A0A087XWU3_POEFO Loading...

THO complex 7

Component of the THO subcomplex of the TREX complex which is thought to couple mRNA transcription, processing and nuclear export, and which specifically associates with spliced mRNA and not with unspliced pre-mRNA. Required for efficient export of polyadenylated RNA. Plays a key structural role in the oligomerization of the THO-DDX39B complex. TREX is recruited to spliced mRNAs by a transcription-independent mechanism, binds to mRNA upstream of the exon-junction complex (EJC) and is recruited in a splicing- and cap-dependent manner to a region near the 5' end of the mRNA where it functions in mRNA export to the cytoplasm via the TAP/NXF1 pathway.

AlphaFold DB , UniProt , Accession A0A087XWU3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 203 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	43.7	Very low	70	Confident	245 Å²	245	111.3 Å²	111.3	100%	1.207	63%	0.632	S	S	*	*				0	110.4	0	-64.9	-167.7	-152.5	0	0	106.6
2	G	49.6	Very low	70	Confident	76 Å²	76	111.8 Å²	111.8	78%	0.784	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-67.1	135.1	179.8	0	0	0	0	0	110	V4	G2-V4 PolarHBondContact O-N 2.76Å
3	A	55.9	Low	70.1	Confident	95 Å²	95	115.9 Å²	115.9	79%	0.785	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-61.1	118.6	175.7	0	0	0	0	0	108.6	T5	A3-T5 PolarHBondContact O-N 3.48Å
4	V	66.9	Low	70	Confident	76 Å²	76	116.1 Å²	116.1	46%	0.461	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-59.4	119.3	172.6	-179	0	0	0	0	106.6	G2 E8 V9	G2-V4 PolarHBondContact O-N 2.76Å; V4-E8 HydrophobicContact CG1-CB 3.63Å; V4-V9 HydrophobicContact CB-CG2 4.48Å; V4-V9 HydrophobicContact CG1-CG2 3.59Å
5	T	81.6	Confident	69.7	Low	79 Å²	79	116.8 Å²	116.8	49%	0.485	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-72.1	151.5	178.9	55.7	0	0	0	0	109.7	A3 D7 E8 V9	A3-T5 PolarHBondContact O-N 3.48Å; T5-D7 PolarHBondContact O-N 3.34Å; T5-D7 VanDerWaalsContact O-N 3.12Å; T5-E8 WeakPolarHBondContact O-CA 3.42Å; T5-E8 WeakPolarHBondContact O-CB 3.26Å; T5-E8 PolarHBondContact O-N 3.48Å; T5-V9 PolarHBondContact O-N 3.32Å; T5-V9 VanDerWaalsContact O-N 3.14Å
6	D	78.6	Confident	69.3	Low	131 Å²	131	116.9 Å²	116.9	70%	0.701	62%	0.623	S	S	*	*	H	α-helix	trans	-54.4	-34.3	179.6	-79.9	-11.6	0	0	0	112	E8 V9 I10	D6-E8 VanDerWaalsContact C-N 3.35Å; D6-E8 PolarHBondContact O-N 3.42Å; D6-V9 PolarHBondContact O-N 2.97Å; D6-I10 WeakPolarHBondContact O-CB 3.35Å; D6-I10 VanDerWaalsContact O-CG1 3.24Å; D6-I10 WeakPolarHBondContact O-CG1 3.44Å; D6-I10 PolarHBondContact O-N 2.85Å
7	D	78.9	Confident	68.6	Low	114 Å²	114	116.4 Å²	116.4	61%	0.61	62%	0.62	S	S	*	*	H	α-helix	trans	-60.8	-38.3	172.6	-80.5	-4.7	0	0	0	113.3	T5 R11	T5-D7 PolarHBondContact O-N 3.34Å; T5-D7 VanDerWaalsContact O-N 3.12Å; D7-R11 WeakPolarHBondContact O-CB 3.48Å; D7-R11 PolarHBondContact O-N 3.39Å
8	E	80.3	Confident	67.8	Low	82 Å²	82	112.4 Å²	112.4	38%	0.383	61%	0.612	S	S	.	*	H	α-helix	trans	-69.6	-35.9	174.9	-78.3	-172	160.3	0	0	111.8	V4 T5 D6 K12	V4-E8 HydrophobicContact CG1-CB 3.63Å; T5-E8 WeakPolarHBondContact O-CA 3.42Å; T5-E8 WeakPolarHBondContact O-CB 3.26Å; T5-E8 PolarHBondContact O-N 3.48Å; D6-E8 VanDerWaalsContact C-N 3.35Å; D6-E8 PolarHBondContact O-N 3.42Å; E8-K12 WeakPolarHBondContact O-CB 3.27Å; E8-K12 VanDerWaalsContact O-CG 3.29Å; E8-K12 WeakPolarHBondContact O-CG 3.49Å; E8-K12 PolarHBondContact O-N 3.11Å
9	V	80.4	Confident	67.2	Low	76 Å²	76	109.9 Å²	109.9	46%	0.461	60%	0.598	S	S	.	*	H	α-helix	trans	-66.3	-46.3	175.2	-178.8	0	0	0	0	110.2	V4 T5 D6 K12 R13	V4-V9 HydrophobicContact CB-CG2 4.48Å; V4-V9 HydrophobicContact CG1-CG2 3.59Å; T5-V9 PolarHBondContact O-N 3.32Å; T5-V9 VanDerWaalsContact O-N 3.14Å; D6-V9 PolarHBondContact O-N 2.97Å; V9-K12 PolarHBondContact O-N 3.26Å; V9-R13 WeakPolarHBondContact O-CB 3.49Å; V9-R13 PolarHBondContact O-N 3.46Å
10	I	77.4	Confident	66.6	Low	95 Å²	95	106.5 Å²	106.5	49%	0.487	59%	0.59	S	S	.	*	H	α-helix	trans	-63.7	-45	178.6	-67.6	164.5	0	0	0	110.4	D6 K12 R13 L14	D6-I10 WeakPolarHBondContact O-CB 3.35Å; D6-I10 VanDerWaalsContact O-CG1 3.24Å; D6-I10 WeakPolarHBondContact O-CG1 3.44Å; D6-I10 PolarHBondContact O-N 2.85Å; I10-K12 PolarHBondContact O-N 3.37Å; I10-R13 WeakPolarHBondContact O-CB 3.47Å; I10-R13 PolarHBondContact O-N 3.36Å; I10-L14 HydrophobicContact CG2-CD1 3.89Å; I10-L14 WeakPolarHBondContact O-CB 3.31Å; I10-L14 WeakPolarHBondContact O-CG 3.47Å; I10-L14 PolarHBondContact O-N 3.49Å
11	R	76.2	Confident	66.1	Low	155 Å²	155	104.8 Å²	104.8	59%	0.585	59%	0.589	S	S	*	*	H	α-helix	trans	-60.8	-45.9	176.7	-169.3	-173.3	-63.4	157.5	1.1	111.6	D7 L14 L15	D7-R11 WeakPolarHBondContact O-CB 3.48Å; D7-R11 PolarHBondContact O-N 3.39Å; R11-L14 PolarHBondContact O-N 3.25Å; R11-L15 HydrophobicContact CG-CD1 4.1Å; R11-L15 WeakPolarHBondContact O-CB 3.43Å; R11-L15 WeakPolarHBondContact O-CD1 3.36Å; R11-L15 PolarHBondContact O-N 2.91Å
12	K	70.9	Confident	67.3	Low	117 Å²	117	94.7 Å²	94.7	51%	0.509	55%	0.548	S	S	.	.	H	α-helix	trans	-63.7	-39.8	176.1	-77.4	177.4	-179.2	171.9	0	112.1	E8 V9 I10 L15 I16	E8-K12 WeakPolarHBondContact O-CB 3.27Å; E8-K12 VanDerWaalsContact O-CG 3.29Å; E8-K12 WeakPolarHBondContact O-CG 3.49Å; E8-K12 PolarHBondContact O-N 3.11Å; V9-K12 PolarHBondContact O-N 3.26Å; I10-K12 PolarHBondContact O-N 3.37Å; K12-L15 PolarHBondContact O-N 3.18Å; K12-I16 WeakPolarHBondContact O-CD1 3.42Å; K12-I16 VanDerWaalsContact O-CG1 3.23Å; K12-I16 WeakPolarHBondContact O-CG1 3.3Å; K12-I16 PolarHBondContact O-N 3.25Å
13	R	70.7	Confident	68.6	Low	166 Å²	166	92.5 Å²	92.5	63%	0.626	52%	0.518	S	S	*	.	H	α-helix	trans	-61.9	-47.2	176.1	-167.8	81	-175	-140.9	-2.3	111.2	V9 I10 L15 I16 D17	V9-R13 WeakPolarHBondContact O-CB 3.49Å; V9-R13 PolarHBondContact O-N 3.46Å; I10-R13 WeakPolarHBondContact O-CB 3.47Å; I10-R13 PolarHBondContact O-N 3.36Å; R13-L15 VanDerWaalsContact C-N 3.33Å; R13-L15 PolarHBondContact O-N 3.39Å; R13-I16 PolarHBondContact O-N 3.15Å; R13-D17 WeakPolarHBondContact CG-OD2 3.35Å; R13-D17 IonicContact CZ-OD2 3.82Å; R13-D17 IonicContact NE-OD2 2.88Å; R13-D17 PolarHBondContact NE-OD2 3.14Å; R13-D17 IonicContact NH2-OD2 3.89Å; R13-D17 WeakPolarHBondContact O-CB 3.47Å; R13-D17 PolarHBondContact O-N 2.91Å
14	L	68.8	Low	69.8	Low	119 Å²	119	92.8 Å²	92.8	62%	0.623	51%	0.507	S	S	*	.	H	α-helix	trans	-63.6	-35.3	177.3	-75	165.5	0	0	0	112.8	I10 R11 G18	I10-L14 HydrophobicContact CG2-CD1 3.89Å; I10-L14 WeakPolarHBondContact O-CB 3.31Å; I10-L14 WeakPolarHBondContact O-CG 3.47Å; I10-L14 PolarHBondContact O-N 3.49Å; R11-L14 PolarHBondContact O-N 3.25Å; L14-G18 VanDerWaalsContact O-CA 3.25Å; L14-G18 WeakPolarHBondContact O-CA 3.37Å; L14-G18 PolarHBondContact O-N 2.98Å
15	L	65.4	Low	70.6	Confident	126 Å²	126	97.6 Å²	97.6	66%	0.66	52%	0.516	S	S	*	.	H	α-helix	trans	-70.2	-30.9	174.9	-87.1	153.1	0	0	0	113.4	R11 K12 R13	R11-L15 HydrophobicContact CG-CD1 4.1Å; R11-L15 WeakPolarHBondContact O-CB 3.43Å; R11-L15 WeakPolarHBondContact O-CD1 3.36Å; R11-L15 PolarHBondContact O-N 2.91Å; K12-L15 PolarHBondContact O-N 3.18Å; R13-L15 VanDerWaalsContact C-N 3.33Å; R13-L15 PolarHBondContact O-N 3.39Å
16	I	64.1	Low	70.8	Confident	119 Å²	119	97.5 Å²	97.5	61%	0.61	51%	0.507	S	S	*	.	H	α-helix	trans	-84.7	-41.9	179.4	-66.7	166.2	0	0	0	111	K12 R13	K12-I16 WeakPolarHBondContact O-CD1 3.42Å; K12-I16 VanDerWaalsContact O-CG1 3.23Å; K12-I16 WeakPolarHBondContact O-CG1 3.3Å; K12-I16 PolarHBondContact O-N 3.25Å; R13-I16 PolarHBondContact O-N 3.15Å
17	D	56.7	Low	71.3	Confident	107 Å²	107	95.7 Å²	95.7	57%	0.572	50%	0.496	S	S	*	.	H	α-helix	trans	-88.5	-17.5	-176.5	-69.8	-23.4	0	0	0	112.8	R13 D19	R13-D17 WeakPolarHBondContact CG-OD2 3.35Å; R13-D17 IonicContact CZ-OD2 3.82Å; R13-D17 IonicContact NE-OD2 2.88Å; R13-D17 PolarHBondContact NE-OD2 3.14Å; R13-D17 IonicContact NH2-OD2 3.89Å; R13-D17 WeakPolarHBondContact O-CB 3.47Å; R13-D17 PolarHBondContact O-N 2.91Å; D17-D19 PolarHBondContact O-N 3.5Å
18	G	54.6	Low	71.8	Confident	46 Å²	46	93.4 Å²	93.4	47%	0.474	48%	0.484	S	S	.	.	S	Bend	trans	-89.5	87.8	-178.5	0	0	0	0	0	113.1	L14 G20	L14-G18 VanDerWaalsContact O-CA 3.25Å; L14-G18 WeakPolarHBondContact O-CA 3.37Å; L14-G18 PolarHBondContact O-N 2.98Å; G18-G20 PolarHBondContact O-N 2.85Å
19	D	55.4	Low	72.2	Confident	65 Å²	65	93.7 Å²	93.7	35%	0.348	49%	0.488	S	S	.	.	S	Bend	trans	53.6	-16.9	166.3	-122	-16.8	0	0	0	118.1	D17 A21 G22 D23 K67	D17-D19 PolarHBondContact O-N 3.5Å; D19-A21 PolarHBondContact O-N 3.16Å; D19-G22 PolarHBondContact O-N 2.85Å; D19-D23 PolarHBondContact O-N 2.9Å; D19-K67 IonicContact OD2-NZ 2.88Å; D19-K67 PolarHBondContact OD2-NZ 3.32Å
20	G	56.6	Low	72.8	Confident	41 Å²	41	91.6 Å²	91.6	42%	0.423	47%	0.474	S	S	.	.	H	α-helix	trans	-77.5	-26.2	-166.8	0	0	0	0	0	115.3	G18 G22	G18-G20 PolarHBondContact O-N 2.85Å; G20-G22 VanDerWaalsContact C-N 3.34Å
21	A	56.4	Low	73.5	Confident	71 Å²	71	91.9 Å²	91.9	59%	0.587	48%	0.476	S	S	*	.	H	α-helix	trans	-77.7	-22.9	172.5	0	0	0	0	0	112.5	D19 R25	D19-A21 PolarHBondContact O-N 3.16Å; A21-R25 VanDerWaalsContact O-CB 3.24Å; A21-R25 WeakPolarHBondContact O-CB 3.47Å; A21-R25 PolarHBondContact O-N 2.7Å
22	G	68.9	Low	74.2	Confident	32 Å²	32	91.4 Å²	91.4	33%	0.33	48%	0.478	S	S	.	.	H	α-helix	trans	-76.3	-43.5	179	0	0	0	0	0	112.1	D19 G20 R26	D19-G22 PolarHBondContact O-N 2.85Å; G20-G22 VanDerWaalsContact C-N 3.34Å; G22-R26 WeakPolarHBondContact O-CB 3.48Å; G22-R26 WeakPolarHBondContact O-CG 3.43Å; G22-R26 PolarHBondContact O-N 3.35Å
23	D	76.6	Confident	75.2	Confident	30 Å²	30	88.5 Å²	88.5	16%	0.16	47%	0.473	C	S	.	.	H	α-helix	trans	-72.4	-45.8	-177.9	-77.7	-18.3	0	0	0	113.5	D19 R25 R26 I27 S64	D19-D23 PolarHBondContact O-N 2.9Å; D23-R25 VanDerWaalsContact C-N 3.26Å; D23-R25 PolarHBondContact O-N 2.83Å; D23-R26 WeakPolarHBondContact O-CB 3.48Å; D23-R26 PolarHBondContact O-N 2.87Å; D23-R26 VanDerWaalsContact O-N 3.07Å; D23-R26 IonicContact OD1-CZ 3.14Å; D23-R26 IonicContact OD1-NE 3.04Å; D23-R26 PolarHBondContact OD1-NE 2.82Å; D23-R26 IonicContact OD1-NH2 2.6Å; D23-R26 PolarHBondContact OD1-NH2 3.14Å; D23-I27 WeakPolarHBondContact O-CG1 3.41Å; D23-I27 PolarHBondContact O-N 3.37Å; D23-S64 VanDerWaalsContact CG-OG 3.27Å; D23-S64 PolarHBondContact OD1-OG 3.47Å; D23-S64 VanDerWaalsContact OD1-OG 3.11Å; D23-S64 WeakPolarHBondContact OD2-CB 3.32Å; D23-S64 PolarHBondContact OD2-OG 3.26Å
24	D	81	Confident	76.3	Confident	102 Å²	102	85.6 Å²	85.6	55%	0.545	47%	0.465	S	S	.	.	H	α-helix	trans	-58.9	-41.2	174.4	-179.2	67	0	0	0	111.2	R26 I27 N28	D24-R26 PolarHBondContact O-N 3.31Å; D24-I27 PolarHBondContact O-N 2.83Å; D24-N28 VanDerWaalsContact O-CB 3.3Å; D24-N28 WeakPolarHBondContact O-CB 3.43Å; D24-N28 PolarHBondContact O-N 3.24Å; D24-N28 PolarHBondContact O-ND2 3.38Å; D24-N28 PolarHBondContact OD1-ND2 3.49Å; D24-N28 PolarHBondContact OD2-ND2 3.04Å; D24-N28 VanDerWaalsContact OD2-ND2 3.09Å
25	R	83.6	Confident	77.4	Confident	177 Å²	177	83 Å²	83	67%	0.668	45%	0.454	S	S	*	.	H	α-helix	trans	-62.5	-43.1	173.8	-178	178.8	175.7	-176	-1	112.1	A21 D23 N28 L29	A21-R25 VanDerWaalsContact O-CB 3.24Å; A21-R25 WeakPolarHBondContact O-CB 3.47Å; A21-R25 PolarHBondContact O-N 2.7Å; D23-R25 VanDerWaalsContact C-N 3.26Å; D23-R25 PolarHBondContact O-N 2.83Å; R25-N28 PolarHBondContact O-N 3.46Å; R25-L29 HydrophobicContact CG-CD1 4.14Å; R25-L29 WeakPolarHBondContact O-CB 3.27Å; R25-L29 VanDerWaalsContact O-CG 3.24Å; R25-L29 WeakPolarHBondContact O-CG 3.38Å; R25-L29 PolarHBondContact O-N 3.14Å
26	R	85.8	Confident	78.5	Confident	76 Å²	76	84 Å²	84	29%	0.287	45%	0.453	S	S	.	.	H	α-helix	trans	-63.2	-45.6	178	-82.7	-171.8	-79.7	-149.1	-5.1	111.8	G22 D23 D24 L29 L30 S64	G22-R26 WeakPolarHBondContact O-CB 3.48Å; G22-R26 WeakPolarHBondContact O-CG 3.43Å; G22-R26 PolarHBondContact O-N 3.35Å; D23-R26 WeakPolarHBondContact O-CB 3.48Å; D23-R26 PolarHBondContact O-N 2.87Å; D23-R26 VanDerWaalsContact O-N 3.07Å; D23-R26 IonicContact OD1-CZ 3.14Å; D23-R26 IonicContact OD1-NE 3.04Å; D23-R26 PolarHBondContact OD1-NE 2.82Å; D23-R26 IonicContact OD1-NH2 2.6Å; D23-R26 PolarHBondContact OD1-NH2 3.14Å; D24-R26 PolarHBondContact O-N 3.31Å; R26-L29 PolarHBondContact O-N 3.36Å; R26-L30 PolarHBondContact O-N 2.94Å; R26-S64 PolarHBondContact NH2-OG 3.06Å
27	I	88.6	Confident	79.7	Confident	93 Å²	93	82.5 Å²	82.5	48%	0.477	44%	0.44	S	S	.	.	H	α-helix	trans	-63.3	-44.7	178	-66.7	167.8	0	0	0	110.4	D23 D24 L29 L30 L31	D23-I27 WeakPolarHBondContact O-CG1 3.41Å; D23-I27 PolarHBondContact O-N 3.37Å; D24-I27 PolarHBondContact O-N 2.83Å; I27-L29 VanDerWaalsContact C-N 3.31Å; I27-L29 PolarHBondContact O-N 2.84Å; I27-L30 PolarHBondContact O-N 3.26Å; I27-L31 PolarHBondContact O-N 3.45Å
