.			trans	-119.7	114.4	-178.8	-83.2	-28.9	0	0	0	110.1	T51 R55 A56	T51-D53 PolarHBondContact O-N 3.24Å; T51-D53 PolarHBondContact OG1-N 2.71Å; T51-D53 PolarHBondContact OG1-O 2.76Å; D53-R55 PolarHBondContact O-N 3.41Å; D53-A56 PolarHBondContact O-N 3.37Å
54	P	91.1	Very high	93.1	Very high	82 Å²	82	60.8 Å²	60.8	53%	0.532	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-20.1	-177.2	26.9	-34.7	0	0	0	113.4	C57	P54-C57 PolarHBondContact O-N 3.49Å
55	R	91.5	Very high	93.1	Very high	106 Å²	106	59.4 Å²	59.4	40%	0.4	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-34.9	-178.6	-60.1	177	-169.9	152.7	13.1	112.5	H7 L8 D53 C57 L58	H7-R55 VanDerWaalsContact O-CD 3.29Å; H7-R55 WeakPolarHBondContact O-CD 3.37Å; H7-R55 VanDerWaalsContact O-CZ 3.29Å; H7-R55 PolarHBondContact O-NE 3.22Å; H7-R55 PolarHBondContact O-NH1 3.02Å; L8-R55 VanDerWaalsContact CD2-NH2 3.27Å; D53-R55 PolarHBondContact O-N 3.41Å; R55-C57 PolarHBondContact O-N 3.06Å; R55-L58 WeakPolarHBondContact O-CG 3.34Å
56	A	90.5	Very high	93.2	Very high	62 Å²	62	58.9 Å²	58.9	51%	0.512	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-29.5	178.3	0	0	0	0	0	111.7	T51 D53	T51-A56 HydrophobicContact CG2-CB 4.27Å; D53-A56 PolarHBondContact O-N 3.37Å
57	C	93.8	Very high	93.3	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.007	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	16.8	-170.6	-53.5	0	0	0	0	114.5	F44 C47 T51 P54 R55 G59 E60 G61	F44-C57 HydrophobicContact CD2-CB 4.37Å; F44-C57 HydrophobicContact CE2-CB 4.21Å; C47-C57 HydrophobicContact CB-CB 3.77Å; C47-C57 WeakPolarHBondContact CB-SG 3.41Å; C47-C57 WeakPolarHBondContact SG-CA 3.4Å; C47-C57 WeakPolarHBondContact SG-CB 3.4Å; C47-C57 CovalentContact SG-SG 2.03Å; C47-C57 PolarHBondContact SG-SG 2.97Å; T51-C57 PolarHBondContact OG1-SG 3.33Å; P54-C57 PolarHBondContact O-N 3.49Å; R55-C57 PolarHBondContact O-N 3.06Å; C57-G59 VanDerWaalsContact C-N 3.31Å; C57-G59 PolarHBondContact O-N 3.38Å; C57-E60 VanDerWaalsContact C-OE2 3.23Å; C57-E60 WeakPolarHBondContact CA-OE2 3.39Å; C57-G61 PolarHBondContact O-N 3.49Å; C57-G61 VanDerWaalsContact O-N 3.08Å
58	L	94.5	Very high	93.5	Very high	51 Å²	51	57.6 Å²	57.6	27%	0.267	32%	0.316	S	S	.	.	H	α-helix	trans	-67.6	-31.7	-177.1	-70.2	176.8	0	0	0	112.4	P9 L14 R55 G61 K62	P9-L58 HydrophobicContact CB-CD1 3.92Å; P9-L58 HydrophobicContact CG-CD1 4.03Å; L14-L58 HydrophobicContact CD2-CD1 4.07Å; L14-L58 HydrophobicContact CD2-CD2 3.95Å; R55-L58 WeakPolarHBondContact O-CG 3.34Å; L58-G61 PolarHBondContact O-N 2.88Å; L58-K62 WeakPolarHBondContact O-CG 3.16Å; L58-K62 PolarHBondContact O-N 2.89Å
59	G	93	Very high	93.6	Very high	50 Å²	50	56 Å²	56	52%	0.515	31%	0.309	S	S	.	.	H	α-helix	trans	-65.9	-48.1	178.6	0	0	0	0	0	112	C57 G61 K62 A63	C57-G59 VanDerWaalsContact C-N 3.31Å; C57-G59 PolarHBondContact O-N 3.38Å; G59-G61 VanDerWaalsContact C-N 3.33Å; G59-G61 PolarHBondContact O-N 3.33Å; G59-K62 WeakPolarHBondContact O-CB 3.06Å; G59-K62 PolarHBondContact O-N 2.86Å; G59-A63 PolarHBondContact O-N 3.19Å
60	E	94.6	Very high	93.8	Very high	37 Å²	37	51.8 Å²	51.8	17%	0.173	30%	0.3	C	S	.	.	H	α-helix	trans	-63.6	-39.5	176.1	-59.6	87	158.1	0	0	111	E43 F44 C47 C57 K62 A63 L64 R138	E43-E60 HydrophobicContact CG-CG 3.81Å; F44-E60 HydrophobicContact CB-CB 4.06Å; F44-E60 HydrophobicContact CD2-CB 4.11Å; C47-E60 HydrophobicContact CB-CG 4.41Å; C47-E60 PolarHBondContact SG-OE1 3.28Å; C57-E60 VanDerWaalsContact C-OE2 3.23Å; C57-E60 WeakPolarHBondContact CA-OE2 3.39Å; E60-K62 VanDerWaalsContact C-N 3.35Å; E60-K62 PolarHBondContact O-N 2.88Å; E60-A63 WeakPolarHBondContact O-CB 3.07Å; E60-A63 PolarHBondContact O-N 3.31Å; E60-L64 PolarHBondContact O-N 3.48Å; E60-R138 IonicContact OE1-NH1 3.05Å
61	G	95.5	Very high	94	Very high	17 Å²	17	49.3 Å²	49.3	18%	0.175	29%	0.288	C	S	.	.	H	α-helix	trans	-62.9	-38.9	175.2	0	0	0	0	0	113	C57 L58 G59 L64 T65	C57-G61 PolarHBondContact O-N 3.49Å; C57-G61 VanDerWaalsContact O-N 3.08Å; L58-G61 PolarHBondContact O-N 2.88Å; G59-G61 VanDerWaalsContact C-N 3.33Å; G59-G61 PolarHBondContact O-N 3.33Å; G61-L64 PolarHBondContact O-N 3.3Å; G61-T65 WeakPolarHBondContact O-CG2 3.45Å; G61-T65 PolarHBondContact O-N 3.39Å; G61-T65 PolarHBondContact O-OG1 2.87Å
62	K	95.7	Very high	94.3	Very high	79 Å²	79	49.7 Å²	49.7	34%	0.343	29%	0.288	S	S	.	.	H	α-helix	trans	-64.6	-40.5	172	-74.9	177.3	-173.5	-171.9	0	112.1	E13 V16 L58 G59 E60 T65 S66	E13-K62 WeakPolarHBondContact O-CE 3.48Å; E13-K62 PolarHBondContact O-NZ 3.24Å; V16-K62 HydrophobicContact CG1-CG 4.4Å; V16-K62 HydrophobicContact CG2-CD 4.06Å; V16-K62 HydrophobicContact CG2-CG 3.53Å; L58-K62 WeakPolarHBondContact O-CG 3.16Å; L58-K62 PolarHBondContact O-N 2.89Å; G59-K62 WeakPolarHBondContact O-CB 3.06Å; G59-K62 PolarHBondContact O-N 2.86Å; E60-K62 VanDerWaalsContact C-N 3.35Å; E60-K62 PolarHBondContact O-N 2.88Å; K62-T65 WeakPolarHBondContact CA-OG1 3.35Å; K62-T65 PolarHBondContact O-OG1 3.38Å; K62-S66 WeakPolarHBondContact O-CB 3.21Å; K62-S66 PolarHBondContact O-N 3.08Å
63	A	95.4	Very high	94.7	Very high	28 Å²	28	49 Å²	49	23%	0.231	28%	0.283	C	S	.	.	H	α-helix	trans	-62.8	-45.4	176.1	0	0	0	0	0	111.1	E40 G59 E60 S66 C67	E40-A63 WeakPolarHBondContact OE2-CB 3.5Å; G59-A63 PolarHBondContact O-N 3.19Å; E60-A63 WeakPolarHBondContact O-CB 3.07Å; E60-A63 PolarHBondContact O-N 3.31Å; A63-S66 PolarHBondContact O-N 2.92Å; A63-S66 PolarHBondContact O-OG 2.67Å; A63-C67 PolarHBondContact O-N 3.24Å
64	L	96.4	Very high	95	Very high	47 Å²	47	47.7 Å²	47.7	25%	0.246	27%	0.274	C	S	.	.	H	α-helix	trans	-60.5	-48.1	177.1	-178.4	130.8	0	0	0	113.1	E40 S41 F44 E60 G61 S66 C67 A68	E40-L64 HydrophobicContact CB-CB 4.39Å; S41-L64 VanDerWaalsContact CA-CD1 3.4Å; S41-L64 WeakPolarHBondContact OG-CD1 3.33Å; F44-L64 HydrophobicContact CB-CD1 4.36Å; E60-L64 PolarHBondContact O-N 3.48Å; G61-L64 PolarHBondContact O-N 3.3Å; L64-S66 VanDerWaalsContact C-N 3.3Å; L64-S66 PolarHBondContact O-N 2.95Å; L64-C67 WeakPolarHBondContact O-CB 3.39Å; L64-C67 PolarHBondContact O-N 2.92Å; L64-A68 PolarHBondContact O-N 3.01Å
65	T	96.4	Very high	95.2	Very high	31 Å²	31	43.9 Å²	43.9	19%	0.19	25%	0.25	C	C	.	.	H	α-helix	trans	-62.6	-38.9	176.8	48.1	0	0	0	0	111.4	V16 G61 K62 C67 A68 H69	V16-T65 WeakPolarHBondContact CG1-OG1 3.35Å; G61-T65 WeakPolarHBondContact O-CG2 3.45Å; G61-T65 PolarHBondContact O-N 3.39Å; G61-T65 PolarHBondContact O-OG1 2.87Å; K62-T65 WeakPolarHBondContact CA-OG1 3.35Å; K62-T65 PolarHBondContact O-OG1 3.38Å; T65-C67 PolarHBondContact O-N 3.37Å; T65-A68 PolarHBondContact O-N 3.47Å; T65-H69 PolarHBondContact O-CD2 3.47Å; T65-H69 PolarHBondContact O-N 3.28Å
66	S	96.3	Very high	95.4	Very high	64 Å²	64	45.4 Å²	45.4	45%	0.448	26%	0.259	S	S	.	.	H	α-helix	trans	-62.8	-40.4	174.9	84.7	0	0	0	0	112.5	K62 A63 L64 A68 H69 T70	K62-S66 WeakPolarHBondContact O-CB 3.21Å; K62-S66 PolarHBondContact O-N 3.08Å; A63-S66 PolarHBondContact O-N 2.92Å; A63-S66 PolarHBondContact O-OG 2.67Å; L64-S66 VanDerWaalsContact C-N 3.3Å; L64-S66 PolarHBondContact O-N 2.95Å; S66-A68 PolarHBondContact O-N 3.45Å; S66-H69 WeakPolarHBondContact O-CB 2.93Å; S66-H69 PolarHBondContact O-N 2.84Å; S66-T70 PolarHBondContact O-N 2.92Å
67	C	97.3	Very high	95.7	Very high	17 Å²	17	51.6 Å²	51.6	12%	0.115	27%	0.269	C	S	.	.	H	α-helix	trans	-63.6	-40.2	174.7	-179.7	0	0	0	0	111.8	C37 E40 A63 L64 T65 H69 T70 F71	C37-C67 WeakPolarHBondContact CA-SG 3.49Å; C37-C67 HydrophobicContact CB-CB 4Å; C37-C67 WeakPolarHBondContact CB-SG 3.49Å; C37-C67 WeakPolarHBondContact SG-CB 3.45Å; C37-C67 CovalentContact SG-SG 2.05Å; C37-C67 PolarHBondContact SG-SG 3.04Å; E40-C67 HydrophobicContact CG-CB 4.12Å; A63-C67 PolarHBondContact O-N 3.24Å; L64-C67 WeakPolarHBondContact O-CB 3.39Å; L64-C67 PolarHBondContact O-N 2.92Å; T65-C67 PolarHBondContact O-N 3.37Å; C67-H69 VanDerWaalsContact C-N 3.31Å; C67-H69 PolarHBondContact O-N 3.38Å; C67-T70 PolarHBondContact O-N 3.41Å; C67-T70 PolarHBondContact O-OG1 3.48Å; C67-F71 PolarHBondContact O-N 3.27Å