28	N	89.1	Confident	81.3	Confident	67 Å²	67	80.8 Å²	80.8	36%	0.358	44%	0.435	S	S	.	.	H	α-helix	trans	-61.7	-36.7	175.4	-82.5	-57.6	0	0	0	112.8	D24 R25 K32	D24-N28 VanDerWaalsContact O-CB 3.3Å; D24-N28 WeakPolarHBondContact O-CB 3.43Å; D24-N28 PolarHBondContact O-N 3.24Å; D24-N28 PolarHBondContact O-ND2 3.38Å; D24-N28 PolarHBondContact OD1-ND2 3.49Å; D24-N28 PolarHBondContact OD2-ND2 3.04Å; D24-N28 VanDerWaalsContact OD2-ND2 3.09Å; R25-N28 PolarHBondContact O-N 3.46Å; N28-K32 WeakPolarHBondContact O-CG 3.47Å; N28-K32 PolarHBondContact O-N 2.85Å
29	L	88.9	Confident	82.8	Confident	88 Å²	88	85.8 Å²	85.8	46%	0.461	45%	0.446	S	S	.	.	H	α-helix	trans	-69.1	-39.8	174.8	-75.2	169.9	0	0	0	112.3	R25 R26 I27 K32 S33	R25-L29 HydrophobicContact CG-CD1 4.14Å; R25-L29 WeakPolarHBondContact O-CB 3.27Å; R25-L29 VanDerWaalsContact O-CG 3.24Å; R25-L29 WeakPolarHBondContact O-CG 3.38Å; R25-L29 PolarHBondContact O-N 3.14Å; R26-L29 PolarHBondContact O-N 3.36Å; I27-L29 VanDerWaalsContact C-N 3.31Å; I27-L29 PolarHBondContact O-N 2.84Å; L29-K32 PolarHBondContact O-N 3.3Å; L29-S33 WeakPolarHBondContact O-CB 3.44Å; L29-S33 PolarHBondContact O-N 2.71Å; L29-S33 PolarHBondContact O-OG 3.5Å
30	L	92.6	Very high	83.9	Confident	32 Å²	32	85.1 Å²	85.1	17%	0.168	45%	0.446	C	S	.	.	H	α-helix	trans	-61.1	-46.6	173.5	173.9	58.4	0	0	0	110.6	R26 I27 K32 S33 F34 M54 T57 L58	R26-L30 PolarHBondContact O-N 2.94Å; I27-L30 PolarHBondContact O-N 3.26Å; L30-K32 PolarHBondContact O-N 3.42Å; L30-S33 PolarHBondContact O-N 2.94Å; L30-F34 WeakPolarHBondContact O-CB 3.44Å; L30-F34 PolarHBondContact O-N 2.92Å; L30-M54 HydrophobicContact CD1-CB 3.81Å; L30-M54 HydrophobicContact CD1-CG 3.99Å; L30-M54 HydrophobicContact CD1-SD 4.5Å; L30-T57 WeakPolarHBondContact CD1-OG1 3.28Å; L30-L58 HydrophobicContact CD2-CB 4.28Å; L30-L58 HydrophobicContact CD2-CD1 4.17Å
31	L	92.6	Very high	84.5	Confident	100 Å²	100	89.7 Å²	89.7	52%	0.524	47%	0.468	S	S	.	.	H	α-helix	trans	-60.1	-44.5	177.7	-179.4	63.1	0	0	0	112.5	I27 F34 T35	I27-L31 PolarHBondContact O-N 3.45Å; L31-F34 PolarHBondContact O-N 3.26Å; L31-T35 WeakPolarHBondContact O-CB 3.46Å; L31-T35 PolarHBondContact O-N 2.91Å; L31-T35 PolarHBondContact O-OG1 2.93Å
32	K	91.8	Very high	85.2	Confident	146 Å²	146	88 Å²	88	64%	0.635	46%	0.458	S	S	*	.	H	α-helix	trans	-63.9	-41.1	175.5	-74	175.8	-177	179.8	0	111.8	N28 L29 L30 T35 K36	N28-K32 WeakPolarHBondContact O-CG 3.47Å; N28-K32 PolarHBondContact O-N 2.85Å; L29-K32 PolarHBondContact O-N 3.3Å; L30-K32 PolarHBondContact O-N 3.42Å; K32-T35 PolarHBondContact O-N 3.17Å; K32-K36 WeakPolarHBondContact O-CB 3.45Å; K32-K36 PolarHBondContact O-N 2.89Å
33	S	90.8	Very high	85.7	Confident	56 Å²	56	88.9 Å²	88.9	39%	0.392	46%	0.459	S	S	.	.	H	α-helix	trans	-65.1	-42.7	178.4	-58.8	0	0	0	0	111.3	L29 L30 K36 W37	L29-S33 WeakPolarHBondContact O-CB 3.44Å; L29-S33 PolarHBondContact O-N 2.71Å; L29-S33 PolarHBondContact O-OG 3.5Å; L30-S33 PolarHBondContact O-N 2.94Å; S33-K36 PolarHBondContact O-N 3.02Å; S33-W37 WeakPolarHBondContact O-CB 3.36Å; S33-W37 PolarHBondContact O-N 2.92Å
34	F	92.9	Very high	85.9	Confident	104 Å²	104	93.3 Å²	93.3	46%	0.456	49%	0.489	S	S	.	.	H	α-helix	trans	-62	-49.6	174.7	177	-101.1	0	0	0	111.9	L30 L31 K36 W37 C38 M54	L30-F34 WeakPolarHBondContact O-CB 3.44Å; L30-F34 PolarHBondContact O-N 2.92Å; L31-F34 PolarHBondContact O-N 3.26Å; F34-K36 VanDerWaalsContact C-N 3.29Å; F34-K36 PolarHBondContact O-N 3.39Å; F34-W37 HydrophobicContact CD2-CE3 4.46Å; F34-W37 WeakPolarHBondContact O-CB 3.46Å; F34-W37 PolarHBondContact O-N 3.24Å; F34-W37 VanDerWaalsContact O-N 3.13Å; F34-C38 PolarHBondContact O-N 3.37Å; F34-C38 PolarHBondContact O-SG 2.86Å; F34-M54 WeakPolarHBondContact CA-SD 3.44Å; F34-M54 HydrophobicContact CB-SD 3.86Å; F34-M54 HydrophobicContact CD2-SD 4.32Å; F34-M54 PolarHBondContact N-SD 2.9Å
35	T	91.8	Very high	86	Confident	65 Å²	65	96.2 Å²	96.2	40%	0.399	50%	0.5	S	S	.	.	H	α-helix	trans	-59.4	-42.5	178.5	-53.1	0	0	0	0	111.1	L31 K32 C38 H39	L31-T35 WeakPolarHBondContact O-CB 3.46Å; L31-T35 PolarHBondContact O-N 2.91Å; L31-T35 PolarHBondContact O-OG1 2.93Å; K32-T35 PolarHBondContact O-N 3.17Å; T35-C38 PolarHBondContact O-N 3.03Å; T35-H39 PolarHBondContact O-N 2.74Å; T35-H39 PolarHBondContact O-ND1 3.31Å
36	K	89.9	Confident	86.1	Confident	146 Å²	146	93 Å²	93	64%	0.635	49%	0.492	S	S	*	.	H	α-helix	trans	-64.5	-43.4	176.1	-174.8	178.3	178.5	-179	0	111.8	K32 S33 F34 C38 H39 S40	K32-K36 WeakPolarHBondContact O-CB 3.45Å; K32-K36 PolarHBondContact O-N 2.89Å; S33-K36 PolarHBondContact O-N 3.02Å; F34-K36 VanDerWaalsContact C-N 3.29Å; F34-K36 PolarHBondContact O-N 3.39Å; K36-C38 VanDerWaalsContact C-N 3.33Å; K36-C38 PolarHBondContact O-N 3.38Å; K36-H39 PolarHBondContact O-N 2.97Å; K36-S40 VanDerWaalsContact O-CB 3.27Å; K36-S40 WeakPolarHBondContact O-CB 3.34Å; K36-S40 PolarHBondContact O-N 3.42Å
37	W	90	Very high	86.1	Confident	89 Å²	89	90.3 Å²	90.3	34%	0.337	49%	0.488	S	S	.	.	H	α-helix	trans	-60.4	-40.5	179	-176.2	70.6	0	0	0	112.1	S33 F34 H39 G47 Y51 M54	S33-W37 WeakPolarHBondContact O-CB 3.36Å; S33-W37 PolarHBondContact O-N 2.92Å; F34-W37 HydrophobicContact CD2-CE3 4.46Å; F34-W37 WeakPolarHBondContact O-CB 3.46Å; F34-W37 PolarHBondContact O-N 3.24Å; F34-W37 VanDerWaalsContact O-N 3.13Å; W37-H39 VanDerWaalsContact C-N 3.31Å; W37-H39 PolarHBondContact O-N 3.42Å; W37-G47 PolarHBondContact NE1-O 3.34Å; W37-Y51 HydrophobicContact CH2-CD2 4.11Å; W37-Y51 HydrophobicContact CZ2-CD2 4.14Å; W37-Y51 HydrophobicContact CZ2-CG 4.43Å; W37-M54 HydrophobicContact CB-CE 4.04Å; W37-M54 HydrophobicContact CB-SD 4.4Å; W37-M54 HydrophobicContact CD2-CE 3.6Å; W37-M54 HydrophobicContact CE3-CE 3.71Å; W37-M54 HydrophobicContact CG-CE 3.76Å; W37-M54 HydrophobicContact CZ3-CE 4.36Å
38	C	88.8	Confident	86.1	Confident	70 Å²	70	92 Å²	92	47%	0.473	49%	0.492	S	S	.	.	H	α-helix	trans	-65.7	-27.8	177.5	-65.4	0	0	0	0	114.6	F34 T35 K36	F34-C38 PolarHBondContact O-N 3.37Å; F34-C38 PolarHBondContact O-SG 2.86Å; T35-C38 PolarHBondContact O-N 3.03Å; K36-C38 VanDerWaalsContact C-N 3.33Å; K36-C38 PolarHBondContact O-N 3.38Å
39	H	86.1	Confident	86.1	Confident	151 Å²	151	91.4 Å²	91.4	70%	0.699	49%	0.493	S	S	*	.	H	α-helix	trans	-109.9	1.2	-173.1	-61.2	91.6	0	0	0	113.6	T35 K36 W37 P41	T35-H39 PolarHBondContact O-N 2.74Å; T35-H39 PolarHBondContact O-ND1 3.31Å; K36-H39 PolarHBondContact O-N 2.97Å; W37-H39 VanDerWaalsContact C-N 3.31Å; W37-H39 PolarHBondContact O-N 3.42Å; H39-P41 WeakPolarHBondContact O-CD 3.45Å
40	S	78.4	Confident	86.1	Confident	52 Å²	52	89.5 Å²	89.5	36%	0.364	48%	0.482	S	S	.	.			trans	-90.9	121.2	-177.3	-166.6	0	0	0	0	110.6	K36 G42	K36-S40 VanDerWaalsContact O-CB 3.27Å; K36-S40 WeakPolarHBondContact O-CB 3.34Å; K36-S40 PolarHBondContact O-N 3.42Å; S40-G42 PolarHBondContact O-N 3.35Å
41	P	70.1	Confident	86	Confident	136 Å²	136	92.7 Å²	92.7	88%	0.883	49%	0.493	S	S	*	.			trans	-76.2	68.8	167.7	32.5	-32.4	0	0	0	109	H39	H39-P41 WeakPolarHBondContact O-CD 3.45Å
42	G	70	Confident	86	Confident	35 Å²	35	92.3 Å²	92.3	36%	0.361	49%	0.488	S	S	.	.			trans	-90.5	163.8	179.9	0	0	0	0	0	112.5	S40	S40-G42 PolarHBondContact O-N 3.35Å
43	S	80.5	Confident	86.1	Confident	51 Å²	51	93 Å²	93	36%	0.357	49%	0.487	S	S	.	.			trans	-65.6	155	169.1	80.7	0	0	0	0	110.4	E45 E46 G47	S43-E45 PolarHBondContact O-N 3.48Å; S43-E45 VanDerWaalsContact O-N 3.16Å; S43-E46 PolarHBondContact O-N 3.22Å; S43-E46 WeakPolarHBondContact OG-CG 3.32Å; S43-E46 PolarHBondContact OG-N 2.93Å; S43-G47 PolarHBondContact O-N 3.17Å
44	P	80	Confident	86.2	Confident	123 Å²	123	91.1 Å²	91.1	80%	0.799	47%	0.472	S	S	*	.	H	α-helix	trans	-55.2	-33.4	177.1	-26.6	34.9	0	0	0	113.6	F48	P44-F48 PolarHBondContact O-N 2.95Å
45	E	84	Confident	86.3	Confident	164 Å²	164	89.3 Å²	89.3	77%	0.766	47%	0.467	S	S	*	.	H	α-helix	trans	-72.1	-41.9	-179.9	-169.2	173.5	-173.4	0	0	112.2	S43 F48 S49	S43-E45 PolarHBondContact O-N 3.48Å; S43-E45 VanDerWaalsContact O-N 3.16Å; E45-F48 PolarHBondContact O-N 3.47Å; E45-S49 PolarHBondContact O-N 2.9Å
46	E	84.4	Confident	86.3	Confident	110 Å²	110	87.8 Å²	87.8	51%	0.514	46%	0.464	S	S	.	.	H	α-helix	trans	-66.4	-39.9	174.5	-71.9	174.6	177.8	0	0	111.8	S43 F48 S49 Q50	S43-E46 PolarHBondContact O-N 3.22Å; S43-E46 WeakPolarHBondContact OG-CG 3.32Å; S43-E46 PolarHBondContact OG-N 2.93Å; E46-F48 VanDerWaalsContact C-N 3.34Å; E46-S49 PolarHBondContact O-N 2.86Å; E46-Q50 WeakPolarHBondContact O-CG 3.48Å; E46-Q50 PolarHBondContact O-N 3.33Å
47	G	86.2	Confident	86.4	Confident	19 Å²	19	83.1 Å²	83.1	20%	0.196	45%	0.448	C	S	.	.	H	α-helix	trans	-60.1	-43.6	174.8	0	0	0	0	0	112	W37 S43 Q50 Y51	W37-G47 PolarHBondContact NE1-O 3.34Å; S43-G47 PolarHBondContact O-N 3.17Å; G47-Q50 PolarHBondContact O-N 3.15Å; G47-Y51 WeakPolarHBondContact O-CB 3.37Å; G47-Y51 PolarHBondContact O-N 2.89Å
48	F	88.3	Confident	86.5	Confident	127 Å²	127	82.5 Å²	82.5	56%	0.557	45%	0.451	S	S	*	.	H	α-helix	trans	-66.3	-42	177.4	-174.1	-103.7	0	0	0	112.6	P44 E45 E46 Q50 Y51 Q52	P44-F48 PolarHBondContact O-N 2.95Å; E45-F48 PolarHBondContact O-N 3.47Å; E46-F48 VanDerWaalsContact C-N 3.34Å; F48-Q50 VanDerWaalsContact C-N 3.33Å; F48-Q50 PolarHBondContact O-N 2.83Å; F48-Y51 PolarHBondContact O-N 3.46Å; F48-Q52 HydrophobicContact CD1-CG 4.26Å; F48-Q52 HydrophobicContact CE1-CG 3.89Å; F48-Q52 HydrophobicContact CZ-CG 4.03Å; F48-Q52 VanDerWaalsContact CZ-NE2 3.34Å; F48-Q52 WeakPolarHBondContact O-CG 3.43Å; F48-Q52 PolarHBondContact O-N 3.35Å
49	S	89.4	Confident	86.7	Confident	55 Å²	55	81.6 Å²	81.6	39%	0.385	45%	0.448	S	S	.	.	H	α-helix	trans	-61.3	-39	175.6	176.3	0	0	0	0	113	E45 E46 R53	E45-S49 PolarHBondContact O-N 2.9Å; E46-S49 PolarHBondContact O-N 2.86Å; S49-R53 PolarHBondContact O-N 2.95Å; S49-R53 PolarHBondContact O-NE 3.46Å; S49-R53 PolarHBondContact OG-NH2 3Å; S49-R53 VanDerWaalsContact OG-NH2 3.16Å
50	Q	89.1	Confident	86.9	Confident	49 Å²	49	79.4 Å²	79.4	23%	0.229	44%	0.438	C	S	.	.	H	α-helix	trans	-69.6	-40.4	176.3	-71	176.4	34	0	0	111.6	E46 G47 F48 R53 M54	E46-Q50 WeakPolarHBondContact O-CG 3.48Å; E46-Q50 PolarHBondContact O-N 3.33Å; G47-Q50 PolarHBondContact O-N 3.15Å; F48-Q50 VanDerWaalsContact C-N 3.33Å; F48-Q50 PolarHBondContact O-N 2.83Å; Q50-R53 PolarHBondContact O-N 2.85Å; Q50-M54 WeakPolarHBondContact O-CG 3.41Å; Q50-M54 PolarHBondContact O-N 3.2Å
51	Y	91.2	Very high	87.4	Confident	98 Å²	98	77.8 Å²	77.8	38%	0.384	43%	0.427	S	S	.	.	H	α-helix	trans	-59.3	-47.4	174.5	177	-104.8	0	0	0	112.6	W37 G47 F48 R53 M54 L55	W37-Y51 HydrophobicContact CH2-CD2 4.11Å; W37-Y51 HydrophobicContact CZ2-CD2 4.14Å; W37-Y51 HydrophobicContact CZ2-CG 4.43Å; G47-Y51 WeakPolarHBondContact O-CB 3.37Å; G47-Y51 PolarHBondContact O-N 2.89Å; F48-Y51 PolarHBondContact O-N 3.46Å; Y51-R53 VanDerWaalsContact C-N 3.3Å; Y51-R53 PolarHBondContact O-N 3.26Å; Y51-M54 HydrophobicContact CD2-CE 4.34Å; Y51-M54 PolarHBondContact O-N 3.46Å; Y51-M54 VanDerWaalsContact O-N 3.14Å; Y51-L55 HydrophobicContact CD1-CD1 4Å; Y51-L55 HydrophobicContact CE1-CD1 3.39Å; Y51-L55 HydrophobicContact CE1-CG 4.09Å; Y51-L55 HydrophobicContact CE2-CG 4.38Å; Y51-L55 PolarHBondContact O-N 3.47Å
52	Q	93.3	Very high	88.4	Confident	93 Å²	93	77.4 Å²	77.4	44%	0.435	41%	0.413	S	S	.	.	H	α-helix	trans	-60.4	-39	176.4	-70.4	-63	-30	0	0	112.4	F48 L55 G56	F48-Q52 HydrophobicContact CD1-CG 4.26Å; F48-Q52 HydrophobicContact CE1-CG 3.89Å; F48-Q52 HydrophobicContact CZ-CG 4.03Å; F48-Q52 VanDerWaalsContact CZ-NE2 3.34Å; F48-Q52 WeakPolarHBondContact O-CG 3.43Å; F48-Q52 PolarHBondContact O-N 3.35Å; Q52-L55 PolarHBondContact O-N 3.48Å; Q52-G56 PolarHBondContact O-N 3.03Å
53	R	92	Very high	89.4	Confident	159 Å²	159	83.1 Å²	83.1	60%	0.6	43%	0.429	S	S	*	.	H	α-helix	trans	-64.1	-41.9	174.2	-81.5	-178.2	-84.6	177.2	-10.9	112.4	S49 Q50 Y51 G56 T57	S49-R53 PolarHBondContact O-N 2.95Å; S49-R53 PolarHBondContact O-NE 3.46Å; S49-R53 PolarHBondContact OG-NH2 3Å; S49-R53 VanDerWaalsContact OG-NH2 3.16Å; Q50-R53 PolarHBondContact O-N 2.85Å; Y51-R53 VanDerWaalsContact C-N 3.3Å; Y51-R53 PolarHBondContact O-N 3.26Å; R53-G56 PolarHBondContact O-N 3.2Å; R53-T57 PolarHBondContact O-N 3.43Å; R53-T57 PolarHBondContact O-OG1 3.46Å
54	M	94	Very high	89.7	Confident	17 Å²	17	80.9 Å²	80.9	8%	0.084	41%	0.413	C	S	.	.	H	α-helix	trans	-62.8	-42.8	176.1	-71	-170.3	-61.2	0	0	112.1	L30 F34 W37 Q50 Y51 G56 T57 L58	L30-M54 HydrophobicContact CD1-CB 3.81Å; L30-M54 HydrophobicContact CD1-CG 3.99Å; L30-M54 HydrophobicContact CD1-SD 4.5Å; F34-M54 WeakPolarHBondContact CA-SD 3.44Å; F34-M54 HydrophobicContact CB-SD 3.86Å; F34-M54 HydrophobicContact CD2-SD 4.32Å; F34-M54 PolarHBondContact N-SD 2.9Å; W37-M54 HydrophobicContact CB-CE 4.04Å; W37-M54 HydrophobicContact CB-SD 4.4Å; W37-M54 HydrophobicContact CD2-CE 3.6Å; W37-M54 HydrophobicContact CE3-CE 3.71Å; W37-M54 HydrophobicContact CG-CE 3.76Å; W37-M54 HydrophobicContact CZ3-CE 4.36Å; Q50-M54 WeakPolarHBondContact O-CG 3.41Å; Q50-M54 PolarHBondContact O-N 3.2Å; Y51-M54 HydrophobicContact CD2-CE 4.34Å; Y51-M54 PolarHBondContact O-N 3.46Å; Y51-M54 VanDerWaalsContact O-N 3.14Å; M54-G56 VanDerWaalsContact C-N 3.33Å; M54-G56 PolarHBondContact O-N 2.88Å; M54-T57 WeakPolarHBondContact CA-OG1 3.36Å; M54-T57 PolarHBondContact O-N 3.2Å; M54-T57 PolarHBondContact O-OG1 2.88Å; M54-L58 WeakPolarHBondContact O-CB 3.44Å; M54-L58 PolarHBondContact O-N 3.31Å
55	L	94.6	Very high	90.1	Very high	67 Å²	67	81.4 Å²	81.4	35%	0.351	41%	0.406	S	S	.	.	H	α-helix	trans	-59.1	-43.9	173.5	-73.8	177.8	0	0	0	111.9	Y51 Q52 T57 L58 A59	Y51-L55 HydrophobicContact CD1-CD1 4Å; Y51-L55 HydrophobicContact CE1-CD1 3.39Å; Y51-L55 HydrophobicContact CE1-CG 4.09Å; Y51-L55 HydrophobicContact CE2-CG 4.38Å; Y51-L55 PolarHBondContact O-N 3.47Å; Q52-L55 PolarHBondContact O-N 3.48Å; L55-T57 VanDerWaalsContact C-N 3.35Å; L55-T57 PolarHBondContact O-N 3.36Å; L55-L58 PolarHBondContact O-N 2.97Å; L55-A59 PolarHBondContact O-N 3.28Å
56	G	92.9	Very high	90.5	Very high	33 Å²	33	75.2 Å²	75.2	34%	0.34	39%	0.387	S	S	.	.	H	α-helix	trans	-60.2	-42.4	175.6	0	0	0	0	0	112.8	Q52 R53 M54 Q60	Q52-G56 PolarHBondContact O-N 3.03Å; R53-G56 PolarHBondContact O-N 3.2Å; M54-G56 VanDerWaalsContact C-N 3.33Å; M54-G56 PolarHBondContact O-N 2.88Å; G56-Q60 WeakPolarHBondContact O-CG 3.35Å; G56-Q60 PolarHBondContact O-N 3.33Å
57	T	91	Very high	90.7	Very high	47 Å²	47	74.7 Å²	74.7	29%	0.288	38%	0.383	S	S	.	.	H	α-helix	trans	-68.6	-34.6	175.7	48.5	0	0	0	0	113.1	L30 R53 M54 L55 Q60 C61	L30-T57 WeakPolarHBondContact CD1-OG1 3.28Å; R53-T57 PolarHBondContact O-N 3.43Å; R53-T57 PolarHBondContact O-OG1 3.46Å; M54-T57 WeakPolarHBondContact CA-OG1 3.36Å; M54-T57 PolarHBondContact O-N 3.2Å; M54-T57 PolarHBondContact O-OG1 2.88Å; L55-T57 VanDerWaalsContact C-N 3.35Å; L55-T57 PolarHBondContact O-N 3.36Å; T57-Q60 PolarHBondContact O-N 2.85Å; T57-C61 PolarHBondContact O-N 2.93Å; T57-C61 VanDerWaalsContact O-N 3.12Å; T57-C61 PolarHBondContact O-SG 3.44Å
58	L	92.1	Very high	90.8	Very high	76 Å²	76	77.1 Å²	77.1	40%	0.398	39%	0.394	S	S	.	.	H	α-helix	trans	-65	-47.9	175.7	-179.9	63.7	0	0	0	111	L30 M54 L55 Q60 C61 E62	L30-L58 HydrophobicContact CD2-CB 4.28Å; L30-L58 HydrophobicContact CD2-CD1 4.17Å; M54-L58 WeakPolarHBondContact O-CB 3.44Å; M54-L58 PolarHBondContact O-N 3.31Å; L55-L58 PolarHBondContact O-N 2.97Å; L58-Q60 PolarHBondContact O-N 2.86Å; L58-C61 WeakPolarHBondContact O-CA 3.46Å; L58-C61 WeakPolarHBondContact O-CB 3.47Å; L58-C61 PolarHBondContact O-N 3.46Å; L58-E62 PolarHBondContact O-N 2.99Å
59	A	93.2	Very high	91	Very high	52 Å²	52	75.8 Å²	75.8	43%	0.43	39%	0.392	S	S	.	.	H	α-helix	trans	-58.8	-36.5	176.8	0	0	0	0	0	112.4	L55 F63	L55-A59 PolarHBondContact O-N 3.28Å; A59-F63 WeakPolarHBondContact O-CB 3.35Å; A59-F63 PolarHBondContact O-N 3.02Å
60	Q	89.6	Confident	91.2	Very high	104 Å²	104	79.2 Å²	79.2	49%	0.486	40%	0.404	S	S	.	.	H	α-helix	trans	-66.6	-37.3	173.8	-72.1	174.5	9.7	0	0	112.8	G56 T57 L58 S64	G56-Q60 WeakPolarHBondContact O-CG 3.35Å; G56-Q60 PolarHBondContact O-N 3.33Å; T57-Q60 PolarHBondContact O-N 2.85Å; L58-Q60 PolarHBondContact O-N 2.86Å; Q60-S64 WeakPolarHBondContact O-CB 3.22Å; Q60-S64 PolarHBondContact O-N 3.44Å
61	C	89.8	Confident	91.3	Very high	19 Å²	19	79.9 Å²	79.9	13%	0.128	41%	0.411	C	S	.	.	H	α-helix	trans	-66.9	-43.8	175.9	-63.4	0	0	0	0	111	T57 L58 F63 S64 M65	T57-C61 PolarHBondContact O-N 2.93Å; T57-C61 VanDerWaalsContact O-N 3.12Å; T57-C61 PolarHBondContact O-SG 3.44Å; L58-C61 WeakPolarHBondContact O-CA 3.46Å; L58-C61 WeakPolarHBondContact O-CB 3.47Å; L58-C61 PolarHBondContact O-N 3.46Å; C61-F63 VanDerWaalsContact C-N 3.35Å; C61-F63 PolarHBondContact O-N 2.91Å; C61-S64 PolarHBondContact O-N 3.34Å; C61-M65 PolarHBondContact O-N 2.86Å
62	E	90.1	Very high	91.3	Very high	127 Å²	127	81.8 Å²	81.8	59%	0.593	42%	0.418	S	S	*	.	H	α-helix	trans	-60.1	-44.3	175.8	-69.4	175.3	165.9	0	0	111.6	L58 M65 G66	L58-E62 PolarHBondContact O-N 2.99Å; E62-M65 PolarHBondContact O-N 2.99Å; E62-G66 PolarHBondContact O-N 3.35Å
63	F	90.8	Very high	91.4	Very high	155 Å²	155	80.3 Å²	80.3	68%	0.68	41%	0.413	S	S	*	.	H	α-helix	trans	-61.8	-44.8	175.6	179.5	-97	0	0	0	112.3	A59 C61 M65 G66 K67	A59-F63 WeakPolarHBondContact O-CB 3.35Å; A59-F63 PolarHBondContact O-N 3.02Å; C61-F63 VanDerWaalsContact C-N 3.35Å; C61-F63 PolarHBondContact O-N 2.91Å; F63-M65 VanDerWaalsContact C-N 3.33Å; F63-M65 PolarHBondContact O-N 3.46Å; F63-G66 PolarHBondContact O-N 3.5Å; F63-K67 WeakPolarHBondContact O-CB 3.41Å; F63-K67 PolarHBondContact O-N 3Å
64	S	88.2	Confident	91.6	Very high	4 Å²	4	76.4 Å²	76.4	3%	0.028	40%	0.403	C	S	.	.	H	α-helix	trans	-61.7	-41	178.3	-159	0	0	0	0	112.1	D23 R26 Q60 C61 K67 T68	D23-S64 VanDerWaalsContact CG-OG 3.27Å; D23-S64 PolarHBondContact OD1-OG 3.47Å; D23-S64 VanDerWaalsContact OD1-OG 3.11Å; D23-S64 WeakPolarHBondContact OD2-CB 3.32Å; D23-S64 PolarHBondContact OD2-OG 3.26Å; R26-S64 PolarHBondContact NH2-OG 3.06Å; Q60-S64 WeakPolarHBondContact O-CB 3.22Å; Q60-S64 PolarHBondContact O-N 3.44Å; C61-S64 PolarHBondContact O-N 3.34Å; S64-K67 PolarHBondContact O-N 3.3Å; S64-T68 PolarHBondContact O-N 3.38Å; S64-T68 PolarHBondContact O-OG1 3.07Å
65	M	87.8	Confident	91.7	Very high	134 Å²	134	78.9 Å²	78.9	66%	0.66	42%	0.417	S	S	*	.	H	α-helix	trans	-60.8	-48.7	175	-174.1	66.4	73.8	0	0	111.4	C61 E62 F63 K67 T68 L69	C61-M65 PolarHBondContact O-N 2.86Å; E62-M65 PolarHBondContact O-N 2.99Å; F63-M65 VanDerWaalsContact C-N 3.33Å; F63-M65 PolarHBondContact O-N 3.46Å; M65-K67 VanDerWaalsContact C-N 3.34Å; M65-K67 PolarHBondContact O-N 3.34Å; M65-T68 PolarHBondContact O-N 3.29Å; M65-L69 PolarHBondContact O-N 3.14Å; M65-L69 VanDerWaalsContact O-N 3.11Å
66	G	91.6	Very high	91.7	Very high	35 Å²	35	78.5 Å²	78.5	36%	0.361	42%	0.415	S	S	.	.	H	α-helix	trans	-61.3	-41.2	177.8	0	0	0	0	0	112.8	E62 F63 L69 M70	E62-G66 PolarHBondContact O-N 3.35Å; F63-G66 PolarHBondContact O-N 3.5Å; G66-L69 PolarHBondContact O-N 3.48Å; G66-M70 WeakPolarHBondContact O-CG 3.47Å; G66-M70 PolarHBondContact O-N 3.17Å; G66-M70 VanDerWaalsContact O-N 3.14Å
67	K	90.3	Very high	92	Very high	98 Å²	98	84.5 Å²	84.5	43%	0.426	43%	0.427	S	S	.	.	H	α-helix	trans	-60.3	-45.3	174.3	179.7	-168.5	166.9	-149.2	0	111.4	D19 F63 S64 M65 L69 M70 V71	D19-K67 IonicContact OD2-NZ 2.88Å; D19-K67 PolarHBondContact OD2-NZ 3.32Å; F63-K67 WeakPolarHBondContact O-CB 3.41Å; F63-K67 PolarHBondContact O-N 3Å; S64-K67 PolarHBondContact O-N 3.3Å; M65-K67 VanDerWaalsContact C-N 3.34Å; M65-K67 PolarHBondContact O-N 3.34Å; K67-L69 VanDerWaalsContact C-N 3.32Å; K67-L69 PolarHBondContact O-N 2.94Å; K67-M70 PolarHBondContact O-N 3.12Å; K67-V71 WeakPolarHBondContact O-CG2 3.3Å; K67-V71 PolarHBondContact O-N 3.35Å
68	T	87.9	Confident	92.2	Very high	70 Å²	70	86.2 Å²	86.2	43%	0.429	43%	0.432	S	S	.	.	H	α-helix	trans	-61	-41.4	179.8	-61.2	0	0	0	0	111.7	S64 M65 V71 Y72	S64-T68 PolarHBondContact O-N 3.38Å; S64-T68 PolarHBondContact O-OG1 3.07Å; M65-T68 PolarHBondContact O-N 3.29Å; T68-V71 PolarHBondContact O-N 3.43Å; T68-Y72 WeakPolarHBondContact O-CB 3.44Å; T68-Y72 PolarHBondContact O-N 3.02Å
69	L	91.3	Very high	92.4	Very high	100 Å²	100	87.6 Å²	87.6	52%	0.524	44%	0.437	S	S	.	.	H	α-helix	trans	-62.7	-43.1	175.8	-172.7	65.6	0	0	0	111.9	M65 G66 K67 V71 Y72 D73	M65-L69 PolarHBondContact O-N 3.14Å; M65-L69 VanDerWaalsContact O-N 3.11Å; G66-L69 PolarHBondContact O-N 3.48Å; K67-L69 VanDerWaalsContact C-N 3.32Å; K67-L69 PolarHBondContact O-N 2.94Å; L69-V71 VanDerWaalsContact C-N 3.35Å; L69-V71 PolarHBondContact O-N 3.25Å; L69-Y72 WeakPolarHBondContact O-CB 3.43Å; L69-Y72 PolarHBondContact O-N 2.93Å; L69-D73 PolarHBondContact O-N 3.02Å
70	M	94.4	Very high	92.6	Very high	127 Å²	127	90 Å²	90	63%	0.626	44%	0.44	S	S	*	.	H	α-helix	trans	-64.4	-38.5	177.7	-67.9	-70.6	161.6	0	0	112.6	G66 K67 Y72 D73 M74	G66-M70 WeakPolarHBondContact O-CG 3.47Å; G66-M70 PolarHBondContact O-N 3.17Å; G66-M70 VanDerWaalsContact O-N 3.14Å; K67-M70 PolarHBondContact O-N 3.12Å; M70-Y72 VanDerWaalsContact C-N 3.35Å; M70-D73 PolarHBondContact O-N 3.34Å; M70-M74 WeakPolarHBondContact O-CB 3.46Å; M70-M74 PolarHBondContact O-N 2.77Å
71	V	91.1	Very high	93	Very high	63 Å²	63	89.2 Å²	89.2	38%	0.382	44%	0.439	S	S	.	.	H	α-helix	trans	-65.5	-40.3	174.2	171.7	0	0	0	0	110.6	K67 T68 L69 M74 N75	K67-V71 WeakPolarHBondContact O-CG2 3.3Å; K67-V71 PolarHBondContact O-N 3.35Å; T68-V71 PolarHBondContact O-N 3.43Å; L69-V71 VanDerWaalsContact C-N 3.35Å; L69-V71 PolarHBondContact O-N 3.25Å; V71-M74 WeakPolarHBondContact O-CB 3.39Å; V71-M74 PolarHBondContact O-N 3.2Å; V71-N75 PolarHBondContact O-N 2.72Å; V71-N75 PolarHBondContact O-ND2 3.12Å
72	Y	90.6	Very high	93.4	Very high	137 Å²	137	94.6 Å²	94.6	54%	0.537	46%	0.458	S	S	.	.	H	α-helix	trans	-60.3	-47.9	174.8	174.7	-100.8	0	0	0	112.1	T68 L69 M70 M74 N75 L76	T68-Y72 WeakPolarHBondContact O-CB 3.44Å; T68-Y72 PolarHBondContact O-N 3.02Å; L69-Y72 WeakPolarHBondContact O-CB 3.43Å; L69-Y72 PolarHBondContact O-N 2.93Å; M70-Y72 VanDerWaalsContact C-N 3.35Å; Y72-M74 VanDerWaalsContact C-N 3.29Å; Y72-M74 PolarHBondContact O-N 3.32Å; Y72-N75 PolarHBondContact O-N 2.88Å; Y72-N75 VanDerWaalsContact O-N 3.16Å; Y72-L76 HydrophobicContact CD1-CD1 3.86Å; Y72-L76 HydrophobicContact CE1-CD1 3.29Å; Y72-L76 HydrophobicContact CE1-CG 4.24Å; Y72-L76 HydrophobicContact CE2-CD1 4.4Å; Y72-L76 PolarHBondContact O-N 3.39Å
73	D	95.9	Very high	93.7	Very high	62 Å²	62	95.3 Å²	95.3	33%	0.332	46%	0.461	S	S	.	.	H	α-helix	trans	-65.3	-31.9	177.5	-69.7	-15.7	0	0	0	112.7	L69 M70 R77	L69-D73 PolarHBondContact O-N 3.02Å; M70-D73 PolarHBondContact O-N 3.34Å; D73-R77 WeakPolarHBondContact O-CG 3.45Å; D73-R77 PolarHBondContact O-N 3.43Å; D73-R77 PolarHBondContact O-NE 3.04Å; D73-R77 VanDerWaalsContact O-NE 3.13Å
74	M	96.7	Very high	94.1	Very high	77 Å²	77	94.5 Å²	94.5	38%	0.379	46%	0.457	S	S	.	.	H	α-helix	trans	-65.5	-48.1	171.1	-175	-163.3	79.9	0	0	110.9	M70 V71 Y72 L76 R77 E78	M70-M74 WeakPolarHBondContact O-CB 3.46Å; M70-M74 PolarHBondContact O-N 2.77Å; V71-M74 WeakPolarHBondContact O-CB 3.39Å; V71-M74 PolarHBondContact O-N 3.2Å; Y72-M74 VanDerWaalsContact C-N 3.29Å; Y72-M74 PolarHBondContact O-N 3.32Å; M74-L76 VanDerWaalsContact C-N 3.33Å; M74-L76 PolarHBondContact O-N 3.48Å; M74-R77 PolarHBondContact O-N 3.05Å; M74-R77 VanDerWaalsContact O-N 3.15Å; M74-E78 PolarHBondContact O-N 3.2Å
75	N	94.9	Very high	94.6	Very high	69 Å²	69	97.8 Å²	97.8	37%	0.369	47%	0.474	S	S	.	.	H	α-helix	trans	-62.3	-38.5	179.7	-69	-17.7	0	0	0	112.2	V71 Y72 R77 E78 M79	V71-N75 PolarHBondContact O-N 2.72Å; V71-N75 PolarHBondContact O-ND2 3.12Å; Y72-N75 PolarHBondContact O-N 2.88Å; Y72-N75 VanDerWaalsContact O-N 3.16Å; N75-R77 PolarHBondContact O-N 3.41Å; N75-E78 PolarHBondContact O-N 2.92Å; N75-M79 WeakPolarHBondContact O-CG 3.35Å; N75-M79 PolarHBondContact O-N 3.32Å
76	L	96.6	Very high	95	Very high	60 Å²	60	99.2 Å²	99.2	31%	0.314	47%	0.473	S	S	.	.	H	α-helix	trans	-57.2	-48.2	173	-85.6	165.2	0	0	0	111.6	Y72 M74 E78 M79 E80	Y72-L76 HydrophobicContact CD1-CD1 3.86Å; Y72-L76 HydrophobicContact CE1-CD1 3.29Å; Y72-L76 HydrophobicContact CE1-CG 4.24Å; Y72-L76 HydrophobicContact CE2-CD1 4.4Å; Y72-L76 PolarHBondContact O-N 3.39Å; M74-L76 VanDerWaalsContact C-N 3.33Å; M74-L76 PolarHBondContact O-N 3.48Å; L76-E78 VanDerWaalsContact C-N 3.33Å; L76-E78 PolarHBondContact O-N 2.99Å; L76-M79 HydrophobicContact CD2-CE 3.77Å; L76-M79 HydrophobicContact CG-CE 4.26Å; L76-M79 PolarHBondContact O-N 3.38Å; L76-E80 PolarHBondContact O-N 2.98Å; L76-E80 VanDerWaalsContact O-N 3.07Å
77	R	97.3	Very high	95.4	Very high	159 Å²	159	100.1 Å²	100.1	60%	0.6	47%	0.474	S	S	*	.	H	α-helix	trans	-64.7	-36.4	177.4	-73.2	179.5	-74	155.1	-5.9	112.6	D73 M74 N75 N81	D73-R77 WeakPolarHBondContact O-CG 3.45Å; D73-R77 PolarHBondContact O-N 3.43Å; D73-R77 PolarHBondContact O-NE 3.04Å; D73-R77 VanDerWaalsContact O-NE 3.13Å; M74-R77 PolarHBondContact O-N 3.05Å; M74-R77 VanDerWaalsContact O-N 3.15Å; N75-R77 PolarHBondContact O-N 3.41Å; R77-N81 WeakPolarHBondContact O-CB 3.49Å; R77-N81 PolarHBondContact O-N 2.93Å