68	A	96.7	Very high	95.7	Very high	5 Å²	5	55.8 Å²	55.8	4%	0.041	29%	0.288	C	S	.	.	H	α-helix	trans	-63.3	-38.7	175.3	0	0	0	0	0	112.1	L19 L33 L64 T65 S66 F71 F72	L19-A68 HydrophobicContact CD1-CB 3.53Å; L19-A68 HydrophobicContact CD2-CB 4.01Å; L19-A68 HydrophobicContact CG-CB 4.33Å; L33-A68 HydrophobicContact CD1-CB 3.99Å; L64-A68 PolarHBondContact O-N 3.01Å; T65-A68 PolarHBondContact O-N 3.47Å; S66-A68 PolarHBondContact O-N 3.45Å; A68-F71 PolarHBondContact O-N 2.87Å; A68-F72 WeakPolarHBondContact O-CD2 3.4Å; A68-F72 PolarHBondContact O-N 2.86Å
69	H	96.5	Very high	95.8	Very high	45 Å²	45	53.4 Å²	53.4	21%	0.208	28%	0.276	C	S	.	.	H	α-helix	trans	-62	-42.1	173.4	-80.2	-70.6	0	0	0	112.8	P17 E18 T65 S66 C67 K73	P17-H69 PolarHBondContact O-NE2 3.31Å; E18-H69 PolarHBondContact O-CE1 3Å; T65-H69 PolarHBondContact O-CD2 3.47Å; T65-H69 PolarHBondContact O-N 3.28Å; S66-H69 WeakPolarHBondContact O-CB 2.93Å; S66-H69 PolarHBondContact O-N 2.84Å; C67-H69 VanDerWaalsContact C-N 3.31Å; C67-H69 PolarHBondContact O-N 3.38Å; H69-K73 WeakPolarHBondContact O-CB 3.39Å; H69-K73 VanDerWaalsContact O-CG 3.25Å; H69-K73 WeakPolarHBondContact O-CG 3.4Å; H69-K73 PolarHBondContact O-N 3.4Å
70	T	96.1	Very high	95.9	Very high	65 Å²	65	55.9 Å²	55.9	40%	0.399	27%	0.274	S	S	.	.	H	α-helix	trans	-65.3	-41.7	178.3	58.3	0	0	0	0	111.1	S66 C67 K73 Q74	S66-T70 PolarHBondContact O-N 2.92Å; C67-T70 PolarHBondContact O-N 3.41Å; C67-T70 PolarHBondContact O-OG1 3.48Å; T70-K73 PolarHBondContact O-N 2.85Å; T70-Q74 WeakPolarHBondContact O-CG 3.4Å; T70-Q74 PolarHBondContact O-N 3.46Å
71	F	96.2	Very high	96	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-59.1	-52.8	174.9	176.5	-98.6	0	0	0	112.2	A29 H32 L33 F36 C67 A68 K73 Q74 V75 L118	A29-F71 HydrophobicContact CB-CE1 3.88Å; A29-F71 HydrophobicContact CB-CZ 4.46Å; H32-F71 HydrophobicContact CB-CE2 4.03Å; H32-F71 HydrophobicContact CB-CZ 3.77Å; L33-F71 HydrophobicContact CB-CD1 4.17Å; L33-F71 HydrophobicContact CB-CE1 4.02Å; L33-F71 HydrophobicContact CB-CZ 4.44Å; L33-F71 HydrophobicContact CD1-CB 3.9Å; L33-F71 HydrophobicContact CD1-CD1 3.55Å; L33-F71 HydrophobicContact CD1-CE1 4.26Å; L33-F71 HydrophobicContact CD1-CG 3.78Å; L33-F71 HydrophobicContact CG-CD1 4.44Å; F36-F71 HydrophobicContact CB-CD2 3.8Å; F36-F71 HydrophobicContact CB-CE2 4.27Å; F36-F71 HydrophobicContact CD1-CB 3.7Å; F36-F71 AromaticContact CD1-CD2 3.89Å; F36-F71 HydrophobicContact CD1-CD2 3.89Å; F36-F71 HydrophobicContact CD1-CG 4.21Å; F36-F71 HydrophobicContact CD2-CD2 4.19Å; F36-F71 HydrophobicContact CE1-CB 3.91Å; F36-F71 HydrophobicContact CG-CB 4.4Å; F36-F71 AromaticContact CG-CD2 3.7Å; F36-F71 HydrophobicContact CG-CD2 3.7Å; F36-F71 HydrophobicContact CG-CG 4.45Å; C67-F71 PolarHBondContact O-N 3.27Å; A68-F71 PolarHBondContact O-N 2.87Å; F71-K73 VanDerWaalsContact C-N 3.27Å; F71-K73 PolarHBondContact O-N 3.03Å; F71-Q74 WeakPolarHBondContact O-CB 3.44Å; F71-Q74 PolarHBondContact O-N 2.96Å; F71-V75 HydrophobicContact CD1-CG2 4.16Å; F71-V75 HydrophobicContact CD2-CG2 4.45Å; F71-V75 HydrophobicContact CE1-CG2 3.66Å; F71-V75 HydrophobicContact CE2-CG2 4Å; F71-V75 HydrophobicContact CZ-CG2 3.57Å; F71-V75 WeakPolarHBondContact O-CG2 3.48Å; F71-V75 PolarHBondContact O-N 3.39Å; F71-L118 HydrophobicContact CD2-CD2 4.33Å; F71-L118 HydrophobicContact CE2-CD2 4.25Å
72	F	96.1	Very high	96	Very high	25 Å²	25	60.8 Å²	60.8	11%	0.11	30%	0.295	C	S	.	.	H	α-helix	trans	-65.6	-30.2	-179.9	-76.5	-64.8	0	0	0	112.9	L19 I21 L26 A29 L33 A68 K76 F83	L19-F72 HydrophobicContact CD2-CD2 4.07Å; L19-F72 HydrophobicContact CD2-CE2 4.44Å; I21-F72 HydrophobicContact CD1-CB 4.44Å; I21-F72 HydrophobicContact CD1-CD1 3.76Å; I21-F72 HydrophobicContact CD1-CD2 3.46Å; I21-F72 VanDerWaalsContact CD1-CD2 3.46Å; I21-F72 HydrophobicContact CD1-CE1 3.76Å; I21-F72 HydrophobicContact CD1-CE2 3.48Å; I21-F72 VanDerWaalsContact CD1-CE2 3.48Å; I21-F72 HydrophobicContact CD1-CG 3.62Å; I21-F72 HydrophobicContact CD1-CZ 3.63Å; L26-F72 HydrophobicContact CD1-CZ 4.24Å; A29-F72 HydrophobicContact CB-CE1 3.84Å; A29-F72 HydrophobicContact CB-CZ 4.13Å; L33-F72 HydrophobicContact CD2-CE2 4.35Å; A68-F72 WeakPolarHBondContact O-CD2 3.4Å; A68-F72 PolarHBondContact O-N 2.86Å; F72-K76 WeakPolarHBondContact O-CB 3.25Å; F72-K76 PolarHBondContact O-N 2.81Å; F72-F83 HydrophobicContact CE1-CZ 4.27Å
73	K	95.6	Very high	96.1	Very high	127 Å²	127	58.1 Å²	58.1	55%	0.552	28%	0.284	S	S	*	.	H	α-helix	trans	-63.4	-40.2	170.3	-76.9	174	-176.3	177.7	0	111.9	H69 T70 F71 R77	H69-K73 WeakPolarHBondContact O-CB 3.39Å; H69-K73 VanDerWaalsContact O-CG 3.25Å; H69-K73 WeakPolarHBondContact O-CG 3.4Å; H69-K73 PolarHBondContact O-N 3.4Å; T70-K73 PolarHBondContact O-N 2.85Å; F71-K73 VanDerWaalsContact C-N 3.27Å; F71-K73 PolarHBondContact O-N 3.03Å; K73-R77 VanDerWaalsContact O-CG 3.22Å; K73-R77 WeakPolarHBondContact O-CG 3.41Å; K73-R77 PolarHBondContact O-N 3.38Å; K73-R77 VanDerWaalsContact O-N 3.14Å
74	Q	95.5	Very high	96.1	Very high	63 Å²	63	63 Å²	63	29%	0.294	30%	0.296	S	S	.	.	H	α-helix	trans	-69	-45.3	176.7	-70.6	176	-1.5	0	0	111.7	T70 F71 K76 R77 H78 L118	T70-Q74 WeakPolarHBondContact O-CG 3.4Å; T70-Q74 PolarHBondContact O-N 3.46Å; F71-Q74 WeakPolarHBondContact O-CB 3.44Å; F71-Q74 PolarHBondContact O-N 2.96Å; Q74-K76 VanDerWaalsContact C-N 3.31Å; Q74-K76 PolarHBondContact O-N 3.45Å; Q74-R77 PolarHBondContact O-N 3.08Å; Q74-R77 VanDerWaalsContact O-N 3.08Å; Q74-H78 PolarHBondContact O-CD2 3.07Å; Q74-H78 PolarHBondContact O-N 3.2Å; Q74-H78 VanDerWaalsContact O-N 3.08Å; Q74-L118 HydrophobicContact CB-CD2 4.25Å; Q74-L118 VanDerWaalsContact OE1-CD2 3.23Å
75	V	95.6	Very high	96.1	Very high	2 Å²	2	65.4 Å²	65.4	1%	0.012	31%	0.309	C	S	.	.	H	α-helix	trans	-58.7	-44.2	176.6	174.2	0	0	0	0	110.9	F71 R77 H78 C79 E80 F83 F110	F71-V75 HydrophobicContact CD1-CG2 4.16Å; F71-V75 HydrophobicContact CD2-CG2 4.45Å; F71-V75 HydrophobicContact CE1-CG2 3.66Å; F71-V75 HydrophobicContact CE2-CG2 4Å; F71-V75 HydrophobicContact CZ-CG2 3.57Å; F71-V75 WeakPolarHBondContact O-CG2 3.48Å; F71-V75 PolarHBondContact O-N 3.39Å; V75-R77 VanDerWaalsContact C-N 3.31Å; V75-R77 PolarHBondContact O-N 3.06Å; V75-H78 PolarHBondContact O-N 3.14Å; V75-C79 CarbonylContact O-C 3.33Å; V75-C79 WeakPolarHBondContact O-CA 3.46Å; V75-C79 PolarHBondContact O-N 3.23Å; V75-E80 PolarHBondContact O-N 2.7Å; V75-F83 HydrophobicContact CG1-CB 3.99Å; V75-F83 HydrophobicContact CG1-CD1 4.03Å; V75-F83 HydrophobicContact CG1-CD2 4.28Å; V75-F83 HydrophobicContact CG1-CG 3.84Å; V75-F110 HydrophobicContact CG1-CE2 4.17Å
76	K	95.4	Very high	96.1	Very high	137 Å²	137	64.1 Å²	64.1	60%	0.596	30%	0.301	S	S	*	.	H	α-helix	trans	-64.4	-33.1	176.6	-171.8	175.7	-178.8	179.1	0	113	F72 Q74	F72-K76 WeakPolarHBondContact O-CB 3.25Å; F72-K76 PolarHBondContact O-N 2.81Å; Q74-K76 VanDerWaalsContact C-N 3.31Å; Q74-K76 PolarHBondContact O-N 3.45Å
77	R	96.3	Very high	96	Very high	193 Å²	193	63.7 Å²	63.7	73%	0.728	29%	0.291	S	S	*	.	H	α-helix	trans	-74.7	-32.7	-179.6	-77.8	172	-179.1	-175.2	-0.1	113.5	K73 Q74 V75	K73-R77 VanDerWaalsContact O-CG 3.22Å; K73-R77 WeakPolarHBondContact O-CG 3.41Å; K73-R77 PolarHBondContact O-N 3.38Å; K73-R77 VanDerWaalsContact O-N 3.14Å; Q74-R77 PolarHBondContact O-N 3.08Å; Q74-R77 VanDerWaalsContact O-N 3.08Å; V75-R77 VanDerWaalsContact C-N 3.31Å; V75-R77 PolarHBondContact O-N 3.06Å
78	H	95.4	Very high	95.9	Very high	89 Å²	89	65.1 Å²	65.1	41%	0.412	30%	0.299	S	S	.	.	H	α-helix	trans	-115.5	-37.5	-168.7	-61.8	-59.5	0	0	0	114.1	Q74 V75 H117	Q74-H78 PolarHBondContact O-CD2 3.07Å; Q74-H78 PolarHBondContact O-N 3.2Å; Q74-H78 VanDerWaalsContact O-N 3.08Å; V75-H78 PolarHBondContact O-N 3.14Å; H78-H117 HydrophobicContact CB-CB 3.84Å; H78-H117 AromaticContact CG-CG 3.97Å; H78-H117 AromaticContact ND1-ND1 3.92Å
79	C	95.7	Very high	95.8	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	30%	0.304	C	S	.	.			trans	-130	33.5	-166.7	-55.1	0	0	0	0	112.6	V75 D81 E82 F83 C113	V75-C79 CarbonylContact O-C 3.33Å; V75-C79 WeakPolarHBondContact O-CA 3.46Å; V75-C79 PolarHBondContact O-N 3.23Å; C79-D81 PolarHBondContact O-N 2.97Å; C79-E82 VanDerWaalsContact C-OE2 3.31Å; C79-E82 VanDerWaalsContact CA-OE2 3.24Å; C79-E82 WeakPolarHBondContact CA-OE2 3.32Å; C79-F83 WeakPolarHBondContact O-CB 3.44Å; C79-F83 PolarHBondContact O-N 3.06Å; C79-C113 WeakPolarHBondContact CA-SG 3.35Å; C79-C113 HydrophobicContact CB-CB 3.91Å; C79-C113 WeakPolarHBondContact CB-SG 3.42Å; C79-C113 WeakPolarHBondContact SG-CB 3.44Å; C79-C113 CovalentContact SG-SG 2.03Å; C79-C113 PolarHBondContact SG-SG 3.45Å