78	E	96.8	Very high	95.7	Very high	82 Å²	82	99.5 Å²	99.5	38%	0.383	48%	0.475	S	S	.	.	H	α-helix	trans	-65.6	-42.7	174.5	-74.4	-172.6	164.8	0	0	111.8	M74 N75 L76 E80 N81 Y82	M74-E78 PolarHBondContact O-N 3.2Å; N75-E78 PolarHBondContact O-N 2.92Å; L76-E78 VanDerWaalsContact C-N 3.33Å; L76-E78 PolarHBondContact O-N 2.99Å; E78-E80 PolarHBondContact O-N 3.38Å; E78-N81 WeakPolarHBondContact O-CB 3.44Å; E78-N81 PolarHBondContact O-N 3.42Å; E78-N81 VanDerWaalsContact O-N 3.14Å; E78-Y82 HydrophobicContact CB-CE2 4.15Å; E78-Y82 WeakPolarHBondContact O-CD2 3.48Å; E78-Y82 PolarHBondContact O-N 3.44Å
79	M	96.3	Very high	96.2	Very high	105 Å²	105	100 Å²	100	52%	0.517	47%	0.474	S	S	.	.	H	α-helix	trans	-58.8	-47.5	174.9	-72.7	-171.6	-61.5	0	0	111.7	N75 L76 N81 Y82 E83	N75-M79 WeakPolarHBondContact O-CG 3.35Å; N75-M79 PolarHBondContact O-N 3.32Å; L76-M79 HydrophobicContact CD2-CE 3.77Å; L76-M79 HydrophobicContact CG-CE 4.26Å; L76-M79 PolarHBondContact O-N 3.38Å; M79-N81 VanDerWaalsContact C-N 3.25Å; M79-N81 PolarHBondContact O-N 3.42Å; M79-Y82 PolarHBondContact O-N 3.1Å; M79-Y82 VanDerWaalsContact O-N 3.17Å; M79-E83 PolarHBondContact O-N 3.39Å
80	E	97.4	Very high	96.5	Very high	104 Å²	104	101.3 Å²	101.3	49%	0.486	48%	0.477	S	S	.	.	H	α-helix	trans	-59.5	-37	175.4	-70.1	178.4	-176.2	0	0	112.4	L76 E78 K84	L76-E80 PolarHBondContact O-N 2.98Å; L76-E80 VanDerWaalsContact O-N 3.07Å; E78-E80 PolarHBondContact O-N 3.38Å; E80-K84 WeakPolarHBondContact O-CG 3.45Å; E80-K84 PolarHBondContact O-N 2.92Å; E80-K84 VanDerWaalsContact O-N 3.16Å
81	N	97.9	Very high	96.7	Very high	87 Å²	87	101 Å²	101	47%	0.465	48%	0.475	S	S	.	.	H	α-helix	trans	-67.9	-42.7	176.8	-169.5	25.6	0	0	0	111.3	R77 E78 M79 E83 K84 I85	R77-N81 WeakPolarHBondContact O-CB 3.49Å; R77-N81 PolarHBondContact O-N 2.93Å; E78-N81 WeakPolarHBondContact O-CB 3.44Å; E78-N81 PolarHBondContact O-N 3.42Å; E78-N81 VanDerWaalsContact O-N 3.14Å; M79-N81 VanDerWaalsContact C-N 3.25Å; M79-N81 PolarHBondContact O-N 3.42Å; N81-E83 PolarHBondContact O-N 3.03Å; N81-K84 WeakPolarHBondContact O-CB 3.48Å; N81-K84 PolarHBondContact O-N 3.49Å; N81-I85 VanDerWaalsContact O-CG1 3.31Å; N81-I85 WeakPolarHBondContact O-CG1 3.34Å; N81-I85 PolarHBondContact O-N 3.48Å
82	Y	97.6	Very high	97.1	Very high	132 Å²	132	102.6 Å²	102.6	52%	0.518	48%	0.481	S	S	.	.	H	α-helix	trans	-62.2	-42.3	175.9	-69	-50.1	0	0	0	111.9	E78 M79 K84 I85 Y86	E78-Y82 HydrophobicContact CB-CE2 4.15Å; E78-Y82 WeakPolarHBondContact O-CD2 3.48Å; E78-Y82 PolarHBondContact O-N 3.44Å; M79-Y82 PolarHBondContact O-N 3.1Å; M79-Y82 VanDerWaalsContact O-N 3.17Å; Y82-K84 VanDerWaalsContact C-N 3.32Å; Y82-K84 PolarHBondContact O-N 2.88Å; Y82-I85 HydrophobicContact CD1-CD1 4.39Å; Y82-I85 PolarHBondContact O-N 3Å; Y82-Y86 VanDerWaalsContact O-CD2 3.26Å; Y82-Y86 WeakPolarHBondContact O-CD2 3.09Å; Y82-Y86 PolarHBondContact O-N 3Å
83	E	97.4	Very high	97.4	Very high	141 Å²	141	100.3 Å²	100.3	66%	0.659	48%	0.477	S	S	*	.	H	α-helix	trans	-58.3	-43	174.5	-73.5	-177.3	174.3	0	0	112.3	M79 N81 I85 Y86 S87	M79-E83 PolarHBondContact O-N 3.39Å; N81-E83 PolarHBondContact O-N 3.03Å; E83-I85 PolarHBondContact O-N 2.84Å; E83-Y86 PolarHBondContact O-N 3.44Å; E83-S87 PolarHBondContact O-N 3.32Å
84	K	97.9	Very high	97.5	Very high	138 Å²	138	101.2 Å²	101.2	60%	0.6	49%	0.485	S	S	*	.	H	α-helix	trans	-62.2	-43.1	175.2	-72.1	167.9	-174.3	164.2	0	112	E80 N81 Y82 S87 N88	E80-K84 WeakPolarHBondContact O-CG 3.45Å; E80-K84 PolarHBondContact O-N 2.92Å; E80-K84 VanDerWaalsContact O-N 3.16Å; N81-K84 WeakPolarHBondContact O-CB 3.48Å; N81-K84 PolarHBondContact O-N 3.49Å; Y82-K84 VanDerWaalsContact C-N 3.32Å; Y82-K84 PolarHBondContact O-N 2.88Å; K84-S87 PolarHBondContact O-N 3.11Å; K84-N88 WeakPolarHBondContact O-CB 3.32Å; K84-N88 PolarHBondContact O-N 3.17Å
85	I	98.1	Very high	97.6	Very high	74 Å²	74	99.9 Å²	99.9	38%	0.379	48%	0.483	S	S	.	.	H	α-helix	trans	-63.1	-45	177.4	-68.5	166	0	0	0	110.2	N81 Y82 E83 S87 N88 I89	N81-I85 VanDerWaalsContact O-CG1 3.31Å; N81-I85 WeakPolarHBondContact O-CG1 3.34Å; N81-I85 PolarHBondContact O-N 3.48Å; Y82-I85 HydrophobicContact CD1-CD1 4.39Å; Y82-I85 PolarHBondContact O-N 3Å; E83-I85 PolarHBondContact O-N 2.84Å; I85-S87 PolarHBondContact O-N 2.99Å; I85-N88 PolarHBondContact O-N 3.38Å; I85-I89 HydrophobicContact CG2-CD1 3.7Å; I85-I89 HydrophobicContact CG2-CG1 4.36Å; I85-I89 VanDerWaalsContact O-CG1 3.28Å; I85-I89 WeakPolarHBondContact O-CG1 3.4Å; I85-I89 PolarHBondContact O-N 3.16Å
86	Y	98	Very high	97.8	Very high	164 Å²	164	98.8 Å²	98.8	64%	0.643	48%	0.484	S	S	*	.	H	α-helix	trans	-57.5	-50.4	175.9	-91.7	-73	0	0	0	111.7	Y82 E83 N88 I89 E90	Y82-Y86 VanDerWaalsContact O-CD2 3.26Å; Y82-Y86 WeakPolarHBondContact O-CD2 3.09Å; Y82-Y86 PolarHBondContact O-N 3Å; E83-Y86 PolarHBondContact O-N 3.44Å; Y86-N88 VanDerWaalsContact C-N 3.3Å; Y86-N88 PolarHBondContact O-N 3.4Å; Y86-I89 PolarHBondContact O-N 3.5Å; Y86-E90 PolarHBondContact O-N 2.92Å
87	S	98.2	Very high	97.9	Very high	54 Å²	54	101.7 Å²	101.7	38%	0.378	50%	0.496	S	S	.	.	H	α-helix	trans	-60.7	-39.8	178.4	-172.1	0	0	0	0	112.2	E83 K84 I85 E90 Q91	E83-S87 PolarHBondContact O-N 3.32Å; K84-S87 PolarHBondContact O-N 3.11Å; I85-S87 PolarHBondContact O-N 2.99Å; S87-E90 PolarHBondContact O-N 3.36Å; S87-Q91 WeakPolarHBondContact O-CG 3.32Å; S87-Q91 PolarHBondContact O-N 3.33Å
88	N	98.3	Very high	97.9	Very high	85 Å²	85	99.1 Å²	99.1	46%	0.455	49%	0.493	S	S	.	.	H	α-helix	trans	-63.8	-43.1	176.2	-171.1	-72.5	0	0	0	111.9	K84 I85 Y86 Q91 N92	K84-N88 WeakPolarHBondContact O-CB 3.32Å; K84-N88 PolarHBondContact O-N 3.17Å; I85-N88 PolarHBondContact O-N 3.38Å; Y86-N88 VanDerWaalsContact C-N 3.3Å; Y86-N88 PolarHBondContact O-N 3.4Å; N88-Q91 PolarHBondContact O-N 3.33Å; N88-N92 WeakPolarHBondContact O-CB 3.46Å; N88-N92 PolarHBondContact O-N 3.47Å; N88-N92 PolarHBondContact O-ND2 3.18Å; N88-N92 PolarHBondContact OD1-ND2 2.95Å
89	I	98.1	Very high	98	Very high	81 Å²	81	101.4 Å²	101.4	42%	0.415	50%	0.502	S	S	.	.	H	α-helix	trans	-61.9	-45.6	176.9	-69.5	167.8	0	0	0	110.4	I85 Y86 Q91 N92 I93	I85-I89 HydrophobicContact CG2-CD1 3.7Å; I85-I89 HydrophobicContact CG2-CG1 4.36Å; I85-I89 VanDerWaalsContact O-CG1 3.28Å; I85-I89 WeakPolarHBondContact O-CG1 3.4Å; I85-I89 PolarHBondContact O-N 3.16Å; Y86-I89 PolarHBondContact O-N 3.5Å; I89-Q91 PolarHBondContact O-N 3.36Å; I89-N92 PolarHBondContact O-N 3.23Å; I89-I93 HydrophobicContact CG2-CD1 3.74Å; I89-I93 HydrophobicContact CG2-CG1 4.37Å; I89-I93 VanDerWaalsContact O-CG1 3.28Å; I89-I93 WeakPolarHBondContact O-CG1 3.5Å; I89-I93 PolarHBondContact O-N 3.47Å
90	E	97.9	Very high	98.1	Very high	126 Å²	126	100.6 Å²	100.6	59%	0.589	50%	0.499	S	S	*	.	H	α-helix	trans	-60.5	-42.5	177	-73.7	-176.6	167.8	0	0	112.6	Y86 S87 I93 T94	Y86-E90 PolarHBondContact O-N 2.92Å; S87-E90 PolarHBondContact O-N 3.36Å; E90-I93 PolarHBondContact O-N 2.98Å; E90-T94 PolarHBondContact O-N 2.88Å; E90-T94 PolarHBondContact O-OG1 3.38Å
91	Q	98.3	Very high	98.1	Very high	122 Å²	122	97.8 Å²	97.8	57%	0.57	49%	0.494	S	S	*	.	H	α-helix	trans	-62.6	-43.2	175.1	-73.7	177.7	4.5	0	0	111.8	S87 N88 I89 I93 T94 S95	S87-Q91 WeakPolarHBondContact O-CG 3.32Å; S87-Q91 PolarHBondContact O-N 3.33Å; N88-Q91 PolarHBondContact O-N 3.33Å; I89-Q91 PolarHBondContact O-N 3.36Å; Q91-I93 PolarHBondContact O-N 3.37Å; Q91-T94 PolarHBondContact O-N 3.2Å; Q91-S95 WeakPolarHBondContact O-CB 3.5Å; Q91-S95 PolarHBondContact O-N 3.14Å
92	N	98.4	Very high	98.1	Very high	95 Å²	95	99.4 Å²	99.4	51%	0.508	50%	0.498	S	S	.	.	H	α-helix	trans	-64.4	-40.5	177.5	-70.7	-27.3	0	0	0	112	N88 I89 T94 S95 A96	N88-N92 WeakPolarHBondContact O-CB 3.46Å; N88-N92 PolarHBondContact O-N 3.47Å; N88-N92 PolarHBondContact O-ND2 3.18Å; N88-N92 PolarHBondContact OD1-ND2 2.95Å; I89-N92 PolarHBondContact O-N 3.23Å; N92-T94 VanDerWaalsContact C-N 3.35Å; N92-S95 PolarHBondContact O-N 3.01Å; N92-A96 WeakPolarHBondContact O-CB 3.38Å; N92-A96 PolarHBondContact O-N 3.25Å
93	I	98.1	Very high	98.1	Very high	90 Å²	90	96.6 Å²	96.6	46%	0.462	50%	0.497	S	S	.	.	H	α-helix	trans	-61.2	-46.4	175.2	-71.1	167.5	0	0	0	110.1	I89 E90 Q91 A96 H97	I89-I93 HydrophobicContact CG2-CD1 3.74Å; I89-I93 HydrophobicContact CG2-CG1 4.37Å; I89-I93 VanDerWaalsContact O-CG1 3.28Å; I89-I93 WeakPolarHBondContact O-CG1 3.5Å; I89-I93 PolarHBondContact O-N 3.47Å; E90-I93 PolarHBondContact O-N 2.98Å; Q91-I93 PolarHBondContact O-N 3.37Å; I93-A96 PolarHBondContact O-N 2.9Å; I93-H97 PolarHBondContact O-CD2 3.41Å; I93-H97 PolarHBondContact O-N 3.01Å
94	T	98.2	Very high	98.2	Very high	81 Å²	81	96.2 Å²	96.2	50%	0.497	49%	0.493	S	S	.	.	H	α-helix	trans	-60.9	-47.9	177.8	-55.1	0	0	0	0	111	E90 Q91 N92 A96 H97 D98	E90-T94 PolarHBondContact O-N 2.88Å; E90-T94 PolarHBondContact O-OG1 3.38Å; Q91-T94 PolarHBondContact O-N 3.2Å; N92-T94 VanDerWaalsContact C-N 3.35Å; T94-A96 VanDerWaalsContact C-N 3.3Å; T94-A96 PolarHBondContact O-N 2.92Å; T94-H97 WeakPolarHBondContact O-CB 3.31Å; T94-H97 PolarHBondContact O-N 3.49Å; T94-H97 VanDerWaalsContact O-N 3.12Å; T94-D98 PolarHBondContact O-N 3.36Å
95	S	98.3	Very high	98.2	Very high	49 Å²	49	96.9 Å²	96.9	34%	0.343	50%	0.496	S	S	.	.	H	α-helix	trans	-60.5	-38.2	176.3	-176.4	0	0	0	0	112.7	Q91 N92 D98 K99	Q91-S95 WeakPolarHBondContact O-CB 3.5Å; Q91-S95 PolarHBondContact O-N 3.14Å; N92-S95 PolarHBondContact O-N 3.01Å; S95-D98 PolarHBondContact O-N 2.96Å; S95-K99 WeakPolarHBondContact O-CG 3.45Å; S95-K99 PolarHBondContact O-N 3.36Å
96	A	98.4	Very high	98.2	Very high	46 Å²	46	99 Å²	99	38%	0.38	50%	0.504	S	S	.	.	H	α-helix	trans	-65.5	-40.7	175.7	0	0	0	0	0	111.7	N92 I93 T94 D98 K99 I100	N92-A96 WeakPolarHBondContact O-CB 3.38Å; N92-A96 PolarHBondContact O-N 3.25Å; I93-A96 PolarHBondContact O-N 2.9Å; T94-A96 VanDerWaalsContact C-N 3.3Å; T94-A96 PolarHBondContact O-N 2.92Å; A96-D98 VanDerWaalsContact C-N 3.35Å; A96-D98 PolarHBondContact O-N 3.28Å; A96-K99 PolarHBondContact O-N 3.45Å; A96-I100 VanDerWaalsContact O-CG1 3.26Å; A96-I100 WeakPolarHBondContact O-CG1 3.48Å; A96-I100 PolarHBondContact O-N 3.44Å
97	H	98.3	Very high	98.2	Very high	121 Å²	121	95.6 Å²	95.6	56%	0.56	50%	0.497	S	S	*	.	H	α-helix	trans	-60.8	-42.9	173.9	-87	-63	0	0	0	112.4	I93 T94 I100 A101	I93-H97 PolarHBondContact O-CD2 3.41Å; I93-H97 PolarHBondContact O-N 3.01Å; T94-H97 WeakPolarHBondContact O-CB 3.31Å; T94-H97 PolarHBondContact O-N 3.49Å; T94-H97 VanDerWaalsContact O-N 3.12Å; H97-I100 PolarHBondContact O-N 2.94Å; H97-A101 PolarHBondContact O-N 2.82Å
98	D	98.3	Very high	98.1	Very high	104 Å²	104	98.6 Å²	98.6	56%	0.556	51%	0.505	S	S	*	.	H	α-helix	trans	-62.7	-45.5	176.9	-70.7	-24.3	0	0	0	111.7	T94 S95 A96 I100 A101 E102	T94-D98 PolarHBondContact O-N 3.36Å; S95-D98 PolarHBondContact O-N 2.96Å; A96-D98 VanDerWaalsContact C-N 3.35Å; A96-D98 PolarHBondContact O-N 3.28Å; D98-I100 VanDerWaalsContact C-N 3.32Å; D98-I100 PolarHBondContact O-N 3.46Å; D98-A101 WeakPolarHBondContact O-CB 3.47Å; D98-A101 PolarHBondContact O-N 3Å; D98-A101 VanDerWaalsContact O-N 3.1Å; D98-E102 PolarHBondContact O-N 3.39Å
99	K	98.3	Very high	98.1	Very high	131 Å²	131	103.4 Å²	103.4	57%	0.57	52%	0.516	S	S	*	.	H	α-helix	trans	-59.3	-42.1	174.9	-72.6	172	-176.2	172.7	0	111.9	S95 A96 A101 E102 C103	S95-K99 WeakPolarHBondContact O-CG 3.45Å; S95-K99 PolarHBondContact O-N 3.36Å; A96-K99 PolarHBondContact O-N 3.45Å; K99-A101 VanDerWaalsContact C-N 3.32Å; K99-A101 PolarHBondContact O-N 3.39Å; K99-E102 PolarHBondContact O-N 2.89Å; K99-C103 WeakPolarHBondContact O-CB 3.44Å; K99-C103 PolarHBondContact O-N 3.31Å; K99-C103 PolarHBondContact O-SG 2.91Å; K99-C103 VanDerWaalsContact O-SG 3.39Å
100	I	97.9	Very high	98	Very high	87 Å²	87	102.1 Å²	102.1	45%	0.446	52%	0.518	S	S	.	.	H	α-helix	trans	-62.1	-42.2	175.8	-70.5	165	0	0	0	110.7	A96 H97 D98 E102 K104	A96-I100 VanDerWaalsContact O-CG1 3.26Å; A96-I100 WeakPolarHBondContact O-CG1 3.48Å; A96-I100 PolarHBondContact O-N 3.44Å; H97-I100 PolarHBondContact O-N 2.94Å; D98-I100 VanDerWaalsContact C-N 3.32Å; D98-I100 PolarHBondContact O-N 3.46Å; I100-E102 VanDerWaalsContact C-N 3.34Å; I100-K104 HydrophobicContact CG2-CD 4.27Å; I100-K104 WeakPolarHBondContact O-CB 3.49Å; I100-K104 VanDerWaalsContact O-CG 3.3Å; I100-K104 WeakPolarHBondContact O-CG 3.05Å; I100-K104 PolarHBondContact O-N 3.1Å