80	E	95.9	Very high	95.7	Very high	103 Å²	103	63.8 Å²	63.8	48%	0.481	29%	0.294	S	S	.	.	H	α-helix	trans	-62.9	-42.2	-174.6	-178.6	167.9	-171.8	0	0	111.9	V75 R84	V75-E80 PolarHBondContact O-N 2.7Å; E80-R84 WeakPolarHBondContact O-CB 3.04Å; E80-R84 PolarHBondContact O-N 3.03Å
81	D	96.2	Very high	95.6	Very high	93 Å²	93	67.1 Å²	67.1	50%	0.497	31%	0.305	S	S	.	.	H	α-helix	trans	-72.5	-45.2	-175.3	-78.7	-44.5	0	0	0	112.6	C79 F83 R84 N85	C79-D81 PolarHBondContact O-N 2.97Å; D81-F83 VanDerWaalsContact C-N 3.34Å; D81-R84 PolarHBondContact O-N 3.34Å; D81-R84 IonicContact OD1-CZ 3.03Å; D81-R84 IonicContact OD1-NE 2.64Å; D81-R84 IonicContact OD1-NH2 2.76Å; D81-R84 PolarHBondContact OD1-NH2 3.41Å; D81-N85 WeakPolarHBondContact O-CB 3.35Å; D81-N85 VanDerWaalsContact O-CG 3.25Å; D81-N85 PolarHBondContact O-N 3.06Å; D81-N85 PolarHBondContact O-ND2 3.23Å
82	E	96	Very high	95.4	Very high	64 Å²	64	74 Å²	74	30%	0.299	34%	0.335	S	S	.	.	H	α-helix	trans	-63.7	-43.2	176.1	-57.4	83.8	174.9	0	0	110.5	C79 R84 N85 Y86 P109 F110 C113	C79-E82 VanDerWaalsContact C-OE2 3.31Å; C79-E82 VanDerWaalsContact CA-OE2 3.24Å; C79-E82 WeakPolarHBondContact CA-OE2 3.32Å; E82-R84 PolarHBondContact O-N 3.05Å; E82-N85 PolarHBondContact O-N 3.4Å; E82-Y86 WeakPolarHBondContact O-CB 3.19Å; E82-Y86 PolarHBondContact O-N 3.41Å; E82-P109 HydrophobicContact CG-CB 4.23Å; E82-F110 HydrophobicContact CB-CB 4.19Å; E82-C113 HydrophobicContact CG-CB 4.39Å
83	F	96.4	Very high	95.2	Very high	22 Å²	22	79.4 Å²	79.4	10%	0.096	36%	0.356	C	S	.	.	H	α-helix	trans	-61.9	-44.3	176.9	-176.7	-119	0	0	0	111.5	P25 A28 A29 F72 V75 C79 D81 N85 Y86 F87 F110	P25-F83 HydrophobicContact CB-CE1 3.96Å; P25-F83 HydrophobicContact CB-CZ 3.66Å; P25-F83 WeakPolarHBondContact O-CZ 3.41Å; A28-F83 HydrophobicContact CB-CE2 3.89Å; A29-F83 HydrophobicContact CB-CE2 3.79Å; A29-F83 HydrophobicContact CB-CZ 4.13Å; F72-F83 HydrophobicContact CE1-CZ 4.27Å; V75-F83 HydrophobicContact CG1-CB 3.99Å; V75-F83 HydrophobicContact CG1-CD1 4.03Å; V75-F83 HydrophobicContact CG1-CD2 4.28Å; V75-F83 HydrophobicContact CG1-CG 3.84Å; C79-F83 WeakPolarHBondContact O-CB 3.44Å; C79-F83 PolarHBondContact O-N 3.06Å; D81-F83 VanDerWaalsContact C-N 3.34Å; F83-N85 PolarHBondContact O-N 3.44Å; F83-Y86 PolarHBondContact O-N 3Å; F83-F87 AromaticContact CD1-CD1 3.85Å; F83-F87 HydrophobicContact CD1-CD1 3.85Å; F83-F87 HydrophobicContact CD1-CE1 4Å; F83-F87 AromaticContact CE1-CD1 3.8Å; F83-F87 HydrophobicContact CE1-CD1 3.8Å; F83-F87 HydrophobicContact CE1-CE1 4.08Å; F83-F87 HydrophobicContact CG-CD1 4.26Å; F83-F87 HydrophobicContact CZ-CD1 4.18Å; F83-F87 WeakPolarHBondContact O-CD1 3.22Å; F83-F87 PolarHBondContact O-N 3Å; F83-F110 HydrophobicContact CB-CD2 3.97Å; F83-F110 HydrophobicContact CB-CE2 3.79Å; F83-F110 HydrophobicContact CD2-CD2 4.15Å; F83-F110 HydrophobicContact CD2-CE1 4.28Å; F83-F110 AromaticContact CD2-CE2 3.49Å; F83-F110 HydrophobicContact CD2-CE2 3.49Å; F83-F110 VanDerWaalsContact CD2-CE2 3.49Å; F83-F110 AromaticContact CD2-CZ 3.53Å; F83-F110 HydrophobicContact CD2-CZ 3.53Å; F83-F110 HydrophobicContact CE2-CE2 4.44Å; F83-F110 HydrophobicContact CE2-CZ 4.09Å; F83-F110 HydrophobicContact CG-CE2 4.02Å; F83-F110 HydrophobicContact CG-CZ 4.47Å
84	R	96.4	Very high	94.7	Very high	131 Å²	131	73.6 Å²	73.6	49%	0.494	33%	0.332	S	S	.	.	H	α-helix	trans	-60.1	-45.8	176.9	-175.6	172.7	61.3	160.8	-6.4	112.5	E80 D81 E82 Y86 F87 T88	E80-R84 WeakPolarHBondContact O-CB 3.04Å; E80-R84 PolarHBondContact O-N 3.03Å; D81-R84 PolarHBondContact O-N 3.34Å; D81-R84 IonicContact OD1-CZ 3.03Å; D81-R84 IonicContact OD1-NE 2.64Å; D81-R84 IonicContact OD1-NH2 2.76Å; D81-R84 PolarHBondContact OD1-NH2 3.41Å; E82-R84 PolarHBondContact O-N 3.05Å; R84-Y86 VanDerWaalsContact C-N 3.31Å; R84-Y86 PolarHBondContact O-N 3.26Å; R84-F87 HydrophobicContact CB-CE1 4.05Å; R84-F87 HydrophobicContact CB-CZ 4.3Å; R84-F87 HydrophobicContact CG-CE1 4.25Å; R84-F87 HydrophobicContact CG-CZ 3.98Å; R84-T88 WeakPolarHBondContact O-CB 3.28Å; R84-T88 PolarHBondContact O-N 2.78Å; R84-T88 PolarHBondContact O-OG1 2.05Å
85	N	95.9	Very high	94.3	Very high	98 Å²	98	72.8 Å²	72.8	52%	0.524	34%	0.341	S	S	.	.	H	α-helix	trans	-61.6	-42.7	176.8	-70.8	-24.3	0	0	0	111.3	D81 E82 F83 C89	D81-N85 WeakPolarHBondContact O-CB 3.35Å; D81-N85 VanDerWaalsContact O-CG 3.25Å; D81-N85 PolarHBondContact O-N 3.06Å; D81-N85 PolarHBondContact O-ND2 3.23Å; E82-N85 PolarHBondContact O-N 3.4Å; F83-N85 PolarHBondContact O-N 3.44Å; N85-C89 WeakPolarHBondContact O-CB 3.33Å; N85-C89 PolarHBondContact O-N 3.48Å
86	Y	96	Very high	93.8	Very high	3 Å²	3	79.2 Å²	79.2	1%	0.012	38%	0.382	C	S	.	.	H	α-helix	trans	-66.4	-53	-178.4	-179.7	-136.3	0	0	0	113.2	A28 E82 F83 R84 T88 C89 L90 C103 A106 Q107 F110	A28-Y86 HydrophobicContact CB-CD1 3.68Å; A28-Y86 HydrophobicContact CB-CE1 3.65Å; A28-Y86 WeakPolarHBondContact O-CE1 3.14Å; E82-Y86 WeakPolarHBondContact O-CB 3.19Å; E82-Y86 PolarHBondContact O-N 3.41Å; F83-Y86 PolarHBondContact O-N 3Å; R84-Y86 VanDerWaalsContact C-N 3.31Å; R84-Y86 PolarHBondContact O-N 3.26Å; Y86-T88 VanDerWaalsContact C-N 3.27Å; Y86-T88 PolarHBondContact O-N 3.5Å; Y86-C89 WeakPolarHBondContact O-CB 3.16Å; Y86-C89 PolarHBondContact O-N 3.01Å; Y86-L90 HydrophobicContact CD2-CD1 4.4Å; Y86-L90 HydrophobicContact CD2-CG 4.43Å; Y86-L90 HydrophobicContact CE1-CD1 4.13Å; Y86-L90 HydrophobicContact CE2-CD1 3.92Å; Y86-L90 HydrophobicContact CE2-CD2 4.36Å; Y86-L90 HydrophobicContact CE2-CG 4.07Å; Y86-L90 PolarHBondContact O-N 2.94Å; Y86-C103 HydrophobicContact CD2-CB 4.32Å; Y86-C103 HydrophobicContact CE2-CB 4.12Å; Y86-A106 HydrophobicContact CD2-CB 4.16Å; Y86-Q107 HydrophobicContact CD2-CB 4.04Å; Y86-Q107 HydrophobicContact CE1-CG 4.35Å; Y86-Q107 HydrophobicContact CE2-CB 3.61Å; Y86-Q107 HydrophobicContact CE2-CG 3.96Å; Y86-F110 AromaticContact CD1-CD1 3.81Å; Y86-F110 HydrophobicContact CD1-CD1 3.81Å; Y86-F110 HydrophobicContact CD1-CE1 4.26Å; Y86-F110 HydrophobicContact CD1-CG 4.33Å; Y86-F110 HydrophobicContact CE1-CD1 4.17Å; Y86-F110 HydrophobicContact CE1-CE1 4.47Å
87	F	95	Very high	93.4	Very high	56 Å²	56	76.8 Å²	76.8	25%	0.246	39%	0.388	C	S	.	.	H	α-helix	trans	-68.6	-29.1	-179.9	77.2	-112.9	0	0	0	112.3	P25 A28 F83 R84 L90 H91	P25-F87 HydrophobicContact CB-CB 4.28Å; P25-F87 HydrophobicContact CB-CD1 4.07Å; P25-F87 HydrophobicContact CB-CG 4.12Å; A28-F87 HydrophobicContact CB-CB 3.91Å; F83-F87 AromaticContact CD1-CD1 3.85Å; F83-F87 HydrophobicContact CD1-CD1 3.85Å; F83-F87 HydrophobicContact CD1-CE1 4Å; F83-F87 AromaticContact CE1-CD1 3.8Å; F83-F87 HydrophobicContact CE1-CD1 3.8Å; F83-F87 HydrophobicContact CE1-CE1 4.08Å; F83-F87 HydrophobicContact CG-CD1 4.26Å; F83-F87 HydrophobicContact CZ-CD1 4.18Å; F83-F87 WeakPolarHBondContact O-CD1 3.22Å; F83-F87 PolarHBondContact O-N 3Å; R84-F87 HydrophobicContact CB-CE1 4.05Å; R84-F87 HydrophobicContact CB-CZ 4.3Å; R84-F87 HydrophobicContact CG-CE1 4.25Å; R84-F87 HydrophobicContact CG-CZ 3.98Å; F87-L90 PolarHBondContact O-N 3.06Å; F87-H91 WeakPolarHBondContact O-CB 3.28Å; F87-H91 PolarHBondContact O-N 3.35Å
88	T	94.9	Very high	92.9	Very high	46 Å²	46	70.5 Å²	70.5	28%	0.282	36%	0.364	S	S	.	.	H	α-helix	trans	-66.6	-40.1	174.7	-60	0	0	0	0	110.9	R84 Y86 H91 K92	R84-T88 WeakPolarHBondContact O-CB 3.28Å; R84-T88 PolarHBondContact O-N 2.78Å; R84-T88 PolarHBondContact O-OG1 2.05Å; Y86-T88 VanDerWaalsContact C-N 3.27Å; Y86-T88 PolarHBondContact O-N 3.5Å; T88-H91 PolarHBondContact O-N 3.25Å; T88-K92 HydrophobicContact CG2-CD 4.14Å; T88-K92 WeakPolarHBondContact O-CG 3.31Å; T88-K92 PolarHBondContact O-N 3.02Å
89	C	95.5	Very high	92.5	Very high	22 Å²	22	68.5 Å²	68.5	15%	0.149	36%	0.36	C	S	.	.	H	α-helix	trans	-59.9	-47.5	172.1	-179.3	0	0	0	0	111	N85 Y86 H91 K92 Y93 C103 A106	N85-C89 WeakPolarHBondContact O-CB 3.33Å; N85-C89 PolarHBondContact O-N 3.48Å; Y86-C89 WeakPolarHBondContact O-CB 3.16Å; Y86-C89 PolarHBondContact O-N 3.01Å; C89-H91 VanDerWaalsContact C-N 3.3Å; C89-H91 PolarHBondContact O-N 3.23Å; C89-K92 PolarHBondContact O-N 3.04Å; C89-Y93 PolarHBondContact O-N 2.97Å; C89-C103 HydrophobicContact CB-CB 3.88Å; C89-C103 WeakPolarHBondContact CB-SG 3.41Å; C89-C103 PolarHBondContact O-SG 3.46Å; C89-C103 VanDerWaalsContact O-SG 3.34Å; C89-C103 WeakPolarHBondContact SG-CA 3.49Å; C89-C103 WeakPolarHBondContact SG-CB 3.16Å; C89-C103 CovalentContact SG-SG 2.05Å; C89-C103 PolarHBondContact SG-SG 2.91Å; C89-A106 HydrophobicContact CB-CB 4.34Å
90	L	94.1	Very high	92.1	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-60.6	-40.6	179.4	-71.9	173.9	0	0	0	112.1	A28 Y86 F87 G94 L100 C103	A28-L90 HydrophobicContact CB-CD1 3.77Å; Y86-L90 HydrophobicContact CD2-CD1 4.4Å; Y86-L90 HydrophobicContact CD2-CG 4.43Å; Y86-L90 HydrophobicContact CE1-CD1 4.13Å; Y86-L90 HydrophobicContact CE2-CD1 3.92Å; Y86-L90 HydrophobicContact CE2-CD2 4.36Å; Y86-L90 HydrophobicContact CE2-CG 4.07Å; Y86-L90 PolarHBondContact O-N 2.94Å; F87-L90 PolarHBondContact O-N 3.06Å; L90-G94 VanDerWaalsContact O-CA 3.27Å; L90-G94 WeakPolarHBondContact O-CA 3.36Å; L90-G94 PolarHBondContact O-N 3.23Å; L90-L100 HydrophobicContact CD1-CD2 4.19Å; L90-L100 HydrophobicContact CD2-CD2 3.54Å; L90-C103 HydrophobicContact CD2-CB 3.96Å; L90-C103 HydrophobicContact CG-CB 4.34Å; L90-C103 PolarHBondContact N-SG 3.19Å; L90-C103 VanDerWaalsContact N-SG 3.42Å
91	H	92.8	Very high	91.8	Very high	135 Å²	135	70 Å²	70	63%	0.625	38%	0.376	S	S	*	.	H	α-helix	trans	-64.3	-41	176.3	-172.3	-74.2	0	0	0	112.3	C24 F87 T88 C89	C24-H91 HydrophobicContact CB-CB 4.47Å; F87-H91 WeakPolarHBondContact O-CB 3.28Å; F87-H91 PolarHBondContact O-N 3.35Å; T88-H91 PolarHBondContact O-N 3.25Å; C89-H91 VanDerWaalsContact C-N 3.3Å; C89-H91 PolarHBondContact O-N 3.23Å
92	K	93.2	Very high	91.5	Very high	145 Å²	145	72.7 Å²	72.7	63%	0.63	38%	0.382	S	S	*	.	H	α-helix	trans	-78.6	-42.4	-176.9	-71.6	179.3	179.8	-178.3	0	113.4	T88 C89	T88-K92 HydrophobicContact CG2-CD 4.14Å; T88-K92 WeakPolarHBondContact O-CG 3.31Å; T88-K92 PolarHBondContact O-N 3.02Å; C89-K92 PolarHBondContact O-N 3.04Å
93	Y	92.5	Very high	91.4	Very high	139 Å²	139	69.6 Å²	69.6	55%	0.545	37%	0.368	S	S	.	.	H	α-helix	trans	-116.9	-10.5	-167.1	-57.9	-64.6	0	0	0	114.4	C89 G95 K102	C89-Y93 PolarHBondContact O-N 2.97Å; Y93-G95 PolarHBondContact O-N 3.32Å; Y93-K102 WeakPolarHBondContact O-CD 3.07Å
94	G	84.9	Confident	91.3	Very high	5 Å²	5	73 Å²	73	5%	0.052	38%	0.381	C	S	.	.	S	Bend	trans	-66.3	-20.6	-177.2	0	0	0	0	0	114.4	L90 Y98 S99	L90-G94 VanDerWaalsContact O-CA 3.27Å; L90-G94 WeakPolarHBondContact O-CA 3.36Å; L90-G94 PolarHBondContact O-N 3.23Å; G94-Y98 CarbonylContact O-C 3.53Å; G94-Y98 WeakPolarHBondContact O-CA 2.9Å; G94-Y98 PolarHBondContact O-N 2.91Å; G94-Y98 VanDerWaalsContact O-N 3.1Å; G94-S99 PolarHBondContact O-N 3.45Å
95	G	86.3	Confident	91.2	Very high	46 Å²	46	70.9 Å²	70.9	47%	0.474	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	-166.1	-175.9	0	0	0	0	0	112.6	Y93 A97 Y98	Y93-G95 PolarHBondContact O-N 3.32Å; G95-A97 PolarHBondContact O-N 3.5Å; G95-Y98 PolarHBondContact O-N 3.25Å
96	P	86.1	Confident	91.1	Very high	136 Å²	136	67.3 Å²	67.3	88%	0.883	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-27.3	-177.2	25.4	-34	0	0	0	113.2
97	A	85.5	Confident	91.1	Very high	86 Å²	86	67.4 Å²	67.4	71%	0.711	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-1.2	-179.4	0	0	0	0	0	114.1	G95 S99	G95-A97 PolarHBondContact O-N 3.5Å; A97-S99 VanDerWaalsContact C-N 3.33Å; A97-S99 PolarHBondContact O-N 2.66Å
98	Y	86.3	Confident	91.1	Very high	61 Å²	61	71.8 Å²	71.8	24%	0.239	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	47.7	-174.4	-59	-82.1	0	0	0	113.9	K23 C24 L27 G94 G95 L100	K23-Y98 HydrophobicContact CD-CE2 3.8Å; C24-Y98 WeakPolarHBondContact SG-CE1 3.03Å; L27-Y98 HydrophobicContact CD2-CD1 4.47Å; L27-Y98 HydrophobicContact CD2-CD2 4.5Å; L27-Y98 HydrophobicContact CD2-CG 3.86Å; G94-Y98 CarbonylContact O-C 3.53Å; G94-Y98 WeakPolarHBondContact O-CA 2.9Å; G94-Y98 PolarHBondContact O-N 2.91Å; G94-Y98 VanDerWaalsContact O-N 3.1Å; G95-Y98 PolarHBondContact O-N 3.25Å; Y98-L100 PolarHBondContact O-N 2.94Å
99	S	87.5	Confident	91.1	Very high	47 Å²	47	72.3 Å²	72.3	33%	0.329	40%	0.395	S	S	.	.			trans	-60.6	125.7	-178.3	-178.7	0	0	0	0	112	G94 A97 T101	G94-S99 PolarHBondContact O-N 3.45Å; A97-S99 VanDerWaalsContact C-N 3.33Å; A97-S99 PolarHBondContact O-N 2.66Å; S99-T101 PolarHBondContact O-N 3.04Å; S99-T101 PolarHBondContact OG-N 3.11Å; S99-T101 PolarHBondContact OG-OG1 3.19Å
100	L	87	Confident	91.2	Very high	40 Å²	40	71.2 Å²	71.2	21%	0.209	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-72.8	-14.4	177	-51.2	-177.2	0	0	0	112.9	L90 Y98 K102 C103 R104	L90-L100 HydrophobicContact CD1-CD2 4.19Å; L90-L100 HydrophobicContact CD2-CD2 3.54Å; Y98-L100 PolarHBondContact O-N 2.94Å; L100-K102 VanDerWaalsContact C-N 3.32Å; L100-K102 PolarHBondContact O-N 2.88Å; L100-C103 PolarHBondContact O-N 3.27Å; L100-C103 VanDerWaalsContact O-N 3.09Å; L100-R104 PolarHBondContact O-N 2.89Å
101	T	89	Confident	91.3	Very high	96 Å²	96	72.1 Å²	72.1	59%	0.589	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-60.1	-39.7	-170.8	56.7	0	0	0	0	112.9	S99 C103	S99-T101 PolarHBondContact O-N 3.04Å; S99-T101 PolarHBondContact OG-N 3.11Å; S99-T101 PolarHBondContact OG-OG1 3.19Å; T101-C103 VanDerWaalsContact C-N 3.29Å; T101-C103 PolarHBondContact O-N 3.01Å
102	K	89.9	Confident	91.5	Very high	148 Å²	148	72 Å²	72	64%	0.643	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-77.7	-14.8	-179.3	-62.6	-174.3	-174.7	174.5	0	113.7	Y93 L100	Y93-K102 WeakPolarHBondContact O-CD 3.07Å; L100-K102 VanDerWaalsContact C-N 3.32Å; L100-K102 PolarHBondContact O-N 2.88Å
103	C	94.3	Very high	91.6	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-113.3	14.6	-172.8	-64.2	0	0	0	0	113.6	Y86 C89 L90 L100 T101 A105 A106 Q107	Y86-C103 HydrophobicContact CD2-CB 4.32Å; Y86-C103 HydrophobicContact CE2-CB 4.12Å; C89-C103 HydrophobicContact CB-CB 3.88Å; C89-C103 WeakPolarHBondContact CB-SG 3.41Å; C89-C103 PolarHBondContact O-SG 3.46Å; C89-C103 VanDerWaalsContact O-SG 3.34Å; C89-C103 WeakPolarHBondContact SG-CA 3.49Å; C89-C103 WeakPolarHBondContact SG-CB 3.16Å; C89-C103 CovalentContact SG-SG 2.05Å; C89-C103 PolarHBondContact SG-SG 2.91Å; L90-C103 HydrophobicContact CD2-CB 3.96Å; L90-C103 HydrophobicContact CG-CB 4.34Å; L90-C103 PolarHBondContact N-SG 3.19Å; L90-C103 VanDerWaalsContact N-SG 3.42Å; L100-C103 PolarHBondContact O-N 3.27Å; L100-C103 VanDerWaalsContact O-N 3.09Å; T101-C103 VanDerWaalsContact C-N 3.29Å; T101-C103 PolarHBondContact O-N 3.01Å; C103-A105 VanDerWaalsContact C-N 3.27Å; C103-A105 PolarHBondContact O-N 3.44Å; C103-A106 PolarHBondContact O-N 3.45Å; C103-A106 VanDerWaalsContact O-N 3.1Å; C103-Q107 PolarHBondContact O-N 2.68Å
104	R	93.5	Very high	91.8	Very high	94 Å²	94	58.9 Å²	58.9	36%	0.355	34%	0.339	S	S	.	.	H	α-helix	trans	-58.3	-38.3	176.7	-63.5	-57.7	-170.5	175	3.1	112.5	L100 A106 Q107 Y108	L100-R104 PolarHBondContact O-N 2.89Å; R104-A106 VanDerWaalsContact C-N 3.26Å; R104-A106 PolarHBondContact O-N 2.91Å; R104-Q107 WeakPolarHBondContact O-CB 3.25Å; R104-Q107 PolarHBondContact O-N 2.96Å; R104-Y108 HydrophobicContact CB-CE2 3.97Å; R104-Y108 WeakPolarHBondContact O-CD2 3.34Å; R104-Y108 PolarHBondContact O-N 3.01Å
105	A	94.3	Very high	92.4	Very high	86 Å²	86	63.7 Å²	63.7	71%	0.711	36%	0.359	S	S	*	.	H	α-helix	trans	-60	-34.5	176.7	0	0	0	0	0	113.2	C103 P109	C103-A105 VanDerWaalsContact C-N 3.27Å; C103-A105 PolarHBondContact O-N 3.44Å; A105-P109 WeakPolarHBondContact O-CD 3.42Å
106	A	94.7	Very high	92.9	Very high	22 Å²	22	65.4 Å²	65.4	18%	0.182	36%	0.36	C	S	.	.	H	α-helix	trans	-85.8	-21.9	174.7	0	0	0	0	0	112.8	Y86 C89 C103 R104	Y86-A106 HydrophobicContact CD2-CB 4.16Å; C89-A106 HydrophobicContact CB-CB 4.34Å; C103-A106 PolarHBondContact O-N 3.45Å; C103-A106 VanDerWaalsContact O-N 3.1Å; R104-A106 VanDerWaalsContact C-N 3.26Å; R104-A106 PolarHBondContact O-N 2.91Å