101	A	98.3	Very high	98.1	Very high	45 Å²	45	102.8 Å²	102.8	37%	0.372	52%	0.519	S	S	.	.	H	α-helix	trans	-64.4	-39.6	178	0	0	0	0	0	111.8	H97 D98 K99 K104 K105	H97-A101 PolarHBondContact O-N 2.82Å; D98-A101 WeakPolarHBondContact O-CB 3.47Å; D98-A101 PolarHBondContact O-N 3Å; D98-A101 VanDerWaalsContact O-N 3.1Å; K99-A101 VanDerWaalsContact C-N 3.32Å; K99-A101 PolarHBondContact O-N 3.39Å; A101-K104 PolarHBondContact O-N 2.96Å; A101-K105 PolarHBondContact O-N 3.19Å
102	E	98.2	Very high	98	Very high	121 Å²	121	105.3 Å²	105.3	57%	0.565	52%	0.523	S	S	*	.	H	α-helix	trans	-66	-50.9	175.6	-173.7	158.5	-142	0	0	112	D98 K99 I100 K104 K105 E106	D98-E102 PolarHBondContact O-N 3.39Å; K99-E102 PolarHBondContact O-N 2.89Å; I100-E102 VanDerWaalsContact C-N 3.34Å; E102-K104 PolarHBondContact O-N 2.95Å; E102-K104 VanDerWaalsContact O-N 3.17Å; E102-K105 WeakPolarHBondContact O-CA 3.26Å; E102-K105 WeakPolarHBondContact O-CB 3.45Å; E102-K105 PolarHBondContact O-N 2.87Å; E102-E106 PolarHBondContact O-N 3.17Å
103	C	97.9	Very high	98	Very high	74 Å²	74	105.6 Å²	105.6	50%	0.5	52%	0.524	S	S	.	.	H	α-helix	trans	-57.1	-35	175.7	-71	0	0	0	0	112.3	K99 E106 I107	K99-C103 WeakPolarHBondContact O-CB 3.44Å; K99-C103 PolarHBondContact O-N 3.31Å; K99-C103 PolarHBondContact O-SG 2.91Å; K99-C103 VanDerWaalsContact O-SG 3.39Å; C103-E106 PolarHBondContact O-N 3.39Å; C103-I107 WeakPolarHBondContact O-CG2 3.35Å; C103-I107 PolarHBondContact O-N 2.96Å
104	K	98.2	Very high	98	Very high	132 Å²	132	109.5 Å²	109.5	57%	0.574	53%	0.533	S	S	*	.	H	α-helix	trans	-64.6	-35	173.2	-79.6	176.5	-178.9	178.3	0	112.9	I100 A101 E102 I107 Q108	I100-K104 HydrophobicContact CG2-CD 4.27Å; I100-K104 WeakPolarHBondContact O-CB 3.49Å; I100-K104 VanDerWaalsContact O-CG 3.3Å; I100-K104 WeakPolarHBondContact O-CG 3.05Å; I100-K104 PolarHBondContact O-N 3.1Å; A101-K104 PolarHBondContact O-N 2.96Å; E102-K104 PolarHBondContact O-N 2.95Å; E102-K104 VanDerWaalsContact O-N 3.17Å; K104-I107 WeakPolarHBondContact O-CG2 3.43Å; K104-Q108 WeakPolarHBondContact O-CG 3.44Å; K104-Q108 PolarHBondContact O-N 3.2Å
105	K	98.1	Very high	98	Very high	152 Å²	152	111.5 Å²	111.5	66%	0.661	54%	0.535	S	S	*	.	H	α-helix	trans	-71.5	-43.1	174.1	-69	173.4	-177.2	173.6	0	110.7	A101 E102 I107 Q108 R109	A101-K105 PolarHBondContact O-N 3.19Å; E102-K105 WeakPolarHBondContact O-CA 3.26Å; E102-K105 WeakPolarHBondContact O-CB 3.45Å; E102-K105 PolarHBondContact O-N 2.87Å; K105-I107 PolarHBondContact O-N 2.96Å; K105-Q108 PolarHBondContact O-N 3.39Å; K105-R109 PolarHBondContact O-N 3.34Å
106	E	98	Very high	97.9	Very high	118 Å²	118	112.6 Å²	112.6	55%	0.551	54%	0.536	S	S	*	.	H	α-helix	trans	-61.2	-45.3	178.5	-68.2	-171.4	145.6	0	0	112.3	E102 C103 Q108 R109 A110	E102-E106 PolarHBondContact O-N 3.17Å; C103-E106 PolarHBondContact O-N 3.39Å; E106-Q108 VanDerWaalsContact C-N 3.29Å; E106-Q108 PolarHBondContact O-N 3.01Å; E106-R109 WeakPolarHBondContact O-CB 3.19Å; E106-R109 PolarHBondContact O-N 2.88Å; E106-R109 VanDerWaalsContact O-N 3.14Å; E106-A110 WeakPolarHBondContact O-CB 3.39Å; E106-A110 PolarHBondContact O-N 3.31Å
107	I	97.9	Very high	97.9	Very high	94 Å²	94	118.7 Å²	118.7	48%	0.482	55%	0.55	S	S	.	.	H	α-helix	trans	-63.4	-36.2	177.9	-165.8	172.9	0	0	0	111.8	C103 K104 K105 A110 K111	C103-I107 WeakPolarHBondContact O-CG2 3.35Å; C103-I107 PolarHBondContact O-N 2.96Å; K104-I107 WeakPolarHBondContact O-CG2 3.43Å; K105-I107 PolarHBondContact O-N 2.96Å; I107-A110 PolarHBondContact O-N 3.25Å; I107-K111 WeakPolarHBondContact O-CB 3.3Å; I107-K111 VanDerWaalsContact O-CG 3.31Å; I107-K111 WeakPolarHBondContact O-CG 3.44Å; I107-K111 PolarHBondContact O-N 3.5Å
108	Q	97.8	Very high	97.8	Very high	117 Å²	117	118 Å²	118	55%	0.547	55%	0.547	S	S	.	.	H	α-helix	trans	-64.7	-43	174.4	-74.7	-177	0.6	0	0	111.4	K104 K105 E106 K111 R112	K104-Q108 WeakPolarHBondContact O-CG 3.44Å; K104-Q108 PolarHBondContact O-N 3.2Å; K105-Q108 PolarHBondContact O-N 3.39Å; E106-Q108 VanDerWaalsContact C-N 3.29Å; E106-Q108 PolarHBondContact O-N 3.01Å; Q108-K111 PolarHBondContact O-N 3.12Å; Q108-R112 PolarHBondContact O-N 3.39Å; Q108-R112 VanDerWaalsContact O-N 3.11Å
109	R	97.1	Very high	97.7	Very high	185 Å²	185	117.3 Å²	117.3	70%	0.698	54%	0.54	S	S	*	.	H	α-helix	trans	-62.3	-46.4	175.1	-173.1	-179.8	-179.7	179.2	0.6	111.4	K105 E106 K111 R112 I113	K105-R109 PolarHBondContact O-N 3.34Å; E106-R109 WeakPolarHBondContact O-CB 3.19Å; E106-R109 PolarHBondContact O-N 2.88Å; E106-R109 VanDerWaalsContact O-N 3.14Å; R109-K111 VanDerWaalsContact C-N 3.33Å; R109-K111 PolarHBondContact O-N 3.02Å; R109-R112 WeakPolarHBondContact O-CB 3.47Å; R109-R112 PolarHBondContact O-N 3.42Å; R109-R112 VanDerWaalsContact O-N 3.16Å; R109-I113 HydrophobicContact CG-CD1 4.17Å; R109-I113 WeakPolarHBondContact O-CG1 3.44Å; R109-I113 PolarHBondContact O-N 3.17Å
110	A	97.4	Very high	97.7	Very high	54 Å²	54	118.7 Å²	118.7	45%	0.446	54%	0.543	S	S	.	.	H	α-helix	trans	-60.7	-40.6	177.9	0	0	0	0	0	112.1	E106 I107 R112 I113 R114	E106-A110 WeakPolarHBondContact O-CB 3.39Å; E106-A110 PolarHBondContact O-N 3.31Å; I107-A110 PolarHBondContact O-N 3.25Å; A110-R112 PolarHBondContact O-N 2.88Å; A110-I113 PolarHBondContact O-N 2.92Å; A110-R114 WeakPolarHBondContact O-CB 3.44Å; A110-R114 PolarHBondContact O-N 3.36Å
111	K	97.9	Very high	97.7	Very high	141 Å²	141	118.7 Å²	118.7	61%	0.613	54%	0.544	S	S	*	.	H	α-helix	trans	-60.9	-42.8	173.8	-77.9	178.6	178.5	-175.9	0	112.3	I107 Q108 R109 R114 K115	I107-K111 WeakPolarHBondContact O-CB 3.3Å; I107-K111 VanDerWaalsContact O-CG 3.31Å; I107-K111 WeakPolarHBondContact O-CG 3.44Å; I107-K111 PolarHBondContact O-N 3.5Å; Q108-K111 PolarHBondContact O-N 3.12Å; R109-K111 VanDerWaalsContact C-N 3.33Å; R109-K111 PolarHBondContact O-N 3.02Å; K111-R114 PolarHBondContact O-N 3.5Å; K111-K115 PolarHBondContact O-N 3.37Å
112	R	97.9	Very high	97.6	Very high	174 Å²	174	119 Å²	119	66%	0.657	55%	0.546	S	S	*	.	H	α-helix	trans	-62	-47	175.3	-69.7	-178.3	-165.3	173.8	4.8	111.4	Q108 R109 A110 R114 K115 N116	Q108-R112 PolarHBondContact O-N 3.39Å; Q108-R112 VanDerWaalsContact O-N 3.11Å; R109-R112 WeakPolarHBondContact O-CB 3.47Å; R109-R112 PolarHBondContact O-N 3.42Å; R109-R112 VanDerWaalsContact O-N 3.16Å; A110-R112 PolarHBondContact O-N 2.88Å; R112-R114 VanDerWaalsContact C-N 3.3Å; R112-R114 PolarHBondContact O-N 3.14Å; R112-K115 WeakPolarHBondContact O-CB 3.42Å; R112-K115 PolarHBondContact O-N 3.12Å; R112-K115 VanDerWaalsContact O-N 3.17Å; R112-N116 PolarHBondContact O-N 3.4Å; R112-N116 PolarHBondContact O-OD1 2.96Å
113	I	97.8	Very high	97.5	Very high	101 Å²	101	118 Å²	118	52%	0.518	55%	0.545	S	S	.	.	H	α-helix	trans	-59.1	-44	177.8	-66.7	168.4	0	0	0	110.6	R109 A110 K115 N116 R117	R109-I113 HydrophobicContact CG-CD1 4.17Å; R109-I113 WeakPolarHBondContact O-CG1 3.44Å; R109-I113 PolarHBondContact O-N 3.17Å; A110-I113 PolarHBondContact O-N 2.92Å; I113-K115 PolarHBondContact O-N 3.01Å; I113-N116 PolarHBondContact O-N 3.44Å; I113-R117 WeakPolarHBondContact O-CB 3.31Å; I113-R117 PolarHBondContact O-N 2.85Å
114	R	97.9	Very high	97.4	Very high	172 Å²	172	116.6 Å²	116.6	65%	0.649	54%	0.538	S	S	*	.	H	α-helix	trans	-60.7	-43.8	176.7	-177	178.1	176.2	178.4	0.9	112	A110 K111 R112 R117 Q118	A110-R114 WeakPolarHBondContact O-CB 3.44Å; A110-R114 PolarHBondContact O-N 3.36Å; K111-R114 PolarHBondContact O-N 3.5Å; R112-R114 VanDerWaalsContact C-N 3.3Å; R112-R114 PolarHBondContact O-N 3.14Å; R114-R117 PolarHBondContact O-N 3.43Å; R114-Q118 WeakPolarHBondContact O-CG 3.49Å; R114-Q118 PolarHBondContact O-N 2.86Å
115	K	98	Very high	97.3	Very high	124 Å²	124	117.2 Å²	117.2	54%	0.539	54%	0.541	S	S	.	.	H	α-helix	trans	-60.4	-50.1	176.7	-171.7	-170.8	179.5	-151.3	0	111	K111 R112 I113 R117 Q118 E119	K111-K115 PolarHBondContact O-N 3.37Å; R112-K115 WeakPolarHBondContact O-CB 3.42Å; R112-K115 PolarHBondContact O-N 3.12Å; R112-K115 VanDerWaalsContact O-N 3.17Å; I113-K115 PolarHBondContact O-N 3.01Å; K115-R117 VanDerWaalsContact C-N 3.28Å; K115-R117 PolarHBondContact O-N 2.89Å; K115-Q118 WeakPolarHBondContact O-CB 3.43Å; K115-Q118 PolarHBondContact O-N 2.9Å; K115-Q118 VanDerWaalsContact O-N 3.1Å; K115-E119 WeakPolarHBondContact CE-OE1 3.43Å; K115-E119 IonicContact NZ-OE1 2.72Å; K115-E119 PolarHBondContact NZ-OE1 2.94Å; K115-E119 WeakPolarHBondContact O-CG 3.44Å; K115-E119 PolarHBondContact O-N 3.22Å
116	N	97.4	Very high	97.2	Very high	71 Å²	71	114.2 Å²	114.2	38%	0.38	53%	0.531	S	S	.	.	H	α-helix	trans	-59.5	-40.9	178.7	-65.1	9.3	0	0	0	111.4	R112 I113 Q118 E119 Y120	R112-N116 PolarHBondContact O-N 3.4Å; R112-N116 PolarHBondContact O-OD1 2.96Å; I113-N116 PolarHBondContact O-N 3.44Å; N116-Q118 PolarHBondContact O-N 3.36Å; N116-E119 PolarHBondContact O-N 3.22Å; N116-Y120 HydrophobicContact CB-CE2 4.15Å; N116-Y120 WeakPolarHBondContact O-CD2 3.26Å; N116-Y120 PolarHBondContact O-N 3.38Å
117	R	97.7	Very high	97	Very high	174 Å²	174	114.3 Å²	114.3	66%	0.657	53%	0.534	S	S	*	.	H	α-helix	trans	-61.9	-41.8	175.9	-172.3	171.8	175.8	170.2	-0	112.3	I113 R114 K115 E119 Y120 D121	I113-R117 WeakPolarHBondContact O-CB 3.31Å; I113-R117 PolarHBondContact O-N 2.85Å; R114-R117 PolarHBondContact O-N 3.43Å; K115-R117 VanDerWaalsContact C-N 3.28Å; K115-R117 PolarHBondContact O-N 2.89Å; R117-E119 VanDerWaalsContact C-N 3.34Å; R117-Y120 PolarHBondContact O-N 3.17Å; R117-D121 WeakPolarHBondContact O-CB 3.35Å; R117-D121 VanDerWaalsContact O-CG 3.24Å; R117-D121 PolarHBondContact O-N 2.98Å
118	Q	96.7	Very high	96.7	Very high	108 Å²	108	117.5 Å²	117.5	51%	0.505	55%	0.547	S	S	.	.	H	α-helix	trans	-64	-38.7	175	-71.7	174.9	-22.5	0	0	112.2	R114 K115 N116 D121 A122	R114-Q118 WeakPolarHBondContact O-CG 3.49Å; R114-Q118 PolarHBondContact O-N 2.86Å; K115-Q118 WeakPolarHBondContact O-CB 3.43Å; K115-Q118 PolarHBondContact O-N 2.9Å; K115-Q118 VanDerWaalsContact O-N 3.1Å; N116-Q118 PolarHBondContact O-N 3.36Å; Q118-D121 PolarHBondContact O-N 3.34Å; Q118-A122 WeakPolarHBondContact O-CB 3.35Å; Q118-A122 PolarHBondContact O-N 2.86Å
119	E	96.2	Very high	96.5	Very high	89 Å²	89	119.3 Å²	119.3	42%	0.416	56%	0.555	S	S	.	*	H	α-helix	trans	-63.9	-43.2	174.6	-69.2	172.9	-171.5	0	0	111.2	K115 N116 R117 A122 L123	K115-E119 WeakPolarHBondContact CE-OE1 3.43Å; K115-E119 IonicContact NZ-OE1 2.72Å; K115-E119 PolarHBondContact NZ-OE1 2.94Å; K115-E119 WeakPolarHBondContact O-CG 3.44Å; K115-E119 PolarHBondContact O-N 3.22Å; N116-E119 PolarHBondContact O-N 3.22Å; R117-E119 VanDerWaalsContact C-N 3.34Å; E119-A122 PolarHBondContact O-N 2.97Å; E119-L123 WeakPolarHBondContact O-CG 3.48Å; E119-L123 PolarHBondContact O-N 2.86Å
120	Y	97.2	Very high	96.2	Very high	160 Å²	160	116.6 Å²	116.6	63%	0.627	55%	0.55	S	S	*	*	H	α-helix	trans	-62.5	-45.5	173.8	-65.5	-48.8	0	0	0	112.5	N116 R117 A122 L123 A124	N116-Y120 HydrophobicContact CB-CE2 4.15Å; N116-Y120 WeakPolarHBondContact O-CD2 3.26Å; N116-Y120 PolarHBondContact O-N 3.38Å; R117-Y120 PolarHBondContact O-N 3.17Å; Y120-A122 VanDerWaalsContact C-N 3.3Å; Y120-A122 PolarHBondContact O-N 3.5Å; Y120-L123 PolarHBondContact O-N 2.97Å; Y120-A124 VanDerWaalsContact O-CB 3.31Å; Y120-A124 WeakPolarHBondContact O-CB 3.47Å; Y120-A124 PolarHBondContact O-N 3.4Å
121	D	97.4	Very high	95.9	Very high	86 Å²	86	118.5 Å²	118.5	46%	0.46	56%	0.558	S	S	.	*	H	α-helix	trans	-63.6	-37.3	178.6	-69.5	-20.9	0	0	0	111.3	R117 Q118 K125	R117-D121 WeakPolarHBondContact O-CB 3.35Å; R117-D121 VanDerWaalsContact O-CG 3.24Å; R117-D121 PolarHBondContact O-N 2.98Å; Q118-D121 PolarHBondContact O-N 3.34Å; D121-K125 WeakPolarHBondContact O-CG 3.38Å; D121-K125 PolarHBondContact O-N 3.17Å
122	A	96.8	Very high	95.7	Very high	51 Å²	51	116.2 Å²	116.2	42%	0.421	55%	0.552	S	S	.	*	H	α-helix	trans	-65.5	-46.2	175.7	0	0	0	0	0	111.8	Q118 E119 Y120 K125 I126	Q118-A122 WeakPolarHBondContact O-CB 3.35Å; Q118-A122 PolarHBondContact O-N 2.86Å; E119-A122 PolarHBondContact O-N 2.97Å; Y120-A122 VanDerWaalsContact C-N 3.3Å; Y120-A122 PolarHBondContact O-N 3.5Å; A122-K125 PolarHBondContact O-N 3.48Å; A122-I126 WeakPolarHBondContact O-CG1 3.29Å; A122-I126 PolarHBondContact O-N 2.96Å
123	L	95.8	Very high	95.5	Very high	102 Å²	102	117.3 Å²	117.3	53%	0.534	56%	0.557	S	S	.	*	H	α-helix	trans	-63.7	-42.4	175.6	-74.2	170.4	0	0	0	111.7	E119 Y120 K125 I126 I127	E119-L123 WeakPolarHBondContact O-CG 3.48Å; E119-L123 PolarHBondContact O-N 2.86Å; Y120-L123 PolarHBondContact O-N 2.97Å; L123-K125 VanDerWaalsContact C-N 3.3Å; L123-K125 PolarHBondContact O-N 3.26Å; L123-I126 PolarHBondContact O-N 3.49Å; L123-I126 VanDerWaalsContact O-N 3.12Å; L123-I127 WeakPolarHBondContact O-CG1 3.2Å; L123-I127 PolarHBondContact O-N 2.79Å