107	Q	95.4	Very high	93.3	Very high	5 Å²	5	63.7 Å²	63.7	2%	0.023	34%	0.34	C	S	.	.	H	α-helix	trans	-71.8	-43	177.6	-169.7	-158.4	-53.8	0	0	112.4	Y86 C103 R104 F110 D111	Y86-Q107 HydrophobicContact CD2-CB 4.04Å; Y86-Q107 HydrophobicContact CE1-CG 4.35Å; Y86-Q107 HydrophobicContact CE2-CB 3.61Å; Y86-Q107 HydrophobicContact CE2-CG 3.96Å; C103-Q107 PolarHBondContact O-N 2.68Å; R104-Q107 WeakPolarHBondContact O-CB 3.25Å; R104-Q107 PolarHBondContact O-N 2.96Å; Q107-F110 WeakPolarHBondContact O-CB 3.46Å; Q107-F110 PolarHBondContact O-N 3.23Å; Q107-D111 WeakPolarHBondContact CG-OD2 3.34Å; Q107-D111 PolarHBondContact NE2-OD2 3.03Å; Q107-D111 PolarHBondContact O-N 3.41Å
108	Y	95	Very high	93.6	Very high	148 Å²	148	61 Å²	61	58%	0.58	31%	0.314	S	S	*	.	H	α-helix	trans	-59	-46.4	-176.4	-64.9	-62.6	0	0	0	113.5	R104 F110 D111 E112	R104-Y108 HydrophobicContact CB-CE2 3.97Å; R104-Y108 WeakPolarHBondContact O-CD2 3.34Å; R104-Y108 PolarHBondContact O-N 3.01Å; Y108-F110 VanDerWaalsContact C-N 3.28Å; Y108-F110 PolarHBondContact O-N 2.96Å; Y108-D111 PolarHBondContact O-N 3.14Å; Y108-E112 WeakPolarHBondContact O-CB 3.35Å; Y108-E112 PolarHBondContact O-N 2.73Å
109	P	95.9	Very high	93.9	Very high	57 Å²	57	65 Å²	65	37%	0.37	34%	0.339	S	S	.	.	H	α-helix	trans	-60.1	-37.4	175.4	-24.5	34.5	0	0	0	113	E82 A105 E112 C113	E82-P109 HydrophobicContact CG-CB 4.23Å; A105-P109 WeakPolarHBondContact O-CD 3.42Å; P109-E112 PolarHBondContact O-N 3.42Å; P109-C113 WeakPolarHBondContact O-CB 3.46Å; P109-C113 PolarHBondContact O-N 3.18Å
110	F	96.6	Very high	94.2	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-68.3	-44.5	177.3	173.9	-115.8	0	0	0	112.2	H32 V75 E82 F83 Y86 Q107 Y108 E112 C113 I114	H32-F110 AromaticContact CD2-CE1 3.69Å; V75-F110 HydrophobicContact CG1-CE2 4.17Å; E82-F110 HydrophobicContact CB-CB 4.19Å; F83-F110 HydrophobicContact CB-CD2 3.97Å; F83-F110 HydrophobicContact CB-CE2 3.79Å; F83-F110 HydrophobicContact CD2-CD2 4.15Å; F83-F110 HydrophobicContact CD2-CE1 4.28Å; F83-F110 AromaticContact CD2-CE2 3.49Å; F83-F110 HydrophobicContact CD2-CE2 3.49Å; F83-F110 VanDerWaalsContact CD2-CE2 3.49Å; F83-F110 AromaticContact CD2-CZ 3.53Å; F83-F110 HydrophobicContact CD2-CZ 3.53Å; F83-F110 HydrophobicContact CE2-CE2 4.44Å; F83-F110 HydrophobicContact CE2-CZ 4.09Å; F83-F110 HydrophobicContact CG-CE2 4.02Å; F83-F110 HydrophobicContact CG-CZ 4.47Å; Y86-F110 AromaticContact CD1-CD1 3.81Å; Y86-F110 HydrophobicContact CD1-CD1 3.81Å; Y86-F110 HydrophobicContact CD1-CE1 4.26Å; Y86-F110 HydrophobicContact CD1-CG 4.33Å; Y86-F110 HydrophobicContact CE1-CD1 4.17Å; Y86-F110 HydrophobicContact CE1-CE1 4.47Å; Q107-F110 WeakPolarHBondContact O-CB 3.46Å; Q107-F110 PolarHBondContact O-N 3.23Å; Y108-F110 VanDerWaalsContact C-N 3.28Å; Y108-F110 PolarHBondContact O-N 2.96Å; F110-E112 VanDerWaalsContact C-N 3.27Å; F110-E112 PolarHBondContact O-N 3.25Å; F110-C113 PolarHBondContact O-N 3.33Å; F110-I114 HydrophobicContact CD1-CD1 4.25Å; F110-I114 HydrophobicContact CD2-CD1 4.15Å; F110-I114 HydrophobicContact CD2-CG1 4.48Å; F110-I114 HydrophobicContact CE1-CD1 3.66Å; F110-I114 HydrophobicContact CE2-CD1 3.51Å; F110-I114 HydrophobicContact CE2-CG1 4.1Å; F110-I114 HydrophobicContact CG-CD1 4.5Å; F110-I114 HydrophobicContact CZ-CD1 3.25Å; F110-I114 HydrophobicContact CZ-CG1 4.31Å; F110-I114 WeakPolarHBondContact O-CG1 3.42Å; F110-I114 PolarHBondContact O-N 3.49Å; F110-I114 VanDerWaalsContact O-N 3.08Å
111	D	96.4	Very high	94.5	Very high	19 Å²	19	66.8 Å²	66.8	10%	0.102	34%	0.341	C	S	.	.	H	α-helix	trans	-62.3	-37	175.6	-69.7	-26.9	0	0	0	111.1	H32 Q107 Y108 K115 R122	H32-D111 IonicContact CD2-OD1 3.18Å; H32-D111 IonicContact CE1-OD1 2.7Å; H32-D111 IonicContact NE2-OD1 3.14Å; H32-D111 PolarHBondContact NE2-OD1 2.72Å; Q107-D111 WeakPolarHBondContact CG-OD2 3.34Å; Q107-D111 PolarHBondContact NE2-OD2 3.03Å; Q107-D111 PolarHBondContact O-N 3.41Å; Y108-D111 PolarHBondContact O-N 3.14Å; D111-K115 WeakPolarHBondContact O-CB 2.93Å; D111-K115 PolarHBondContact O-N 3.42Å; D111-K115 VanDerWaalsContact O-N 3.09Å; D111-R122 IonicContact OD1-NH1 3.33Å; D111-R122 PolarHBondContact OD1-NH1 3.15Å; D111-R122 VanDerWaalsContact OD1-NH1 3.14Å; D111-R122 WeakPolarHBondContact OD2-CD 3.32Å; D111-R122 IonicContact OD2-CZ 2.71Å; D111-R122 IonicContact OD2-NH1 3.96Å; D111-R122 PolarHBondContact OD2-NH1 3.18Å
112	E	96.4	Very high	94.8	Very high	132 Å²	132	65.4 Å²	65.4	62%	0.617	33%	0.325	S	S	*	.	H	α-helix	trans	-67.3	-46.6	175.8	-173.9	170.5	-167.2	0	0	112	Y108 P109 F110 I114 K115 T116	Y108-E112 WeakPolarHBondContact O-CB 3.35Å; Y108-E112 PolarHBondContact O-N 2.73Å; P109-E112 PolarHBondContact O-N 3.42Å; F110-E112 VanDerWaalsContact C-N 3.27Å; F110-E112 PolarHBondContact O-N 3.25Å; E112-I114 VanDerWaalsContact C-N 3.31Å; E112-I114 PolarHBondContact O-N 2.95Å; E112-K115 WeakPolarHBondContact O-CA 3.03Å; E112-K115 WeakPolarHBondContact O-CB 3.49Å; E112-K115 PolarHBondContact O-N 2.99Å; E112-T116 WeakPolarHBondContact O-CG2 3.43Å; E112-T116 PolarHBondContact O-N 3.38Å; E112-T116 PolarHBondContact O-OG1 3.29Å
113	C	97.1	Very high	95	Very high	8 Å²	8	59.1 Å²	59.1	5%	0.054	30%	0.299	C	S	.	.	H	α-helix	trans	-60.1	-39.6	177.1	-174.9	0	0	0	0	112.6	C79 E82 P109 F110 K115 T116 H117	C79-C113 WeakPolarHBondContact CA-SG 3.35Å; C79-C113 HydrophobicContact CB-CB 3.91Å; C79-C113 WeakPolarHBondContact CB-SG 3.42Å; C79-C113 WeakPolarHBondContact SG-CB 3.44Å; C79-C113 CovalentContact SG-SG 2.03Å; C79-C113 PolarHBondContact SG-SG 3.45Å; E82-C113 HydrophobicContact CG-CB 4.39Å; P109-C113 WeakPolarHBondContact O-CB 3.46Å; P109-C113 PolarHBondContact O-N 3.18Å; F110-C113 PolarHBondContact O-N 3.33Å; C113-K115 VanDerWaalsContact C-N 3.34Å; C113-T116 PolarHBondContact O-N 3Å; C113-T116 PolarHBondContact O-OG1 3.48Å; C113-H117 PolarHBondContact O-CD2 3.47Å; C113-H117 PolarHBondContact O-N 3.08Å
114	I	96.3	Very high	94.9	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-66.6	-39.2	174.8	-70.8	177.1	0	0	0	111	H32 F110 E112 T116 L118 N119 Q120	H32-I114 HydrophobicContact CB-CD1 3.92Å; H32-I114 WeakPolarHBondContact CD2-CD1 3.45Å; F110-I114 HydrophobicContact CD1-CD1 4.25Å; F110-I114 HydrophobicContact CD2-CD1 4.15Å; F110-I114 HydrophobicContact CD2-CG1 4.48Å; F110-I114 HydrophobicContact CE1-CD1 3.66Å; F110-I114 HydrophobicContact CE2-CD1 3.51Å; F110-I114 HydrophobicContact CE2-CG1 4.1Å; F110-I114 HydrophobicContact CG-CD1 4.5Å; F110-I114 HydrophobicContact CZ-CD1 3.25Å; F110-I114 HydrophobicContact CZ-CG1 4.31Å; F110-I114 WeakPolarHBondContact O-CG1 3.42Å; F110-I114 PolarHBondContact O-N 3.49Å; F110-I114 VanDerWaalsContact O-N 3.08Å; E112-I114 VanDerWaalsContact C-N 3.31Å; E112-I114 PolarHBondContact O-N 2.95Å; I114-T116 VanDerWaalsContact C-N 3.34Å; I114-T116 PolarHBondContact O-N 2.03Å; I114-L118 HydrophobicContact CG2-CB 4.2Å; I114-L118 WeakPolarHBondContact O-CA 3.33Å; I114-L118 WeakPolarHBondContact O-CB 3.44Å; I114-L118 PolarHBondContact O-N 3.41Å; I114-N119 PolarHBondContact O-N 3.47Å; I114-Q120 HydrophobicContact CG2-CB 4.02Å; I114-Q120 WeakPolarHBondContact CG2-O 3.42Å
115	K	96.4	Very high	94.8	Very high	106 Å²	106	68 Å²	68	46%	0.461	35%	0.353	S	S	.	.	H	α-helix	trans	-62.5	-41	176.6	-178.5	174.8	172.7	160.7	0	111.5	D111 E112 C113 N119 E121	D111-K115 WeakPolarHBondContact O-CB 2.93Å; D111-K115 PolarHBondContact O-N 3.42Å; D111-K115 VanDerWaalsContact O-N 3.09Å; E112-K115 WeakPolarHBondContact O-CA 3.03Å; E112-K115 WeakPolarHBondContact O-CB 3.49Å; E112-K115 PolarHBondContact O-N 2.99Å; C113-K115 VanDerWaalsContact C-N 3.34Å; K115-N119 WeakPolarHBondContact O-CA 2.99Å; K115-N119 PolarHBondContact O-N 3.49Å; K115-E121 HydrophobicContact CD-CG 4.14Å; K115-E121 VanDerWaalsContact CE-OE1 3.29Å; K115-E121 WeakPolarHBondContact CE-OE1 3.44Å; K115-E121 HydrophobicContact CG-CG 4.31Å; K115-E121 IonicContact NZ-OE1 3.12Å; K115-E121 PolarHBondContact NZ-OE1 3.08Å
116	T	96.5	Very high	94.8	Very high	83 Å²	83	68 Å²	68	51%	0.509	34%	0.342	S	S	.	.	H	α-helix	trans	-73.5	-40.8	-178.7	57	0	0	0	0	113.4	E112 C113 I114	E112-T116 WeakPolarHBondContact O-CG2 3.43Å; E112-T116 PolarHBondContact O-N 3.38Å; E112-T116 PolarHBondContact O-OG1 3.29Å; C113-T116 PolarHBondContact O-N 3Å; C113-T116 PolarHBondContact O-OG1 3.48Å; I114-T116 VanDerWaalsContact C-N 3.34Å; I114-T116 PolarHBondContact O-N 2.03Å
117	H	94.8	Very high	94.7	Very high	99 Å²	99	71 Å²	71	46%	0.458	35%	0.349	S	S	.	.	H	α-helix	trans	-96.9	-34.2	-173.1	-68	-68.6	0	0	0	114.6	H78 C113	H78-H117 HydrophobicContact CB-CB 3.84Å; H78-H117 AromaticContact CG-CG 3.97Å; H78-H117 AromaticContact ND1-ND1 3.92Å; C113-H117 PolarHBondContact O-CD2 3.47Å; C113-H117 PolarHBondContact O-N 3.08Å
118	L	92.3	Very high	94.6	Very high	29 Å²	29	74.7 Å²	74.7	15%	0.152	37%	0.365	C	S	.	.	H	α-helix	trans	-104.1	-1.2	-178.4	-74.6	79	0	0	0	112.6	F36 F71 Q74 I114 Q120	F36-L118 HydrophobicContact CD2-CD2 4.45Å; F36-L118 HydrophobicContact CE2-CD2 4.46Å; F71-L118 HydrophobicContact CD2-CD2 4.33Å; F71-L118 HydrophobicContact CE2-CD2 4.25Å; Q74-L118 HydrophobicContact CB-CD2 4.25Å; Q74-L118 VanDerWaalsContact OE1-CD2 3.23Å; I114-L118 HydrophobicContact CG2-CB 4.2Å; I114-L118 WeakPolarHBondContact O-CA 3.33Å; I114-L118 WeakPolarHBondContact O-CB 3.44Å; I114-L118 PolarHBondContact O-N 3.41Å; L118-Q120 HydrophobicContact CB-CB 4.34Å; L118-Q120 PolarHBondContact O-N 3.48Å; L118-Q120 VanDerWaalsContact O-N 3.1Å
119	N	93.5	Very high	94.5	Very high	145 Å²	145	74.2 Å²	74.2	78%	0.775	37%	0.372	S	S	*	.			trans	52.6	29.2	-174.6	-64.2	-44.9	0	0	0	113.3	I114 K115	I114-N119 PolarHBondContact O-N 3.47Å; K115-N119 WeakPolarHBondContact O-CA 2.99Å; K115-N119 PolarHBondContact O-N 3.49Å
120	Q	93	Very high	94.3	Very high	16 Å²	16	75.7 Å²	75.7	8%	0.075	38%	0.38	C	S	.	.			trans	-114.3	109.8	-175.2	-173.4	179.4	-67.8	0	0	110.7	H32 K35 I114 L118	H32-Q120 PolarHBondContact O-NE2 3.26Å; K35-Q120 HydrophobicContact CD-CG 3.69Å; K35-Q120 HydrophobicContact CG-CG 4.11Å; I114-Q120 HydrophobicContact CG2-CB 4.02Å; I114-Q120 WeakPolarHBondContact CG2-O 3.42Å; L118-Q120 HydrophobicContact CB-CB 4.34Å; L118-Q120 PolarHBondContact O-N 3.48Å; L118-Q120 VanDerWaalsContact O-N 3.1Å
121	E	93.9	Very high	94	Very high	109 Å²	109	82.3 Å²	82.3	51%	0.509	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-75.1	148.6	171.3	-59.8	-165.7	144.5	0	0	111.5	K35 K115 P123	K35-E121 WeakPolarHBondContact CD-O 3.19Å; K35-E121 PolarHBondContact NZ-O 3.02Å; K115-E121 HydrophobicContact CD-CG 4.14Å; K115-E121 VanDerWaalsContact CE-OE1 3.29Å; K115-E121 WeakPolarHBondContact CE-OE1 3.44Å; K115-E121 HydrophobicContact CG-CG 4.31Å; K115-E121 IonicContact NZ-OE1 3.12Å; K115-E121 PolarHBondContact NZ-OE1 3.08Å; E121-P123 WeakPolarHBondContact O-CD 3.39Å
122	R	94.1	Very high	93.6	Very high	68 Å²	68	84.5 Å²	84.5	26%	0.257	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-59.1	126.3	171.8	-173.5	-177.2	-177.3	100.4	-5.7	110	I31 D111	I31-R122 HydrophobicContact CG2-CG 3.87Å; D111-R122 IonicContact OD1-NH1 3.33Å; D111-R122 PolarHBondContact OD1-NH1 3.15Å; D111-R122 VanDerWaalsContact OD1-NH1 3.14Å; D111-R122 WeakPolarHBondContact OD2-CD 3.32Å; D111-R122 IonicContact OD2-CZ 2.71Å; D111-R122 IonicContact OD2-NH1 3.96Å; D111-R122 PolarHBondContact OD2-NH1 3.18Å
123	P	94.3	Very high	93.4	Very high	15 Å²	15	86.6 Å²	86.6	10%	0.097	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-56.2	150.9	174.5	-9	10.6	0	0	0	112.8	I31 K35 E121 Y127 F128	I31-P123 HydrophobicContact CG2-CG 3.99Å; K35-P123 HydrophobicContact CB-CG 3.89Å; K35-P123 HydrophobicContact CD-CG 3.76Å; K35-P123 HydrophobicContact CG-CG 4.3Å; E121-P123 WeakPolarHBondContact O-CD 3.39Å; P123-Y127 HydrophobicContact CB-CD1 3.56Å; P123-Y127 HydrophobicContact CB-CE1 4.46Å; P123-Y127 HydrophobicContact CB-CG 3.68Å; P123-Y127 HydrophobicContact CG-CD1 4.01Å; P123-F128 HydrophobicContact CB-CE2 4.21Å; P123-F128 HydrophobicContact CG-CE2 3.83Å; P123-F128 HydrophobicContact CG-CZ 3.95Å
124	K	93.3	Very high	93.2	Very high	156 Å²	156	88.7 Å²	88.7	68%	0.678	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-61.3	152.3	166.6	-64.4	-177	-176.5	178.4	0	110.2	D126 Y127	K124-D126 WeakPolarHBondContact CB-OD1 3Å; K124-D126 PolarHBondContact O-N 2.65Å; K124-Y127 WeakPolarHBondContact O-CB 3.26Å; K124-Y127 PolarHBondContact O-N 3.11Å
125	P	90.8	Very high	93	Very high	125 Å²	125	98.2 Å²	98.2	81%	0.812	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-24.6	-175.5	21.9	-32.7	0	0	0	114.5
126	D	93.2	Very high	92.8	Very high	87 Å²	87	95.2 Å²	95.2	47%	0.465	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-18.3	176.3	58.9	-20	0	0	0	113.7	K124 F128 N129 V130	K124-D126 WeakPolarHBondContact CB-OD1 3Å; K124-D126 PolarHBondContact O-N 2.65Å; D126-F128 VanDerWaalsContact C-N 3.28Å; D126-F128 PolarHBondContact O-N 2.8Å; D126-F128 VanDerWaalsContact O-N 3.09Å; D126-N129 PolarHBondContact O-N 3.23Å; D126-V130 PolarHBondContact O-N 3.48Å
127	Y	93.8	Very high	92.4	Very high	83 Å²	83	99.5 Å²	99.5	33%	0.325	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-48.1	-48.4	-171.4	-177.2	-110.6	0	0	0	112.4	D38 P123 K124 R132	D38-Y127 PolarHBondContact OD2-OH 3.06Å; P123-Y127 HydrophobicContact CB-CD1 3.56Å; P123-Y127 HydrophobicContact CB-CE1 4.46Å; P123-Y127 HydrophobicContact CB-CG 3.68Å; P123-Y127 HydrophobicContact CG-CD1 4.01Å; K124-Y127 WeakPolarHBondContact O-CB 3.26Å; K124-Y127 PolarHBondContact O-N 3.11Å; Y127-R132 VanDerWaalsContact CE1-CZ 3.5Å; Y127-R132 PolarHBondContact O-NE 3.23Å; Y127-R132 PolarHBondContact O-NH2 2.68Å
128	F	93	Very high	92.1	Very high	84 Å²	84	97 Å²	97	37%	0.368	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-78.6	-13	-177.9	-61.4	-72.1	0	0	0	115.1	I31 P123 D126	I31-F128 HydrophobicContact CG2-CE2 4.43Å; P123-F128 HydrophobicContact CB-CE2 4.21Å; P123-F128 HydrophobicContact CG-CE2 3.83Å; P123-F128 HydrophobicContact CG-CZ 3.95Å; D126-F128 VanDerWaalsContact C-N 3.28Å; D126-F128 PolarHBondContact O-N 2.8Å; D126-F128 VanDerWaalsContact O-N 3.09Å
129	N	92.8	Very high	91.9	Very high	137 Å²	137	101.1 Å²	101.1	73%	0.733	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-94.4	-9.5	-178.1	-59.4	-24	0	0	0	112.6	D126	D126-N129 PolarHBondContact O-N 3.23Å
130	V	92.2	Very high	91.6	Very high	89 Å²	89	104.2 Å²	104.2	54%	0.539	52%	0.518	S	S	.	.	S	Bend	trans	-81.5	139.8	176.9	-177.7	0	0	0	0	109.8	D126 R132	D126-V130 PolarHBondContact O-N 3.48Å; V130-R132 WeakPolarHBondContact O-CG 3.49Å; V130-R132 PolarHBondContact O-N 3.2Å
131	V	90.7	Very high	91.3	Very high	138 Å²	138	108 Å²	108	84%	0.836	53%	0.533	S	S	*	.			trans	-64.5	126	171.3	179.5	0	0	0	0	109.3
132	R	88	Confident	90.7	Very high	66 Å²	66	110.7 Å²	110.7	25%	0.249	55%	0.545	C	S	.	.			trans	-114.2	128.7	-177.1	-54.2	-179.2	-175.2	168.5	-1.4	109.9	D38 K42 Y127 V130	D38-R132 IonicContact OD1-CZ 3.69Å; D38-R132 IonicContact OD1-NH1 3.84Å; D38-R132 PolarHBondContact OD1-NH1 3.16Å; D38-R132 IonicContact OD2-CZ 3.6Å; D38-R132 IonicContact OD2-NH1 3.81Å; D38-R132 PolarHBondContact OD2-NH1 3.12Å; K42-R132 HydrophobicContact CD-CB 4.49Å; Y127-R132 VanDerWaalsContact CE1-CZ 3.5Å; Y127-R132 PolarHBondContact O-NE 3.23Å; Y127-R132 PolarHBondContact O-NH2 2.68Å; V130-R132 WeakPolarHBondContact O-CG 3.49Å; V130-R132 PolarHBondContact O-N 3.2Å
133	L	91.7	Very high	90	Very high	175 Å²	175	112.5 Å²	112.5	92%	0.916	57%	0.565	S	S	*	*			trans	-81.4	125.7	171.4	-63	174.4	0	0	0	109.3
134	H	92.8	Very high	89	Confident	52 Å²	52	114.7 Å²	114.7	24%	0.241	59%	0.591	C	S	.	*			trans	-113.2	136.4	175	-166.1	60	0	0	0	109.5	N39 K42 E43 L46	N39-H134 PolarHBondContact O-CE1 3.39Å; K42-H134 HydrophobicContact CB-CB 3.93Å; K42-H134 HydrophobicContact CD-CB 4.26Å; E43-H134 IonicContact OE2-CD2 3.93Å; E43-H134 PolarHBondContact OE2-CD2 3.13Å; E43-H134 IonicContact OE2-NE2 3.75Å; E43-H134 PolarHBondContact OE2-NE2 3.24Å; L46-H134 HydrophobicContact CD2-CB 4.35Å
135	K	92.3	Very high	88	Confident	200 Å²	200	115 Å²	115	87%	0.87	60%	0.599	S	S	*	*			trans	-98.7	119.9	178.6	-71.5	-178	178.3	-178.4	0	108.4
136	T	91	Very high	87.2	Confident	43 Å²	43	112.3 Å²	112.3	26%	0.264	59%	0.588	S	S	.	*			trans	-112.5	148.8	-178.4	66.7	0	0	0	0	110.4	E43 L46	E43-T136 WeakPolarHBondContact OE2-CG2 3.43Å; L46-T136 HydrophobicContact CD2-CG2 3.28Å; L46-T136 HydrophobicContact CG-CG2 4.39Å
137	N	89.6	Confident	86.4	Confident	173 Å²	173	114.8 Å²	114.8	93%	0.925	61%	0.609	S	S	*	*	S	Bend	trans	-89.4	-17.1	176.5	-66.8	-28.3	0	0	0	113.1