124	A	96.3	Very high	95.3	Very high	44 Å²	44	119.1 Å²	119.1	36%	0.364	56%	0.563	S	S	.	*	H	α-helix	trans	-60.3	-40.1	177.2	0	0	0	0	0	111.9	Y120 I127 Q128	Y120-A124 VanDerWaalsContact O-CB 3.31Å; Y120-A124 WeakPolarHBondContact O-CB 3.47Å; Y120-A124 PolarHBondContact O-N 3.4Å; A124-I127 PolarHBondContact O-N 3.05Å; A124-Q128 WeakPolarHBondContact O-CG 3.28Å; A124-Q128 PolarHBondContact O-N 3.02Å
125	K	96.1	Very high	95	Very high	145 Å²	145	116.7 Å²	116.7	63%	0.63	56%	0.559	S	S	*	*	H	α-helix	trans	-61.9	-40.4	173.5	-80.7	-179	179.1	-178.1	0	112.8	D121 A122 L123 Q128	D121-K125 WeakPolarHBondContact O-CG 3.38Å; D121-K125 PolarHBondContact O-N 3.17Å; A122-K125 PolarHBondContact O-N 3.48Å; L123-K125 VanDerWaalsContact C-N 3.3Å; L123-K125 PolarHBondContact O-N 3.26Å; K125-Q128 PolarHBondContact O-N 3.41Å
126	I	95.5	Very high	94.8	Very high	89 Å²	89	113.4 Å²	113.4	46%	0.456	55%	0.549	S	S	.	.	H	α-helix	trans	-66.1	-45.2	176	-64.2	166.5	0	0	0	109.7	A122 L123 Q128 Q129 H130	A122-I126 WeakPolarHBondContact O-CG1 3.29Å; A122-I126 PolarHBondContact O-N 2.96Å; L123-I126 PolarHBondContact O-N 3.49Å; L123-I126 VanDerWaalsContact O-N 3.12Å; I126-Q128 VanDerWaalsContact C-N 3.28Å; I126-Q128 PolarHBondContact O-N 3.43Å; I126-Q129 WeakPolarHBondContact O-CB 3.35Å; I126-Q129 PolarHBondContact O-N 2.95Å; I126-H130 PolarHBondContact O-CD2 2.9Å
127	I	93.6	Very high	94.7	Very high	120 Å²	120	114.3 Å²	114.3	62%	0.615	55%	0.554	S	S	*	*	H	α-helix	trans	-59.5	-40.1	178.1	-68	166.1	0	0	0	111.2	L123 A124 Q129 H130	L123-I127 WeakPolarHBondContact O-CG1 3.2Å; L123-I127 PolarHBondContact O-N 2.79Å; A124-I127 PolarHBondContact O-N 3.05Å; I127-Q129 PolarHBondContact O-N 3.37Å; I127-H130 WeakPolarHBondContact O-CB 3.45Å; I127-H130 PolarHBondContact O-N 3.43Å
128	Q	93	Very high	94.6	Very high	161 Å²	161	113.1 Å²	113.1	75%	0.752	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	-16.7	176.7	-83	178.1	-12.6	0	0	114.6	A124 K125 I126 H130	A124-Q128 WeakPolarHBondContact O-CG 3.28Å; A124-Q128 PolarHBondContact O-N 3.02Å; K125-Q128 PolarHBondContact O-N 3.41Å; I126-Q128 VanDerWaalsContact C-N 3.28Å; I126-Q128 PolarHBondContact O-N 3.43Å; Q128-H130 VanDerWaalsContact C-N 3.25Å
129	Q	93.4	Very high	94.4	Very high	154 Å²	154	114.1 Å²	114.1	72%	0.72	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	-17.6	173.2	-63.4	174.3	3.7	0	0	112.2	I126 I127	I126-Q129 WeakPolarHBondContact O-CB 3.35Å; I126-Q129 PolarHBondContact O-N 2.95Å; I127-Q129 PolarHBondContact O-N 3.37Å
130	H	91.2	Very high	94.4	Very high	128 Å²	128	115.1 Å²	115.1	59%	0.593	57%	0.565	S	S	*	*	S	Bend	trans	-91.5	149.2	177.3	-66.7	-77.4	0	0	0	110.9	I126 I127 Q128	I126-H130 PolarHBondContact O-CD2 2.9Å; I127-H130 WeakPolarHBondContact O-CB 3.45Å; I127-H130 PolarHBondContact O-N 3.43Å; Q128-H130 VanDerWaalsContact C-N 3.25Å
131	P	91.1	Very high	94.3	Very high	95 Å²	95	112.6 Å²	112.6	62%	0.617	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-63.1	156.7	178.6	27.6	-35.1	0	0	0	111.2	R133	P131-R133 PolarHBondContact O-N 3.48Å
132	D	93.2	Very high	94.2	Very high	92 Å²	92	111.2 Å²	111.2	49%	0.492	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-62	138.7	179.8	-178.4	50.2	0	0	0	111	H134 E135 T136	D132-H134 VanDerWaalsContact C-N 3.29Å; D132-H134 PolarHBondContact O-N 3.27Å; D132-H134 VanDerWaalsContact OD2-CB 3.26Å; D132-H134 WeakPolarHBondContact OD2-CB 3.33Å; D132-H134 PolarHBondContact OD2-N 2.9Å; D132-H134 VanDerWaalsContact OD2-N 3.12Å; D132-E135 HydrophobicContact CB-CB 4.39Å; D132-E135 HydrophobicContact CB-CG 4.26Å; D132-E135 PolarHBondContact O-N 3.21Å; D132-E135 PolarHBondContact OD2-N 3.25Å; D132-T136 WeakPolarHBondContact O-CB 3.24Å; D132-T136 PolarHBondContact O-N 2.83Å; D132-T136 PolarHBondContact O-OG1 3.32Å
133	R	92.7	Very high	94.2	Very high	198 Å²	198	114 Å²	114	75%	0.747	57%	0.567	S	S	*	*	H	α-helix	trans	-63.8	-39.1	-176.3	-178.4	179.6	177.8	178.9	0	111	P131 T136 L137	P131-R133 PolarHBondContact O-N 3.48Å; R133-T136 PolarHBondContact O-N 2.88Å; R133-L137 HydrophobicContact CG-CD1 4.12Å; R133-L137 WeakPolarHBondContact O-CB 3.34Å; R133-L137 WeakPolarHBondContact O-CG 3.49Å; R133-L137 PolarHBondContact O-N 3.49Å
134	H	93.3	Very high	94.2	Very high	138 Å²	138	112.8 Å²	112.8	64%	0.639	56%	0.561	S	S	*	*	H	α-helix	trans	-69.8	-42.8	-176.9	-171	66.8	0	0	0	111.1	D132 L137 K138	D132-H134 VanDerWaalsContact C-N 3.29Å; D132-H134 PolarHBondContact O-N 3.27Å; D132-H134 VanDerWaalsContact OD2-CB 3.26Å; D132-H134 WeakPolarHBondContact OD2-CB 3.33Å; D132-H134 PolarHBondContact OD2-N 2.9Å; D132-H134 VanDerWaalsContact OD2-N 3.12Å; H134-L137 PolarHBondContact O-N 3.27Å; H134-K138 PolarHBondContact O-N 3.16Å
135	E	92.4	Very high	94.2	Very high	121 Å²	121	116.4 Å²	116.4	57%	0.565	57%	0.569	S	S	*	*	H	α-helix	trans	-60.1	-46.1	173.4	-68	-171.1	161.9	0	0	112	D132 L137 K138 Q139	D132-E135 HydrophobicContact CB-CB 4.39Å; D132-E135 HydrophobicContact CB-CG 4.26Å; D132-E135 PolarHBondContact O-N 3.21Å; D132-E135 PolarHBondContact OD2-N 3.25Å; E135-L137 VanDerWaalsContact C-N 3.34Å; E135-L137 PolarHBondContact O-N 3.25Å; E135-K138 PolarHBondContact O-N 2.88Å; E135-Q139 WeakPolarHBondContact O-CG 3.26Å; E135-Q139 PolarHBondContact O-N 3.04Å
136	T	93.9	Very high	94.2	Very high	55 Å²	55	115.1 Å²	115.1	34%	0.337	57%	0.565	S	S	.	*	H	α-helix	trans	-61.9	-41.6	179.5	-49.3	0	0	0	0	111.4	D132 R133 K138 Q139 L140	D132-T136 WeakPolarHBondContact O-CB 3.24Å; D132-T136 PolarHBondContact O-N 2.83Å; D132-T136 PolarHBondContact O-OG1 3.32Å; R133-T136 PolarHBondContact O-N 2.88Å; T136-K138 PolarHBondContact O-N 3.07Å; T136-Q139 PolarHBondContact O-N 3.48Å; T136-L140 WeakPolarHBondContact O-CB 3.28Å; T136-L140 PolarHBondContact O-N 3.17Å
137	L	95.1	Very high	94.2	Very high	91 Å²	91	116 Å²	116	48%	0.476	57%	0.57	S	S	.	*	H	α-helix	trans	-63.3	-40.7	175.9	-78	170.2	0	0	0	112.4	R133 H134 E135 L140 E141	R133-L137 HydrophobicContact CG-CD1 4.12Å; R133-L137 WeakPolarHBondContact O-CB 3.34Å; R133-L137 WeakPolarHBondContact O-CG 3.49Å; R133-L137 PolarHBondContact O-N 3.49Å; H134-L137 PolarHBondContact O-N 3.27Å; E135-L137 VanDerWaalsContact C-N 3.34Å; E135-L137 PolarHBondContact O-N 3.25Å; L137-L140 WeakPolarHBondContact O-CB 3.39Å; L137-L140 PolarHBondContact O-N 2.87Å; L137-E141 PolarHBondContact O-N 3.38Å
138	K	95.1	Very high	94.3	Very high	148 Å²	148	115.9 Å²	115.9	64%	0.643	57%	0.567	S	S	*	*	H	α-helix	trans	-64.7	-40.6	177.9	-171.4	179.6	179.9	-178.4	0	111.8	H134 E135 T136 L140 E141 A142	H134-K138 PolarHBondContact O-N 3.16Å; E135-K138 PolarHBondContact O-N 2.88Å; T136-K138 PolarHBondContact O-N 3.07Å; K138-L140 VanDerWaalsContact C-N 3.33Å; K138-E141 PolarHBondContact O-N 3.16Å; K138-A142 PolarHBondContact O-N 3.15Å
139	Q	94.2	Very high	94.4	Very high	129 Å²	129	113.9 Å²	113.9	60%	0.603	56%	0.557	S	S	*	*	H	α-helix	trans	-63.7	-40.6	173.9	-70.5	176.5	-0.8	0	0	111.6	E135 T136 A142 L143	E135-Q139 WeakPolarHBondContact O-CG 3.26Å; E135-Q139 PolarHBondContact O-N 3.04Å; T136-Q139 PolarHBondContact O-N 3.48Å; Q139-A142 PolarHBondContact O-N 3.34Å; Q139-L143 PolarHBondContact O-N 3.14Å
140	L	94.8	Very high	94.5	Very high	110 Å²	110	111.1 Å²	111.1	58%	0.576	55%	0.547	S	S	*	.	H	α-helix	trans	-62.9	-44.2	177.9	-143	162.1	0	0	0	111.4	T136 L137 K138 A142 L143 D144	T136-L140 WeakPolarHBondContact O-CB 3.28Å; T136-L140 PolarHBondContact O-N 3.17Å; L137-L140 WeakPolarHBondContact O-CB 3.39Å; L137-L140 PolarHBondContact O-N 2.87Å; K138-L140 VanDerWaalsContact C-N 3.33Å; L140-A142 VanDerWaalsContact C-N 3.34Å; L140-A142 PolarHBondContact O-N 2.96Å; L140-L143 PolarHBondContact O-N 3.4Å; L140-D144 WeakPolarHBondContact O-CB 3.48Å; L140-D144 PolarHBondContact O-N 3.45Å
141	E	95.9	Very high	94.8	Very high	108 Å²	108	107.8 Å²	107.8	51%	0.505	54%	0.538	S	S	.	.	H	α-helix	trans	-64	-37.7	176.1	-163.9	-166.5	151.3	0	0	112.3	L137 K138 K145	L137-E141 PolarHBondContact O-N 3.38Å; K138-E141 PolarHBondContact O-N 3.16Å; E141-K145 WeakPolarHBondContact O-CG 3.45Å; E141-K145 PolarHBondContact O-N 2.91Å; E141-K145 VanDerWaalsContact O-N 3.14Å; E141-K145 WeakPolarHBondContact OE1-CE 3.44Å; E141-K145 IonicContact OE1-NZ 2.74Å; E141-K145 PolarHBondContact OE1-NZ 2.94Å
142	A	95.6	Very high	95	Very high	57 Å²	57	109.2 Å²	109.2	47%	0.471	54%	0.536	S	S	.	.	H	α-helix	trans	-65.8	-45.3	175.2	0	0	0	0	0	111.8	K138 Q139 L140 D144 K145 E146	K138-A142 PolarHBondContact O-N 3.15Å; Q139-A142 PolarHBondContact O-N 3.34Å; L140-A142 VanDerWaalsContact C-N 3.34Å; L140-A142 PolarHBondContact O-N 2.96Å; A142-D144 VanDerWaalsContact C-N 3.32Å; A142-D144 PolarHBondContact O-N 3.34Å; A142-K145 PolarHBondContact O-N 3.32Å; A142-E146 PolarHBondContact O-N 3.09Å
143	L	95.7	Very high	95.1	Very high	108 Å²	108	108.5 Å²	108.5	57%	0.565	53%	0.532	S	S	*	.	H	α-helix	trans	-62	-39.5	176.2	-120.9	79.5	0	0	0	112	Q139 L140 E146 L147	Q139-L143 PolarHBondContact O-N 3.14Å; L140-L143 PolarHBondContact O-N 3.4Å; L143-E146 PolarHBondContact O-N 2.88Å; L143-L147 WeakPolarHBondContact O-CB 3.23Å; L143-L147 PolarHBondContact O-N 3.49Å
144	D	96.1	Very high	95.2	Very high	78 Å²	78	105.7 Å²	105.7	42%	0.417	53%	0.525	S	S	.	.	H	α-helix	trans	-64.4	-42.3	178.6	-169.2	55	0	0	0	111.5	L140 A142 E146 L147 Q148	L140-D144 WeakPolarHBondContact O-CB 3.48Å; L140-D144 PolarHBondContact O-N 3.45Å; A142-D144 VanDerWaalsContact C-N 3.32Å; A142-D144 PolarHBondContact O-N 3.34Å; D144-E146 VanDerWaalsContact C-N 3.32Å; D144-E146 PolarHBondContact O-N 3.4Å; D144-L147 PolarHBondContact O-N 2.66Å; D144-Q148 VanDerWaalsContact O-CG 3.3Å; D144-Q148 WeakPolarHBondContact O-CG 3.49Å; D144-Q148 PolarHBondContact O-N 2.95Å; D144-Q148 PolarHBondContact OD2-NE2 3.24Å
145	K	95.8	Very high	95.4	Very high	120 Å²	120	104.8 Å²	104.8	52%	0.522	52%	0.521	S	S	.	.	H	α-helix	trans	-61.4	-41	173.1	-73.2	173.4	-173.5	163.8	0	112	E141 A142 Q148 H149	E141-K145 WeakPolarHBondContact O-CG 3.45Å; E141-K145 PolarHBondContact O-N 2.91Å; E141-K145 VanDerWaalsContact O-N 3.14Å; E141-K145 WeakPolarHBondContact OE1-CE 3.44Å; E141-K145 IonicContact OE1-NZ 2.74Å; E141-K145 PolarHBondContact OE1-NZ 2.94Å; A142-K145 PolarHBondContact O-N 3.32Å; K145-Q148 PolarHBondContact O-N 3.37Å; K145-H149 WeakPolarHBondContact O-CB 3.35Å; K145-H149 PolarHBondContact O-N 3.33Å
146	E	96	Very high	95.5	Very high	118 Å²	118	102.7 Å²	102.7	55%	0.551	51%	0.514	S	S	*	.	H	α-helix	trans	-66.8	-41.3	177.8	-168.9	171.9	-168.1	0	0	111.8	A142 L143 D144 H149 L150	A142-E146 PolarHBondContact O-N 3.09Å; L143-E146 PolarHBondContact O-N 2.88Å; D144-E146 VanDerWaalsContact C-N 3.32Å; D144-E146 PolarHBondContact O-N 3.4Å; E146-H149 PolarHBondContact O-N 3.44Å; E146-L150 HydrophobicContact CG-CD1 4.29Å; E146-L150 WeakPolarHBondContact O-CB 3.49Å; E146-L150 WeakPolarHBondContact O-CG 3.41Å; E146-L150 PolarHBondContact O-N 2.95Å
147	L	95.6	Very high	95.6	Very high	108 Å²	108	104 Å²	104	57%	0.565	52%	0.522	S	S	*	.	H	α-helix	trans	-60.8	-46.2	173.6	-84.9	168.8	0	0	0	112.1	L143 D144 H149 L150 S151	L143-L147 WeakPolarHBondContact O-CB 3.23Å; L143-L147 PolarHBondContact O-N 3.49Å; D144-L147 PolarHBondContact O-N 2.66Å; L147-H149 VanDerWaalsContact C-N 3.31Å; L147-H149 PolarHBondContact O-N 3.19Å; L147-L150 PolarHBondContact O-N 3.13Å; L147-S151 WeakPolarHBondContact O-CB 3.5Å; L147-S151 PolarHBondContact O-N 3.47Å
148	Q	96.1	Very high	95.6	Very high	117 Å²	117	103.4 Å²	103.4	55%	0.547	52%	0.519	S	S	.	.	H	α-helix	trans	-60.1	-43.4	176.2	-72	175.2	17.2	0	0	111.2	D144 K145 S151 H152	D144-Q148 VanDerWaalsContact O-CG 3.3Å; D144-Q148 WeakPolarHBondContact O-CG 3.49Å; D144-Q148 PolarHBondContact O-N 2.95Å; D144-Q148 PolarHBondContact OD2-NE2 3.24Å; K145-Q148 PolarHBondContact O-N 3.37Å; Q148-S151 PolarHBondContact O-N 2.99Å; Q148-H152 PolarHBondContact O-N 3.11Å
149	H	95.6	Very high	95.6	Very high	118 Å²	118	99.2 Å²	99.2	55%	0.546	51%	0.511	S	S	.	.	H	α-helix	trans	-63.2	-46.3	176.8	178.2	-90.7	0	0	0	112.3	K145 E146 L147 S151 H152 I153	K145-H149 WeakPolarHBondContact O-CB 3.35Å; K145-H149 PolarHBondContact O-N 3.33Å; E146-H149 PolarHBondContact O-N 3.44Å; L147-H149 VanDerWaalsContact C-N 3.31Å; L147-H149 PolarHBondContact O-N 3.19Å; H149-S151 VanDerWaalsContact C-N 3.33Å; H149-S151 PolarHBondContact O-N 3.22Å; H149-H152 PolarHBondContact O-N 3.38Å; H149-I153 WeakPolarHBondContact CE1-CD1 3.34Å; H149-I153 WeakPolarHBondContact O-CG1 3.49Å; H149-I153 PolarHBondContact O-N 2.98Å