138	R	87.5	Confident	85.6	Confident	46 Å²	46	117.7 Å²	117.7	17%	0.174	63%	0.627	C	S	.	*	S	Bend	trans	-70.1	153.5	179.5	71.6	-154.6	-170	131	11.3	112	E43 L46 C47 E50 E60	E43-R138 IonicContact OE1-NE 3.06Å; L46-R138 PolarHBondContact O-NH2 3.49Å; C47-R138 VanDerWaalsContact CA-CZ 3.42Å; C47-R138 VanDerWaalsContact N-NH2 3.11Å; C47-R138 PolarHBondContact SG-NH1 3.38Å; E50-R138 VanDerWaalsContact CD-NH2 3.32Å; E50-R138 IonicContact OE2-CZ 2.88Å; E50-R138 IonicContact OE2-NE 3.51Å; E50-R138 IonicContact OE2-NH2 3.01Å; E50-R138 PolarHBondContact OE2-NH2 3.07Å; E60-R138 IonicContact OE1-NH1 3.05Å
139	P	88.7	Confident	85.1	Confident	117 Å²	117	119.5 Å²	119.5	76%	0.76	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-64.2	148.7	172.6	28.8	-34.9	0	0	0	110.4	Y141	P139-Y141 PolarHBondContact O-N 2.89Å
140	R	86.5	Confident	84.7	Confident	210 Å²	210	121.9 Å²	121.9	79%	0.792	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-63.3	133.1	172.4	-178.8	-179.7	-68	-178.1	-0.6	109	E142	R140-E142 PolarHBondContact O-N 3.49Å
141	Y	86.6	Confident	84.5	Confident	96 Å²	96	126.8 Å²	126.8	38%	0.376	66%	0.663	S	S	.	*	P	Polyproline II helix	trans	-68.5	129	172	-178.3	-99.6	0	0	0	110.5	E50 T51 P139 P143	E50-Y141 WeakPolarHBondContact O-CD1 3.42Å; T51-Y141 HydrophobicContact CG2-CD2 4.06Å; T51-Y141 HydrophobicContact CG2-CG 4.32Å; P139-Y141 PolarHBondContact O-N 2.89Å; Y141-P143 HydrophobicContact CE1-CB 3.99Å
142	E	82.6	Confident	84.4	Confident	165 Å²	165	127.1 Å²	127.1	77%	0.771	66%	0.658	S	S	*	*			trans	-103.7	114.5	170	-67.2	-176.6	170.4	0	0	107.6	R140 G144	R140-E142 PolarHBondContact O-N 3.49Å; E142-G144 PolarHBondContact O-N 3.13Å; E142-G144 VanDerWaalsContact O-N 3.11Å
143	P	78.9	Confident	84.4	Confident	105 Å²	105	129.5 Å²	129.5	68%	0.682	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-62.8	120.1	177.4	25.8	-31.8	0	0	0	108.4	Y141 L145	Y141-P143 HydrophobicContact CE1-CB 3.99Å; P143-L145 PolarHBondContact O-N 2.94Å
144	G	72.7	Confident	84.2	Confident	62 Å²	62	126.1 Å²	126.1	64%	0.639	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-56.4	140.8	169.1	0	0	0	0	0	109.2	E142 A146	E142-G144 PolarHBondContact O-N 3.13Å; E142-G144 VanDerWaalsContact O-N 3.11Å; G144-A146 PolarHBondContact O-N 3.39Å
145	L	72.8	Confident	84	Confident	161 Å²	161	130.5 Å²	130.5	84%	0.843	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-54.7	130	167.7	-77.9	128.8	0	0	0	107.6	P143	P143-L145 PolarHBondContact O-N 2.94Å
146	A	75	Confident	83.7	Confident	70 Å²	70	124.7 Å²	124.7	58%	0.579	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-50.9	141.7	167.9	0	0	0	0	0	108	G144 M148	G144-A146 PolarHBondContact O-N 3.39Å; A146-M148 PolarHBondContact O-N 3.5Å
147	P	74.5	Confident	83.4	Confident	138 Å²	138	128.5 Å²	128.5	90%	0.896	69%	0.691	S	S	*	*			trans	-64.4	88.3	176.8	26.8	-33.1	0	0	0	108.1
148	M	77.5	Confident	83.1	Confident	144 Å²	144	126.2 Å²	126.2	71%	0.709	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-88.7	137.5	170.7	-63.1	-158.8	-51.8	0	0	106.7	A146 E150	A146-M148 PolarHBondContact O-N 3.5Å; M148-E150 PolarHBondContact O-N 3.4Å
149	P	83.6	Confident	82.9	Confident	123 Å²	123	131.8 Å²	131.8	80%	0.799	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-55.2	144.9	168.5	25.8	-32.9	0	0	0	108.7	R151	P149-R151 PolarHBondContact O-N 2.99Å
150	E	84.1	Confident	82.7	Confident	187 Å²	187	131.4 Å²	131.4	87%	0.874	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-50.8	135	173.2	-68	-177.6	175.2	0	0	109.1	M148 I152	M148-E150 PolarHBondContact O-N 3.4Å; E150-I152 PolarHBondContact O-N 2.7Å; E150-I152 VanDerWaalsContact O-N 3.16Å
151	R	87.8	Confident	82.5	Confident	191 Å²	191	126.9 Å²	126.9	72%	0.721	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-57.9	125.1	176.4	-173.8	-177.3	179.4	-142.4	-2.4	107.4	P149 D154	P149-R151 PolarHBondContact O-N 2.99Å; R151-D154 IonicContact CZ-OD1 2.66Å; R151-D154 IonicContact CZ-OD2 3.5Å; R151-D154 VanDerWaalsContact CZ-OD2 3.28Å; R151-D154 IonicContact NE-OD1 3.79Å; R151-D154 IonicContact NH1-OD1 3.28Å; R151-D154 IonicContact NH1-OD2 3.92Å; R151-D154 PolarHBondContact NH1-OD2 3.05Å; R151-D154 VanDerWaalsContact NH2-CG 3.33Å; R151-D154 IonicContact NH2-OD1 3.8Å; R151-D154 PolarHBondContact NH2-OD1 3.34Å; R151-D154 IonicContact NH2-OD2 3.67Å; R151-D154 PolarHBondContact NH2-OD2 2.92Å
152	I	88.6	Confident	82.4	Confident	146 Å²	146	129.2 Å²	129.2	75%	0.749	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-52.5	132.8	172.4	-57.3	169.4	0	0	0	107.2	E150 D154	E150-I152 PolarHBondContact O-N 2.7Å; E150-I152 VanDerWaalsContact O-N 3.16Å; I152-D154 PolarHBondContact O-N 3.42Å
153	P	87.8	Confident	82.5	Confident	115 Å²	115	124.4 Å²	124.4	75%	0.747	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-49.9	139.6	178.9	-27	33.6	0	0	0	111
154	D	87.6	Confident	82.9	Confident	105 Å²	105	123 Å²	123	56%	0.561	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-59.9	147.8	173	-71.9	-36.3	0	0	0	109.3	R151 I152	R151-D154 IonicContact CZ-OD1 2.66Å; R151-D154 IonicContact CZ-OD2 3.5Å; R151-D154 VanDerWaalsContact CZ-OD2 3.28Å; R151-D154 IonicContact NE-OD1 3.79Å; R151-D154 IonicContact NH1-OD1 3.28Å; R151-D154 IonicContact NH1-OD2 3.92Å; R151-D154 PolarHBondContact NH1-OD2 3.05Å; R151-D154 VanDerWaalsContact NH2-CG 3.33Å; R151-D154 IonicContact NH2-OD1 3.8Å; R151-D154 PolarHBondContact NH2-OD1 3.34Å; R151-D154 IonicContact NH2-OD2 3.67Å; R151-D154 PolarHBondContact NH2-OD2 2.92Å; I152-D154 PolarHBondContact O-N 3.42Å
155	L	87.6	Confident	83.6	Confident	143 Å²	143	128.2 Å²	128.2	75%	0.749	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-54.2	135.3	175.2	-136.8	78.6	0	0	0	107.9
156	P	85.9	Confident	84.4	Confident	78 Å²	78	131.2 Å²	131.2	51%	0.506	69%	0.693	S	S	.	*	P	Polyproline II helix	trans	-60	143.6	179.6	26.4	-36.4	0	0	0	110.4	L158 F161	P156-L158 PolarHBondContact O-N 3.31Å; P156-F161 HydrophobicContact CB-CE2 3.69Å; P156-F161 HydrophobicContact CB-CZ 3.65Å; P156-F161 HydrophobicContact CG-CE2 3.86Å; P156-F161 HydrophobicContact CG-CZ 3.66Å
157	D	86.6	Confident	85	Confident	123 Å²	123	131.2 Å²	131.2	66%	0.658	68%	0.683	S	S	*	*			trans	-58.6	104.4	-177.9	-71.5	-27.7	0	0	0	110.3	D159 T160 F161	D157-D159 PolarHBondContact O-N 2.66Å; D157-T160 HydrophobicContact CB-CG2 4.06Å; D157-T160 PolarHBondContact O-N 2.66Å; D157-T160 PolarHBondContact O-OG1 3.26Å; D157-F161 WeakPolarHBondContact O-CD2 3.4Å; D157-F161 WeakPolarHBondContact O-CE2 3.29Å
158	L	83.2	Confident	85.6	Confident	125 Å²	125	129 Å²	129	65%	0.654	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-58.6	-23.7	-174.6	-68.2	177.2	0	0	0	112.8	P156 T160 F161	P156-L158 PolarHBondContact O-N 3.31Å; L158-T160 VanDerWaalsContact C-N 3.26Å; L158-T160 PolarHBondContact O-N 3.45Å; L158-F161 HydrophobicContact CD2-CD2 4.4Å; L158-F161 HydrophobicContact CD2-CE2 4.41Å; L158-F161 PolarHBondContact O-N 3.49Å
159	D	82.9	Confident	86.2	Confident	163 Å²	163	127.8 Å²	127.8	87%	0.872	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-71.5	-18.8	178.7	-61.4	-25	0	0	0	113.4	D157	D157-D159 PolarHBondContact O-N 2.66Å
160	T	84.2	Confident	86.5	Confident	110 Å²	110	129.3 Å²	129.3	68%	0.675	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-84.4	-16	176.9	62.9	0	0	0	0	113.1	D157 L158	D157-T160 HydrophobicContact CB-CG2 4.06Å; D157-T160 PolarHBondContact O-N 2.66Å; D157-T160 PolarHBondContact O-OG1 3.26Å; L158-T160 VanDerWaalsContact C-N 3.26Å; L158-T160 PolarHBondContact O-N 3.45Å
161	F	82.8	Confident	86.8	Confident	115 Å²	115	125.1 Å²	125.1	50%	0.504	62%	0.622	S	S	.	*	S	Bend	trans	-80	139.8	179	-65.5	-91.9	0	0	0	110.4	P156 D157 L158 V163	P156-F161 HydrophobicContact CB-CE2 3.69Å; P156-F161 HydrophobicContact CB-CZ 3.65Å; P156-F161 HydrophobicContact CG-CE2 3.86Å; P156-F161 HydrophobicContact CG-CZ 3.66Å; D157-F161 WeakPolarHBondContact O-CD2 3.4Å; D157-F161 WeakPolarHBondContact O-CE2 3.29Å; L158-F161 HydrophobicContact CD2-CD2 4.4Å; L158-F161 HydrophobicContact CD2-CE2 4.41Å; L158-F161 PolarHBondContact O-N 3.49Å; F161-V163 PolarHBondContact O-N 3.25Å
162	D	83.4	Confident	86.9	Confident	145 Å²	145	122.6 Å²	122.6	78%	0.775	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-57	127.5	171.6	-82.6	-45	0	0	0	110.4	P164	D162-P164 WeakPolarHBondContact O-CD 3.33Å; D162-P164 VanDerWaalsContact O-N 3.17Å
163	V	84.2	Confident	87	Confident	64 Å²	64	119.6 Å²	119.6	39%	0.388	60%	0.601	S	S	.	*	P	Polyproline II helix	trans	-55.1	123.7	174.8	-178.1	0	0	0	0	108.8	F161 L167 K168	F161-V163 PolarHBondContact O-N 3.25Å; V163-L167 HydrophobicContact CG1-CB 3.5Å; V163-L167 HydrophobicContact CG1-CD1 4.3Å; V163-K168 HydrophobicContact CB-CG 4.16Å; V163-K168 HydrophobicContact CG1-CG 4.02Å; V163-K168 WeakPolarHBondContact O-CE 3.23Å; V163-K168 PolarHBondContact O-NZ 3.34Å
164	P	88	Confident	87.1	Confident	76 Å²	76	118.1 Å²	118.1	49%	0.494	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-51.3	142.1	178.8	-27.5	30.2	0	0	0	112.3	D162 R166 L167 K168	D162-P164 WeakPolarHBondContact O-CD 3.33Å; D162-P164 VanDerWaalsContact O-N 3.17Å; P164-R166 PolarHBondContact O-N 2.81Å; P164-L167 HydrophobicContact CB-CD1 4.49Å; P164-L167 HydrophobicContact CG-CD1 4.03Å; P164-L167 WeakPolarHBondContact O-CA 3.28Å; P164-L167 WeakPolarHBondContact O-CB 3.26Å; P164-L167 PolarHBondContact O-N 3.36Å; P164-K168 PolarHBondContact O-N 3.38Å
165	E	87.2	Confident	87.3	Confident	170 Å²	170	119.7 Å²	119.7	79%	0.794	59%	0.591	S	S	*	*	H	α-helix	trans	-54	-33.2	-180	-68.7	-175.2	165.8	0	0	113.2	L167 K168 H169	E165-L167 VanDerWaalsContact C-N 3.35Å; E165-L167 PolarHBondContact O-N 3.09Å; E165-K168 PolarHBondContact O-N 3.46Å; E165-H169 VanDerWaalsContact O-CB 3.29Å; E165-H169 WeakPolarHBondContact O-CB 3.49Å; E165-H169 PolarHBondContact O-N 2.73Å
166	R	89.8	Confident	87.5	Confident	225 Å²	225	119.7 Å²	119.7	85%	0.849	59%	0.591	S	S	*	*	H	α-helix	trans	-62.8	-39.3	174.7	-70.4	-174.8	-179	176.6	1	112.8	P164 R170	P164-R166 PolarHBondContact O-N 2.81Å; R166-R170 WeakPolarHBondContact O-CB 3.44Å; R166-R170 PolarHBondContact O-N 2.98Å
167	L	87.3	Confident	87.6	Confident	70 Å²	70	123 Å²	123	37%	0.366	60%	0.603	S	S	.	*	H	α-helix	trans	-71.4	-44.8	176.5	-79.7	170.2	0	0	0	110.1	V163 P164 E165 H169 R170 E171	V163-L167 HydrophobicContact CG1-CB 3.5Å; V163-L167 HydrophobicContact CG1-CD1 4.3Å; P164-L167 HydrophobicContact CB-CD1 4.49Å; P164-L167 HydrophobicContact CG-CD1 4.03Å; P164-L167 WeakPolarHBondContact O-CA 3.28Å; P164-L167 WeakPolarHBondContact O-CB 3.26Å; P164-L167 PolarHBondContact O-N 3.36Å; E165-L167 VanDerWaalsContact C-N 3.35Å; E165-L167 PolarHBondContact O-N 3.09Å; L167-H169 VanDerWaalsContact C-N 3.3Å; L167-H169 PolarHBondContact O-N 3.41Å; L167-R170 PolarHBondContact O-N 2.85Å; L167-R170 VanDerWaalsContact O-N 3.08Å; L167-E171 WeakPolarHBondContact O-CG 3.43Å; L167-E171 PolarHBondContact O-N 3Å
168	K	88.2	Confident	87.3	Confident	90 Å²	90	125 Å²	125	39%	0.391	62%	0.621	S	S	.	*	H	α-helix	trans	-56.7	-41.2	172.4	-67	177.8	175.4	165	0	112.4	V163 P164 E165 K172	V163-K168 HydrophobicContact CB-CG 4.16Å; V163-K168 HydrophobicContact CG1-CG 4.02Å; V163-K168 WeakPolarHBondContact O-CE 3.23Å; V163-K168 PolarHBondContact O-NZ 3.34Å; P164-K168 PolarHBondContact O-N 3.38Å; E165-K168 PolarHBondContact O-N 3.46Å; K168-K172 WeakPolarHBondContact O-CG 3.37Å; K168-K172 PolarHBondContact O-N 3.09Å; K168-K172 VanDerWaalsContact O-N 3.09Å
169	H	89.2	Confident	87.5	Confident	120 Å²	120	125.1 Å²	125.1	56%	0.556	62%	0.619	S	S	*	*	H	α-helix	trans	-68.1	-38.3	176.7	-175.2	-88.1	0	0	0	112	E165 L167 L173	E165-H169 VanDerWaalsContact O-CB 3.29Å; E165-H169 WeakPolarHBondContact O-CB 3.49Å; E165-H169 PolarHBondContact O-N 2.73Å; L167-H169 VanDerWaalsContact C-N 3.3Å; L167-H169 PolarHBondContact O-N 3.41Å; H169-L173 VanDerWaalsContact CE1-CD1 3.44Å; H169-L173 WeakPolarHBondContact CE1-CD1 3.44Å; H169-L173 WeakPolarHBondContact O-CG 3.4Å; H169-L173 PolarHBondContact O-N 2.8Å
170	R	90.1	Very high	87.8	Confident	154 Å²	154	123.1 Å²	123.1	58%	0.581	61%	0.606	S	S	*	*	H	α-helix	trans	-68.9	-39.1	176.8	-165	175.4	75.7	141.3	2.6	112.1	R166 L167 L173 N174	R166-R170 WeakPolarHBondContact O-CB 3.44Å; R166-R170 PolarHBondContact O-N 2.98Å; L167-R170 PolarHBondContact O-N 2.85Å; L167-R170 VanDerWaalsContact O-N 3.08Å; R170-L173 PolarHBondContact O-N 3.33Å; R170-N174 WeakPolarHBondContact O-CB 3.45Å; R170-N174 PolarHBondContact O-N 3.04Å; R170-N174 PolarHBondContact O-ND2 3.24Å; R170-N174 PolarHBondContact O-OD1 3.16Å
171	E	89.6	Confident	88	Confident	100 Å²	100	123.8 Å²	123.8	47%	0.467	60%	0.602	S	S	.	*	H	α-helix	trans	-60.2	-49.7	172.9	-74.2	167.7	178.6	0	0	110.8	L167 L173 N174 E175	L167-E171 WeakPolarHBondContact O-CG 3.43Å; L167-E171 PolarHBondContact O-N 3Å; E171-L173 PolarHBondContact O-N 3.08Å; E171-N174 PolarHBondContact O-N 3.49Å; E171-N174 VanDerWaalsContact O-N 3.13Å; E171-E175 WeakPolarHBondContact O-CG 3.1Å; E171-E175 PolarHBondContact O-N 3.43Å
172	K	90.4	Very high	88.3	Confident	138 Å²	138	124.3 Å²	124.3	60%	0.6	61%	0.608	S	S	*	*	H	α-helix	trans	-58.7	-42.5	175	-73.4	179.2	-179.3	-176.8	0	113.4	K168 N174 E175 L176	K168-K172 WeakPolarHBondContact O-CG 3.37Å; K168-K172 PolarHBondContact O-N 3.09Å; K168-K172 VanDerWaalsContact O-N 3.09Å; K172-N174 VanDerWaalsContact C-N 3.33Å; K172-E175 PolarHBondContact O-N 3.46Å; K172-L176 WeakPolarHBondContact O-CB 3.34Å; K172-L176 VanDerWaalsContact O-CG 3.23Å; K172-L176 WeakPolarHBondContact O-CG 3.5Å; K172-L176 PolarHBondContact O-N 3.4Å
173	L	90.4	Very high	88.6	Confident	82 Å²	82	123 Å²	123	43%	0.429	60%	0.597	S	S	.	*	H	α-helix	trans	-64.8	-38.4	176.3	-78.3	177.7	0	0	0	112.1	H169 R170 E171 L176 L177	H169-L173 VanDerWaalsContact CE1-CD1 3.44Å; H169-L173 WeakPolarHBondContact CE1-CD1 3.44Å; H169-L173 WeakPolarHBondContact O-CG 3.4Å; H169-L173 PolarHBondContact O-N 2.8Å; R170-L173 PolarHBondContact O-N 3.33Å; E171-L173 PolarHBondContact O-N 3.08Å; L173-L176 PolarHBondContact O-N 3.39Å; L173-L177 WeakPolarHBondContact O-CB 3.35Å; L173-L177 VanDerWaalsContact O-CG 3.26Å; L173-L177 WeakPolarHBondContact O-CG 3.29Å; L173-L177 PolarHBondContact O-N 3.05Å; L173-L177 VanDerWaalsContact O-N 3.13Å
174	N	91	Very high	88.9	Confident	84 Å²	84	126.9 Å²	126.9	45%	0.449	61%	0.611	S	S	.	*	H	α-helix	trans	-68.8	-41.2	177.6	-71.9	-10.8	0	0	0	111.6	R170 E171 K172 L176 L177 T178	R170-N174 WeakPolarHBondContact O-CB 3.45Å; R170-N174 PolarHBondContact O-N 3.04Å; R170-N174 PolarHBondContact O-ND2 3.24Å; R170-N174 PolarHBondContact O-OD1 3.16Å; E171-N174 PolarHBondContact O-N 3.49Å; E171-N174 VanDerWaalsContact O-N 3.13Å; K172-N174 VanDerWaalsContact C-N 3.33Å; N174-L176 VanDerWaalsContact C-N 3.25Å; N174-L176 PolarHBondContact O-N 2.85Å; N174-L177 PolarHBondContact O-N 3.05Å; N174-L177 VanDerWaalsContact O-N 3.12Å; N174-T178 PolarHBondContact O-N 3.07Å; N174-T178 VanDerWaalsContact O-N 3.16Å; N174-T178 PolarHBondContact O-OG1 3.42Å
175	E	92.2	Very high	89	Confident	139 Å²	139	130.6 Å²	130.6	65%	0.65	62%	0.619	S	S	*	*	H	α-helix	trans	-62.2	-31.3	173.5	-73.2	176.7	172	0	0	112.7	E171 K172 T178	E171-E175 WeakPolarHBondContact O-CG 3.1Å; E171-E175 PolarHBondContact O-N 3.43Å; K172-E175 PolarHBondContact O-N 3.46Å; E175-T178 PolarHBondContact O-OG1 3.37Å
176	L	90.7	Very high	89.1	Confident	142 Å²	142	127.5 Å²	127.5	74%	0.743	61%	0.606	S	S	*	*	H	α-helix	trans	-79	-18.9	174.8	-71.1	169.5	0	0	0	113.6	K172 L173 N174	K172-L176 WeakPolarHBondContact O-CB 3.34Å; K172-L176 VanDerWaalsContact O-CG 3.23Å; K172-L176 WeakPolarHBondContact O-CG 3.5Å; K172-L176 PolarHBondContact O-N 3.4Å; L173-L176 PolarHBondContact O-N 3.39Å; N174-L176 VanDerWaalsContact C-N 3.25Å; N174-L176 PolarHBondContact O-N 2.85Å
177	L	89.3	Confident	89	Confident	147 Å²	147	119.4 Å²	119.4	77%	0.77	59%	0.586	S	S	*	*	H	α-helix	trans	-93.4	-17.1	-179.7	-76.8	169.4	0	0	0	113.2	L173 N174	L173-L177 WeakPolarHBondContact O-CB 3.35Å; L173-L177 VanDerWaalsContact O-CG 3.26Å; L173-L177 WeakPolarHBondContact O-CG 3.29Å; L173-L177 PolarHBondContact O-N 3.05Å; L173-L177 VanDerWaalsContact O-N 3.13Å; N174-L177 PolarHBondContact O-N 3.05Å; N174-L177 VanDerWaalsContact O-N 3.12Å
178	T	80.1	Confident	89.2	Confident	167 Å²	167	123.9 Å²	123.9	100%	1.025	61%	0.606	S	S	*	*			trans	-90.6	0	173.6	50.1	0	0	0	0	112	N174 E175	N174-T178 PolarHBondContact O-N 3.07Å; N174-T178 VanDerWaalsContact O-N 3.16Å; N174-T178 PolarHBondContact O-OG1 3.42Å; E175-T178 PolarHBondContact O-OG1 3.37Å

Retrieved 178 of 178 residues in 36 ms (Link to these results)

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