150	L	95.4	Very high	95.7	Very high	96 Å²	96	99.1 Å²	99.1	50%	0.503	51%	0.509	S	S	.	.	H	α-helix	trans	-63.5	-37.8	176.2	-75.7	170.3	0	0	0	112.2	E146 L147 I153 K154	E146-L150 HydrophobicContact CG-CD1 4.29Å; E146-L150 WeakPolarHBondContact O-CB 3.49Å; E146-L150 WeakPolarHBondContact O-CG 3.41Å; E146-L150 PolarHBondContact O-N 2.95Å; L147-L150 PolarHBondContact O-N 3.13Å; L150-I153 PolarHBondContact O-N 3.22Å; L150-K154 WeakPolarHBondContact O-CB 3.1Å; L150-K154 PolarHBondContact O-N 3.14Å
151	S	96.4	Very high	95.8	Very high	59 Å²	59	98.1 Å²	98.1	41%	0.413	50%	0.504	S	S	.	.	H	α-helix	trans	-60.4	-46.7	174.1	-166.8	0	0	0	0	111.1	L147 Q148 H149 I153 K154 E155	L147-S151 WeakPolarHBondContact O-CB 3.5Å; L147-S151 PolarHBondContact O-N 3.47Å; Q148-S151 PolarHBondContact O-N 2.99Å; H149-S151 VanDerWaalsContact C-N 3.33Å; H149-S151 PolarHBondContact O-N 3.22Å; S151-I153 VanDerWaalsContact C-N 3.33Å; S151-I153 PolarHBondContact O-N 2.96Å; S151-K154 WeakPolarHBondContact O-CB 3.39Å; S151-K154 PolarHBondContact O-N 3.43Å; S151-E155 WeakPolarHBondContact O-CG 3.43Å; S151-E155 PolarHBondContact O-N 3.06Å
152	H	96.1	Very high	95.7	Very high	125 Å²	125	97 Å²	97	58%	0.579	50%	0.498	S	S	*	.	H	α-helix	trans	-64.2	-37.9	177.4	-171.5	-62	0	0	0	112.2	Q148 H149 N156	Q148-H152 PolarHBondContact O-N 3.11Å; H149-H152 PolarHBondContact O-N 3.38Å; H152-N156 WeakPolarHBondContact O-CB 3.31Å; H152-N156 PolarHBondContact O-N 3.35Å
153	I	95.6	Very high	95.7	Very high	77 Å²	77	98.8 Å²	98.8	40%	0.395	50%	0.5	S	S	.	.	H	α-helix	trans	-62.9	-47	173.7	-71.3	175.8	0	0	0	110.3	H149 L150 S151 E155 N156 V157	H149-I153 WeakPolarHBondContact CE1-CD1 3.34Å; H149-I153 WeakPolarHBondContact O-CG1 3.49Å; H149-I153 PolarHBondContact O-N 2.98Å; L150-I153 PolarHBondContact O-N 3.22Å; S151-I153 VanDerWaalsContact C-N 3.33Å; S151-I153 PolarHBondContact O-N 2.96Å; I153-E155 PolarHBondContact O-N 2.96Å; I153-N156 PolarHBondContact O-N 3.38Å; I153-V157 HydrophobicContact CG2-CG2 4.25Å; I153-V157 WeakPolarHBondContact O-CG2 3.39Å; I153-V157 PolarHBondContact O-N 3.22Å
154	K	95.3	Very high	95.7	Very high	138 Å²	138	101.1 Å²	101.1	60%	0.6	50%	0.501	S	S	*	.	H	α-helix	trans	-57.1	-50.2	178.5	-177.4	-172.6	173	-171.2	0	110.8	L150 S151 N156 V157 D158	L150-K154 WeakPolarHBondContact O-CB 3.1Å; L150-K154 PolarHBondContact O-N 3.14Å; S151-K154 WeakPolarHBondContact O-CB 3.39Å; S151-K154 PolarHBondContact O-N 3.43Å; K154-N156 VanDerWaalsContact C-N 3.29Å; K154-N156 PolarHBondContact O-N 3.43Å; K154-V157 PolarHBondContact O-N 3.39Å; K154-V157 VanDerWaalsContact O-N 3.15Å; K154-D158 WeakPolarHBondContact O-CB 3.49Å; K154-D158 PolarHBondContact O-N 2.97Å
155	E	96.3	Very high	95.6	Very high	120 Å²	120	102.5 Å²	102.5	56%	0.561	50%	0.503	S	S	*	.	H	α-helix	trans	-57.2	-41.8	176.9	-74.7	173.6	-167.5	0	0	112.2	S151 I153 D158 A159	S151-E155 WeakPolarHBondContact O-CG 3.43Å; S151-E155 PolarHBondContact O-N 3.06Å; I153-E155 PolarHBondContact O-N 2.96Å; E155-D158 PolarHBondContact O-N 3.49Å; E155-A159 VanDerWaalsContact O-CB 3.32Å; E155-A159 WeakPolarHBondContact O-CB 3.48Å; E155-A159 PolarHBondContact O-N 3.49Å
156	N	95.5	Very high	95.5	Very high	77 Å²	77	103.3 Å²	103.3	41%	0.412	51%	0.507	S	S	.	.	H	α-helix	trans	-67.8	-39.1	177.9	-168.1	11.7	0	0	0	112.3	H152 I153 K154 K160	H152-N156 WeakPolarHBondContact O-CB 3.31Å; H152-N156 PolarHBondContact O-N 3.35Å; I153-N156 PolarHBondContact O-N 3.38Å; K154-N156 VanDerWaalsContact C-N 3.29Å; K154-N156 PolarHBondContact O-N 3.43Å; N156-K160 WeakPolarHBondContact O-CG 3.25Å; N156-K160 PolarHBondContact O-N 3.07Å
157	V	96.1	Very high	95.3	Very high	83 Å²	83	101.9 Å²	101.9	50%	0.503	50%	0.5	S	S	.	.	H	α-helix	trans	-67.2	-44.2	175.3	172	0	0	0	0	110.7	I153 K154 A159 K160 L161	I153-V157 HydrophobicContact CG2-CG2 4.25Å; I153-V157 WeakPolarHBondContact O-CG2 3.39Å; I153-V157 PolarHBondContact O-N 3.22Å; K154-V157 PolarHBondContact O-N 3.39Å; K154-V157 VanDerWaalsContact O-N 3.15Å; V157-A159 VanDerWaalsContact C-N 3.33Å; V157-A159 PolarHBondContact O-N 2.88Å; V157-K160 PolarHBondContact O-N 2.95Å; V157-L161 WeakPolarHBondContact O-CB 3.46Å; V157-L161 PolarHBondContact O-N 3.33Å
158	D	95.1	Very high	95.3	Very high	78 Å²	78	103.7 Å²	103.7	42%	0.417	50%	0.504	S	S	.	.	H	α-helix	trans	-60.7	-42.8	175.9	-75	-22.1	0	0	0	110.7	K154 E155 K160 L161 E162	K154-D158 WeakPolarHBondContact O-CB 3.49Å; K154-D158 PolarHBondContact O-N 2.97Å; E155-D158 PolarHBondContact O-N 3.49Å; D158-K160 PolarHBondContact O-N 2.95Å; D158-L161 WeakPolarHBondContact O-CB 3.24Å; D158-L161 PolarHBondContact O-N 3.47Å; D158-E162 WeakPolarHBondContact O-CG 3.35Å; D158-E162 PolarHBondContact O-N 2.67Å
159	A	95.1	Very high	95.2	Very high	59 Å²	59	104.2 Å²	104.2	49%	0.488	51%	0.506	S	S	.	.	H	α-helix	trans	-62.1	-41.8	174.8	0	0	0	0	0	112.6	E155 V157 E162 L163	E155-A159 VanDerWaalsContact O-CB 3.32Å; E155-A159 WeakPolarHBondContact O-CB 3.48Å; E155-A159 PolarHBondContact O-N 3.49Å; V157-A159 VanDerWaalsContact C-N 3.33Å; V157-A159 PolarHBondContact O-N 2.88Å; A159-E162 PolarHBondContact O-N 3.11Å; A159-L163 WeakPolarHBondContact O-CB 3.41Å; A159-L163 PolarHBondContact O-N 2.88Å
160	K	95.8	Very high	95.1	Very high	127 Å²	127	103 Å²	103	55%	0.552	51%	0.506	S	S	*	.	H	α-helix	trans	-64.6	-41.9	174.6	-75.5	175.8	-176.2	178.7	0	111.7	N156 V157 D158 L163 R164	N156-K160 WeakPolarHBondContact O-CG 3.25Å; N156-K160 PolarHBondContact O-N 3.07Å; V157-K160 PolarHBondContact O-N 2.95Å; D158-K160 PolarHBondContact O-N 2.95Å; K160-L163 PolarHBondContact O-N 2.79Å; K160-R164 WeakPolarHBondContact O-CG 3.46Å; K160-R164 PolarHBondContact O-N 2.96Å
161	L	95.9	Very high	95	Very high	89 Å²	89	102.9 Å²	102.9	47%	0.466	51%	0.506	S	S	.	.	H	α-helix	trans	-60.6	-47.7	176.8	-171.3	96	0	0	0	110.5	V157 D158 L163 R164 K165	V157-L161 WeakPolarHBondContact O-CB 3.46Å; V157-L161 PolarHBondContact O-N 3.33Å; D158-L161 WeakPolarHBondContact O-CB 3.24Å; D158-L161 PolarHBondContact O-N 3.47Å; L161-L163 VanDerWaalsContact C-N 3.35Å; L161-L163 PolarHBondContact O-N 3.49Å; L161-R164 PolarHBondContact O-N 3.47Å; L161-K165 WeakPolarHBondContact O-CG 3.33Å; L161-K165 PolarHBondContact O-N 3.28Å
162	E	95.3	Very high	94.9	Very high	84 Å²	84	104.7 Å²	104.7	39%	0.393	51%	0.51	S	S	.	.	H	α-helix	trans	-61.8	-40.5	176.8	-76.3	-56.1	132.2	0	0	112.4	D158 A159 R164 K165 K166	D158-E162 WeakPolarHBondContact O-CG 3.35Å; D158-E162 PolarHBondContact O-N 2.67Å; A159-E162 PolarHBondContact O-N 3.11Å; E162-R164 VanDerWaalsContact C-N 3.35Å; E162-R164 PolarHBondContact O-N 3.5Å; E162-K165 PolarHBondContact O-N 2.6Å; E162-K165 WeakPolarHBondContact OE1-CD 3.4Å; E162-K165 IonicContact OE1-NZ 3.41Å; E162-K165 PolarHBondContact OE1-NZ 3.04Å; E162-K166 WeakPolarHBondContact O-CG 3.45Å; E162-K166 PolarHBondContact O-N 3.02Å
163	L	95.6	Very high	94.7	Very high	96 Å²	96	100.8 Å²	100.8	50%	0.503	50%	0.496	S	S	.	.	H	α-helix	trans	-60.6	-44.4	173.1	-177.9	65.7	0	0	0	111.6	A159 K160 L161 K166 Q167	A159-L163 WeakPolarHBondContact O-CB 3.41Å; A159-L163 PolarHBondContact O-N 2.88Å; K160-L163 PolarHBondContact O-N 2.79Å; L161-L163 VanDerWaalsContact C-N 3.35Å; L161-L163 PolarHBondContact O-N 3.49Å; L163-K166 PolarHBondContact O-N 3.3Å; L163-Q167 WeakPolarHBondContact O-CG 3.24Å; L163-Q167 PolarHBondContact O-N 3.45Å
164	R	94.1	Very high	94.4	Very high	156 Å²	156	99.7 Å²	99.7	59%	0.589	49%	0.492	S	S	*	.	H	α-helix	trans	-64.2	-42.3	176.7	-68	-55.5	-172.5	179.8	4.2	111.8	K160 L161 E162 K166 Q167 F168	K160-R164 WeakPolarHBondContact O-CG 3.46Å; K160-R164 PolarHBondContact O-N 2.96Å; L161-R164 PolarHBondContact O-N 3.47Å; E162-R164 VanDerWaalsContact C-N 3.35Å; E162-R164 PolarHBondContact O-N 3.5Å; R164-K166 VanDerWaalsContact C-N 3.32Å; R164-K166 PolarHBondContact O-N 3.38Å; R164-Q167 PolarHBondContact O-N 2.93Å; R164-F168 VanDerWaalsContact O-CD2 3.28Å; R164-F168 WeakPolarHBondContact O-CD2 3.5Å; R164-F168 PolarHBondContact O-N 3.19Å
165	K	94.1	Very high	94.2	Very high	108 Å²	108	96.8 Å²	96.8	47%	0.47	48%	0.483	S	S	.	.	H	α-helix	trans	-56.9	-45.3	173.6	-72.7	177.9	-173.8	169.1	0	111.5	L161 E162 F168 H169	L161-K165 WeakPolarHBondContact O-CG 3.33Å; L161-K165 PolarHBondContact O-N 3.28Å; E162-K165 PolarHBondContact O-N 2.6Å; E162-K165 WeakPolarHBondContact OE1-CD 3.4Å; E162-K165 IonicContact OE1-NZ 3.41Å; E162-K165 PolarHBondContact OE1-NZ 3.04Å; K165-F168 PolarHBondContact O-N 2.97Å; K165-H169 WeakPolarHBondContact O-CB 3.47Å; K165-H169 PolarHBondContact O-N 3.48Å
166	K	94.4	Very high	93.8	Very high	136 Å²	136	96 Å²	96	59%	0.591	48%	0.479	S	S	*	.	H	α-helix	trans	-61.9	-44.7	175.8	-70.7	174.3	-175.9	179	0	112.1	E162 L163 R164 H169 V170	E162-K166 WeakPolarHBondContact O-CG 3.45Å; E162-K166 PolarHBondContact O-N 3.02Å; L163-K166 PolarHBondContact O-N 3.3Å; R164-K166 VanDerWaalsContact C-N 3.32Å; R164-K166 PolarHBondContact O-N 3.38Å; K166-H169 WeakPolarHBondContact O-CB 3.35Å; K166-H169 PolarHBondContact O-N 2.96Å; K166-V170 WeakPolarHBondContact O-CG2 3.3Å; K166-V170 PolarHBondContact O-N 3.46Å
167	Q	93	Very high	93.4	Very high	89 Å²	89	97.4 Å²	97.4	42%	0.416	48%	0.483	S	S	.	.	H	α-helix	trans	-61.2	-43.6	176	-72.5	174.9	-14.6	0	0	112.3	L163 R164 H169 V170 L171	L163-Q167 WeakPolarHBondContact O-CG 3.24Å; L163-Q167 PolarHBondContact O-N 3.45Å; R164-Q167 PolarHBondContact O-N 2.93Å; Q167-H169 VanDerWaalsContact C-N 3.33Å; Q167-V170 PolarHBondContact O-N 2.93Å; Q167-L171 PolarHBondContact O-N 2.84Å
168	F	94.4	Very high	92.9	Very high	146 Å²	146	98.7 Å²	98.7	64%	0.64	49%	0.486	S	S	*	.	H	α-helix	trans	-62.9	-39.4	174.6	-89.1	-69	0	0	0	112.2	R164 K165 L171 L172	R164-F168 VanDerWaalsContact O-CD2 3.28Å; R164-F168 WeakPolarHBondContact O-CD2 3.5Å; R164-F168 PolarHBondContact O-N 3.19Å; K165-F168 PolarHBondContact O-N 2.97Å; F168-L171 PolarHBondContact O-N 2.92Å; F168-L172 WeakPolarHBondContact O-CB 3.39Å; F168-L172 PolarHBondContact O-N 2.92Å
169	H	93.6	Very high	92.4	Very high	128 Å²	128	100.2 Å²	100.2	59%	0.593	49%	0.491	S	S	*	.	H	α-helix	trans	-62	-47	176.6	-170.3	66.3	0	0	0	111.4	K165 K166 Q167 L171 L172 T173	K165-H169 WeakPolarHBondContact O-CB 3.47Å; K165-H169 PolarHBondContact O-N 3.48Å; K166-H169 WeakPolarHBondContact O-CB 3.35Å; K166-H169 PolarHBondContact O-N 2.96Å; Q167-H169 VanDerWaalsContact C-N 3.33Å; H169-L171 VanDerWaalsContact C-N 3.34Å; H169-L171 PolarHBondContact O-N 3.44Å; H169-L172 WeakPolarHBondContact O-CB 3.33Å; H169-L172 PolarHBondContact O-N 2.74Å; H169-T173 PolarHBondContact O-N 3.12Å; H169-T173 PolarHBondContact O-OG1 3.37Å; H169-T173 VanDerWaalsContact O-OG1 3.04Å
170	V	94.9	Very high	91.8	Very high	91 Å²	91	103 Å²	103	55%	0.552	49%	0.494	S	S	*	.	H	α-helix	trans	-57.5	-47	174.8	173.4	0	0	0	0	111.1	K166 Q167 L172 T173 T174	K166-V170 WeakPolarHBondContact O-CG2 3.3Å; K166-V170 PolarHBondContact O-N 3.46Å; Q167-V170 PolarHBondContact O-N 2.93Å; V170-L172 VanDerWaalsContact C-N 3.33Å; V170-L172 PolarHBondContact O-N 3.16Å; V170-T173 PolarHBondContact O-N 3.01Å; V170-T174 WeakPolarHBondContact O-CG2 3.4Å; V170-T174 PolarHBondContact O-N 3.44Å; V170-T174 PolarHBondContact O-OG1 3.46Å
171	L	93.3	Very high	91.2	Very high	94 Å²	94	100.3 Å²	100.3	49%	0.492	49%	0.488	S	S	.	.	H	α-helix	trans	-58.8	-45.3	177	-176.1	71	0	0	0	111.5	Q167 F168 H169 T173 T174 I175	Q167-L171 PolarHBondContact O-N 2.84Å; F168-L171 PolarHBondContact O-N 2.92Å; H169-L171 VanDerWaalsContact C-N 3.34Å; H169-L171 PolarHBondContact O-N 3.44Å; L171-T173 VanDerWaalsContact C-N 3.34Å; L171-T173 PolarHBondContact O-N 2.76Å; L171-T174 WeakPolarHBondContact CA-OG1 3.37Å; L171-T174 PolarHBondContact O-N 3.49Å; L171-T174 PolarHBondContact O-OG1 2.92Å; L171-I175 HydrophobicContact CG-CD1 4.07Å; L171-I175 WeakPolarHBondContact O-CG1 3.45Å; L171-I175 PolarHBondContact O-N 3.23Å
172	L	92.8	Very high	90.4	Very high	97 Å²	97	101.3 Å²	101.3	51%	0.508	49%	0.494	S	S	.	.	H	α-helix	trans	-61.2	-43.2	178.8	-154.2	88.2	0	0	0	111.4	F168 H169 V170 I175 Q176	F168-L172 WeakPolarHBondContact O-CB 3.39Å; F168-L172 PolarHBondContact O-N 2.92Å; H169-L172 WeakPolarHBondContact O-CB 3.33Å; H169-L172 PolarHBondContact O-N 2.74Å; V170-L172 VanDerWaalsContact C-N 3.33Å; V170-L172 PolarHBondContact O-N 3.16Å; L172-I175 PolarHBondContact O-N 2.99Å; L172-Q176 WeakPolarHBondContact O-CG 3.39Å; L172-Q176 PolarHBondContact O-N 3.13Å
173	T	91.9	Very high	89.5	Confident	44 Å²	44	102.5 Å²	102.5	27%	0.27	50%	0.499	S	S	.	.	H	α-helix	trans	-62.1	-45.1	175.3	-54.1	0	0	0	0	111.2	H169 V170 L171 I175 Q176 E177	H169-T173 PolarHBondContact O-N 3.12Å; H169-T173 PolarHBondContact O-OG1 3.37Å; H169-T173 VanDerWaalsContact O-OG1 3.04Å; V170-T173 PolarHBondContact O-N 3.01Å; L171-T173 VanDerWaalsContact C-N 3.34Å; L171-T173 PolarHBondContact O-N 2.76Å; T173-I175 VanDerWaalsContact C-N 3.3Å; T173-I175 PolarHBondContact O-N 3.31Å; T173-Q176 WeakPolarHBondContact O-CB 3.46Å; T173-Q176 PolarHBondContact O-N 3.24Å; T173-Q176 VanDerWaalsContact O-N 3.14Å; T173-E177 HydrophobicContact CG2-CG 4.44Å; T173-E177 WeakPolarHBondContact O-CG 3.49Å; T173-E177 PolarHBondContact O-N 3.46Å
174	T	90.6	Very high	88.5	Confident	53 Å²	53	101.9 Å²	101.9	33%	0.325	50%	0.496	S	S	.	.	H	α-helix	trans	-63.2	-35.7	176.7	57	0	0	0	0	112.8	V170 L171 E177 L178	V170-T174 WeakPolarHBondContact O-CG2 3.4Å; V170-T174 PolarHBondContact O-N 3.44Å; V170-T174 PolarHBondContact O-OG1 3.46Å; L171-T174 WeakPolarHBondContact CA-OG1 3.37Å; L171-T174 PolarHBondContact O-N 3.49Å; L171-T174 PolarHBondContact O-OG1 2.92Å; T174-E177 PolarHBondContact O-N 3.06Å; T174-L178 WeakPolarHBondContact O-CB 3.39Å; T174-L178 VanDerWaalsContact O-CG 3.27Å; T174-L178 WeakPolarHBondContact O-CG 3.5Å; T174-L178 PolarHBondContact O-N 3.46Å
175	I	91.1	Very high	87.4	Confident	77 Å²	77	98.6 Å²	98.6	40%	0.395	49%	0.491	S	S	.	.	H	α-helix	trans	-65.5	-43.8	174.1	-69	166.7	0	0	0	110.1	L171 L172 T173 L178 Q179	L171-I175 HydrophobicContact CG-CD1 4.07Å; L171-I175 WeakPolarHBondContact O-CG1 3.45Å; L171-I175 PolarHBondContact O-N 3.23Å; L172-I175 PolarHBondContact O-N 2.99Å; T173-I175 VanDerWaalsContact C-N 3.3Å; T173-I175 PolarHBondContact O-N 3.31Å; I175-L178 PolarHBondContact O-N 2.99Å; I175-Q179 HydrophobicContact CG2-CG 4.45Å; I175-Q179 WeakPolarHBondContact O-CB 3.47Å; I175-Q179 VanDerWaalsContact O-CG 3.3Å; I175-Q179 WeakPolarHBondContact O-CG 3.27Å; I175-Q179 PolarHBondContact O-N 2.9Å
176	Q	87.3	Confident	85.9	Confident	104 Å²	104	99.9 Å²	99.9	49%	0.486	50%	0.498	S	S	.	.	H	α-helix	trans	-63.4	-42.3	176.7	-73.7	173.4	-15.6	0	0	112	L172 T173 Q179 Q180	L172-Q176 WeakPolarHBondContact O-CG 3.39Å; L172-Q176 PolarHBondContact O-N 3.13Å; T173-Q176 WeakPolarHBondContact O-CB 3.46Å; T173-Q176 PolarHBondContact O-N 3.24Å; T173-Q176 VanDerWaalsContact O-N 3.14Å; Q176-Q179 PolarHBondContact O-N 2.9Å; Q176-Q180 VanDerWaalsContact O-CB 3.31Å; Q176-Q180 WeakPolarHBondContact O-CB 3.41Å; Q176-Q180 PolarHBondContact O-N 3.23Å
177	E	87.1	Confident	84.3	Confident	107 Å²	107	99 Å²	99	50%	0.5	49%	0.494	S	S	.	.	H	α-helix	trans	-63.3	-43.3	175.6	-73.4	172	178.1	0	0	111.6	T173 T174 Q180 T181	T173-E177 HydrophobicContact CG2-CG 4.44Å; T173-E177 WeakPolarHBondContact O-CG 3.49Å; T173-E177 PolarHBondContact O-N 3.46Å; T174-E177 PolarHBondContact O-N 3.06Å; E177-Q180 PolarHBondContact O-N 2.74Å; E177-T181 WeakPolarHBondContact O-CB 3.5Å; E177-T181 PolarHBondContact O-N 3.34Å; E177-T181 PolarHBondContact O-OG1 3.41Å
178	L	85.8	Confident	82.5	Confident	109 Å²	109	97.7 Å²	97.7	57%	0.571	50%	0.495	S	S	*	.	H	α-helix	trans	-63.9	-42.6	174.2	-75.6	168.9	0	0	0	112	T174 I175 Q180 T181 L182	T174-L178 WeakPolarHBondContact O-CB 3.39Å; T174-L178 VanDerWaalsContact O-CG 3.27Å; T174-L178 WeakPolarHBondContact O-CG 3.5Å; T174-L178 PolarHBondContact O-N 3.46Å; I175-L178 PolarHBondContact O-N 2.99Å; L178-Q180 VanDerWaalsContact C-N 3.32Å; L178-Q180 PolarHBondContact O-N 3.25Å; L178-T181 PolarHBondContact O-N 3.41Å; L178-L182 WeakPolarHBondContact O-CB 3.47Å; L178-L182 WeakPolarHBondContact O-CG 3.43Å; L178-L182 PolarHBondContact O-N 3.45Å
179	Q	84	Confident	80.6	Confident	111 Å²	111	95.9 Å²	95.9	52%	0.519	49%	0.492	S	S	.	.	H	α-helix	trans	-60.2	-43.5	173.4	-77.4	177.6	-29.9	0	0	111.3	I175 Q176 T181 L182 E183	I175-Q179 HydrophobicContact CG2-CG 4.45Å; I175-Q179 WeakPolarHBondContact O-CB 3.47Å; I175-Q179 VanDerWaalsContact O-CG 3.3Å; I175-Q179 WeakPolarHBondContact O-CG 3.27Å; I175-Q179 PolarHBondContact O-N 2.9Å; Q176-Q179 PolarHBondContact O-N 2.9Å; Q179-T181 VanDerWaalsContact C-N 3.3Å; Q179-T181 PolarHBondContact O-N 3.24Å; Q179-L182 PolarHBondContact O-N 3Å; Q179-E183 WeakPolarHBondContact O-CB 3.33Å; Q179-E183 WeakPolarHBondContact O-CG 3.5Å; Q179-E183 PolarHBondContact O-N 3.18Å
180	Q	84	Confident	78.6	Confident	118 Å²	118	94.8 Å²	94.8	55%	0.551	49%	0.49	S	S	*	.	H	α-helix	trans	-66.8	-33.6	177.2	-167.5	169	24.4	0	0	112.1	Q176 E177 L178 N184	Q176-Q180 VanDerWaalsContact O-CB 3.31Å; Q176-Q180 WeakPolarHBondContact O-CB 3.41Å; Q176-Q180 PolarHBondContact O-N 3.23Å; E177-Q180 PolarHBondContact O-N 2.74Å; L178-Q180 VanDerWaalsContact C-N 3.32Å; L178-Q180 PolarHBondContact O-N 3.25Å; Q180-N184 WeakPolarHBondContact O-CB 3.43Å; Q180-N184 PolarHBondContact O-N 2.97Å; Q180-N184 PolarHBondContact O-ND2 3.14Å; Q180-N184 VanDerWaalsContact O-ND2 3.14Å; Q180-N184 PolarHBondContact O-OD1 3.36Å
181	T	82.6	Confident	76.5	Confident	70 Å²	70	96.1 Å²	96.1	43%	0.429	49%	0.494	S	S	.	.	H	α-helix	trans	-69	-45.6	175.1	-52.2	0	0	0	0	110.3	E177 L178 Q179 E183 N184 D185	E177-T181 WeakPolarHBondContact O-CB 3.5Å; E177-T181 PolarHBondContact O-N 3.34Å; E177-T181 PolarHBondContact O-OG1 3.41Å; L178-T181 PolarHBondContact O-N 3.41Å; Q179-T181 VanDerWaalsContact C-N 3.3Å; Q179-T181 PolarHBondContact O-N 3.24Å; T181-E183 PolarHBondContact O-N 2.99Å; T181-N184 PolarHBondContact O-N 2.86Å; T181-N184 VanDerWaalsContact O-N 3.14Å; T181-D185 PolarHBondContact O-N 2.97Å
182	L	78.5	Confident	74.3	Confident	110 Å²	110	97.4 Å²	97.4	58%	0.576	50%	0.502	S	S	*	.	H	α-helix	trans	-60.5	-43.7	173.5	-72.9	165.8	0	0	0	112.2	L178 Q179 N184 D185 E186	L178-L182 WeakPolarHBondContact O-CB 3.47Å; L178-L182 WeakPolarHBondContact O-CG 3.43Å; L178-L182 PolarHBondContact O-N 3.45Å; Q179-L182 PolarHBondContact O-N 3Å; L182-N184 VanDerWaalsContact C-N 3.27Å; L182-N184 PolarHBondContact O-N 2.88Å; L182-D185 PolarHBondContact O-N 3.46Å; L182-E186 WeakPolarHBondContact O-CB 3.35Å; L182-E186 WeakPolarHBondContact O-CG 3.32Å; L182-E186 PolarHBondContact O-N 3.27Å
183	E	77.4	Confident	71.9	Confident	109 Å²	109	100.8 Å²	100.8	51%	0.509	52%	0.515	S	S	.	.	H	α-helix	trans	-64.1	-31	174.4	-80.5	-174.9	-173.3	0	0	112.9	Q179 T181 K187	Q179-E183 WeakPolarHBondContact O-CB 3.33Å; Q179-E183 WeakPolarHBondContact O-CG 3.5Å; Q179-E183 PolarHBondContact O-N 3.18Å; T181-E183 PolarHBondContact O-N 2.99Å; E183-K187 WeakPolarHBondContact O-CD 3.36Å; E183-K187 VanDerWaalsContact O-CG 3.26Å; E183-K187 WeakPolarHBondContact O-CG 3.48Å; E183-K187 PolarHBondContact O-N 3.28Å
184	N	73.6	Confident	69.8	Low	83 Å²	83	103.1 Å²	103.1	44%	0.444	53%	0.533	S	S	.	.	H	α-helix	trans	-76.4	-39.4	175.6	-70.8	-21.2	0	0	0	111.2	Q180 T181 L182 K187 S188	Q180-N184 WeakPolarHBondContact O-CB 3.43Å; Q180-N184 PolarHBondContact O-N 2.97Å; Q180-N184 PolarHBondContact O-ND2 3.14Å; Q180-N184 VanDerWaalsContact O-ND2 3.14Å; Q180-N184 PolarHBondContact O-OD1 3.36Å; T181-N184 PolarHBondContact O-N 2.86Å; T181-N184 VanDerWaalsContact O-N 3.14Å; L182-N184 VanDerWaalsContact C-N 3.27Å; L182-N184 PolarHBondContact O-N 2.88Å; N184-K187 PolarHBondContact O-N 3.43Å; N184-S188 PolarHBondContact O-N 3.43Å; N184-S188 PolarHBondContact O-OG 2.98Å
185	D	71.6	Confident	67.5	Low	87 Å²	87	108.8 Å²	108.8	47%	0.465	56%	0.556	S	S	.	*	H	α-helix	trans	-63.6	-42.5	174.8	-75.1	-8.2	0	0	0	111	T181 L182 K187 S188 D189	T181-D185 PolarHBondContact O-N 2.97Å; L182-D185 PolarHBondContact O-N 3.46Å; D185-K187 VanDerWaalsContact C-N 3.28Å; D185-K187 PolarHBondContact O-N 3.02Å; D185-S188 VanDerWaalsContact CA-OG 3.27Å; D185-S188 WeakPolarHBondContact CA-OG 3.43Å; D185-S188 PolarHBondContact O-N 3.42Å; D185-S188 PolarHBondContact O-OG 3.27Å; D185-D189 PolarHBondContact O-N 3.21Å
186	E	63.1	Low	65	Low	134 Å²	134	113.5 Å²	113.5	63%	0.626	58%	0.577	S	S	*	*	H	α-helix	trans	-63.8	-29.7	172.8	-76.3	-171.9	167.8	0	0	113	L182 N190	L182-E186 WeakPolarHBondContact O-CB 3.35Å; L182-E186 WeakPolarHBondContact O-CG 3.32Å; L182-E186 PolarHBondContact O-N 3.27Å; E186-N190 PolarHBondContact O-N 3.02Å; E186-N190 PolarHBondContact O-ND2 2.99Å
187	K	60	Low	62.7	Low	118 Å²	118	113.7 Å²	113.7	51%	0.513	59%	0.589	S	S	.	*	H	α-helix	trans	-76	-38.9	173.6	-76.1	167.8	-169.9	154.7	0	111.8	E183 N184 D185 N190 D191	E183-K187 WeakPolarHBondContact O-CD 3.36Å; E183-K187 VanDerWaalsContact O-CG 3.26Å; E183-K187 WeakPolarHBondContact O-CG 3.48Å; E183-K187 PolarHBondContact O-N 3.28Å; N184-K187 PolarHBondContact O-N 3.43Å; D185-K187 VanDerWaalsContact C-N 3.28Å; D185-K187 PolarHBondContact O-N 3.02Å; K187-N190 PolarHBondContact O-N 3.27Å; K187-D191 PolarHBondContact O-N 3.05Å; K187-D191 VanDerWaalsContact O-N 3.11Å
188	S	56.1	Low	60.7	Low	61 Å²	61	114.5 Å²	114.5	43%	0.427	60%	0.604	S	S	.	*	H	α-helix	trans	-68.4	-36.5	175	46	0	0	0	0	113.2	N184 D185 N190 D191 D192	N184-S188 PolarHBondContact O-N 3.43Å; N184-S188 PolarHBondContact O-OG 2.98Å; D185-S188 VanDerWaalsContact CA-OG 3.27Å; D185-S188 WeakPolarHBondContact CA-OG 3.43Å; D185-S188 PolarHBondContact O-N 3.42Å; D185-S188 PolarHBondContact O-OG 3.27Å; S188-N190 VanDerWaalsContact C-N 3.32Å; S188-N190 PolarHBondContact O-N 3.39Å; S188-D191 PolarHBondContact O-N 3.31Å; S188-D192 PolarHBondContact O-N 3.16Å
189	D	53.9	Low	58.5	Low	108 Å²	108	113.3 Å²	113.3	58%	0.578	61%	0.61	S	S	*	*	H	α-helix	trans	-67.6	-30.8	174.9	-91.3	-8.6	0	0	0	112.4	D185 Q193	D185-D189 PolarHBondContact O-N 3.21Å; D189-Q193 PolarHBondContact O-N 2.99Å; D189-Q193 VanDerWaalsContact O-N 3.15Å
190	N	51.9	Low	56.2	Low	105 Å²	105	116.7 Å²	116.7	56%	0.561	63%	0.626	S	S	*	*	H	α-helix	trans	-73.8	-32.7	172.7	-82.3	-54.1	0	0	0	112.7	E186 K187 S188 S194	E186-N190 PolarHBondContact O-N 3.02Å; E186-N190 PolarHBondContact O-ND2 2.99Å; K187-N190 PolarHBondContact O-N 3.27Å; S188-N190 VanDerWaalsContact C-N 3.32Å; S188-N190 PolarHBondContact O-N 3.39Å; N190-S194 PolarHBondContact O-N 3.16Å; N190-S194 PolarHBondContact O-OG 3.38Å
191	D	50.4	Low	54.2	Low	119 Å²	119	118.9 Å²	118.9	64%	0.636	64%	0.641	S	S	*	*	H	α-helix	trans	-72.7	-31.9	173.4	-83.1	-15.1	0	0	0	111.8	K187 S188 S194	K187-D191 PolarHBondContact O-N 3.05Å; K187-D191 VanDerWaalsContact O-N 3.11Å; S188-D191 PolarHBondContact O-N 3.31Å; D191-S194 WeakPolarHBondContact O-CB 3.41Å; D191-S194 PolarHBondContact O-N 3.19Å
192	D	46.3	Very low	52.2	Low	121 Å²	121	119 Å²	119	65%	0.647	66%	0.656	S	S	*	*	H	α-helix	trans	-76.1	-33.2	177.7	-129.4	3.3	0	0	0	112.7	S188 S194 Q195	S188-D192 PolarHBondContact O-N 3.16Å; D192-S194 PolarHBondContact O-N 3.06Å; D192-Q195 PolarHBondContact O-N 3.07Å
193	Q	43.4	Very low	50.2	Low	168 Å²	168	127 Å²	127	79%	0.785	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-10.9	170.5	-76.2	-174.3	12.1	0	0	114	D189	D189-Q193 PolarHBondContact O-N 2.99Å; D189-Q193 VanDerWaalsContact O-N 3.15Å
194	S	46.7	Very low	48.9	Very low	94 Å²	94	128 Å²	128	66%	0.657	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-10.4	177.9	-58	0	0	0	0	113.8	N190 D191 D192	N190-S194 PolarHBondContact O-N 3.16Å; N190-S194 PolarHBondContact O-OG 3.38Å; D191-S194 WeakPolarHBondContact O-CB 3.41Å; D191-S194 PolarHBondContact O-N 3.19Å; D192-S194 PolarHBondContact O-N 3.06Å
195	Q	43.3	Very low	47.6	Very low	171 Å²	171	130.3 Å²	130.3	80%	0.799	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.2	-6.8	-175.3	-76.5	-160.6	-18.4	0	0	116.7	D192 S197	D192-Q195 PolarHBondContact O-N 3.07Å; Q195-S197 PolarHBondContact O-N 3.24Å
196	E	38.4	Very low	46.3	Very low	177 Å²	177	132.7 Å²	132.7	83%	0.827	73%	0.727	S	S	*	*	S	Bend	trans	-97.7	83.3	168.8	-79.4	-162.2	154.5	0	0	113.5
197	S	39.3	Very low	45.3	Very low	107 Å²	107	132.6 Å²	132.6	75%	0.748	73%	0.733	S	S	*	*			trans	76.1	139.7	143.2	-53	0	0	0	0	118.9	Q195	Q195-S197 PolarHBondContact O-N 3.24Å
198	P	44.3	Very low	44.3	Very low	124 Å²	124	133.6 Å²	133.6	81%	0.805	75%	0.747	S	S	*	*				-142.6	141.2	79.1	34.5	-16.5	0	0	0	117
199	A	40.7	Very low	43.6	Very low	85 Å²	85	138.4 Å²	138.4	70%	0.702	77%	0.768	S	S	*	*			trans	67.2	154.9	136.4	0	0	0	0	0	117.8
200	Q	35.2	Very low	42.8	Very low	182 Å²	182	140.6 Å²	140.6	85%	0.85	78%	0.782	S	S	*	*			cis	-172.3	160.8	24.7	-149.3	163.7	-0	0	0	109.6
201	N	41.8	Very low	42.1	Very low	164 Å²	164	143.3 Å²	143.3	88%	0.877	80%	0.799	S	S	*	*			trans	-34.1	156.5	166.6	-69.3	-24.6	0	0	0	118.2
202	G	41	Very low	41.4	Very low	72 Å²	72	145.3 Å²	145.3	74%	0.742	81%	0.812	S	S	*	*			trans	169.7	104.1	147.9	0	0	0	0	0	115.5
203	E	36.7	Very low	41	Very low	279 Å²	279	147.5 Å²	147.5	100%	1.304	83%	0.827	S	S	*	*			trans	65.5	0	159.4	-64.3	-177.1	153.3	0	0	121.4

Retrieved 203 of 203 residues in 461 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).