A0A087Y847_POEFO Loading...

Inhibitor of growth protein

Component of an histone acetyltransferase complex.

AlphaFold DB , UniProt , Accession A0A087Y847, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 289 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	A	57.2	Low	56.6	Low	112 Å²	112	99.7 Å²	99.7	93%	0.926	59%	0.586	S	S	*	*				0	-102.8	0	0	0	0	0	0	110.1	L3 C4 I5	A1-L3 PolarHBondContact O-N 3Å; A1-C4 PolarHBondContact O-N 2.7Å; A1-C4 VanDerWaalsContact O-N 3.07Å; A1-I5 PolarHBondContact O-N 2.64Å; A1-I5 VanDerWaalsContact O-N 3.1Å
2	L	59.1	Low	56.7	Low	148 Å²	148	100.6 Å²	100.6	78%	0.775	58%	0.58	S	S	*	*	H	α-helix	trans	-53.6	-44	-167.8	-67.5	171.7	0	0	0	115.6	I5 A6	L2-I5 PolarHBondContact O-N 3.17Å; L2-A6 PolarHBondContact O-N 3.35Å
3	L	54.9	Low	56.8	Low	142 Å²	142	103.2 Å²	103.2	74%	0.743	58%	0.583	S	S	*	*	H	α-helix	trans	-59	-48.4	176.3	-78.5	165.7	0	0	0	112.5	A1 I5 A6 E7	A1-L3 PolarHBondContact O-N 3Å; L3-I5 VanDerWaalsContact C-N 3.3Å; L3-I5 PolarHBondContact O-N 3.45Å; L3-A6 CarbonylContact O-C 3.57Å; L3-A6 WeakPolarHBondContact O-CA 3.31Å; L3-A6 WeakPolarHBondContact O-CB 3.14Å; L3-A6 PolarHBondContact O-N 3.43Å; L3-E7 WeakPolarHBondContact O-CG 3.39Å; L3-E7 PolarHBondContact O-N 2.84Å
4	C	54.1	Low	56.9	Low	73 Å²	73	109.1 Å²	109.1	49%	0.493	59%	0.593	S	S	.	*	H	α-helix	trans	-64.4	-32.8	178.4	-174.5	0	0	0	0	112.6	A1 E7 T8	A1-C4 PolarHBondContact O-N 2.7Å; A1-C4 VanDerWaalsContact O-N 3.07Å; C4-E7 WeakPolarHBondContact CA-OE2 3.2Å; C4-T8 WeakPolarHBondContact O-CB 3.12Å; C4-T8 PolarHBondContact O-N 2.92Å; C4-T8 PolarHBondContact O-OG1 3.22Å
5	I	61.8	Low	57.1	Low	101 Å²	101	108.9 Å²	108.9	52%	0.518	59%	0.587	S	S	.	*	H	α-helix	trans	-66.9	-43.1	171.3	-63.6	168.5	0	0	0	110.1	A1 L2 L3 T8 M9	A1-I5 PolarHBondContact O-N 2.64Å; A1-I5 VanDerWaalsContact O-N 3.1Å; L2-I5 PolarHBondContact O-N 3.17Å; L3-I5 VanDerWaalsContact C-N 3.3Å; L3-I5 PolarHBondContact O-N 3.45Å; I5-T8 PolarHBondContact O-N 3.41Å; I5-M9 HydrophobicContact CG2-CG 4.24Å; I5-M9 WeakPolarHBondContact O-CB 3.46Å; I5-M9 WeakPolarHBondContact O-CG 3.31Å; I5-M9 PolarHBondContact O-N 3.46Å
6	A	56	Low	57.3	Low	45 Å²	45	107.7 Å²	107.7	37%	0.372	58%	0.58	S	S	.	*	H	α-helix	trans	-64.9	-44	177.1	0	0	0	0	0	112.4	L2 L3 T8 M9 L10	L2-A6 PolarHBondContact O-N 3.35Å; L3-A6 CarbonylContact O-C 3.57Å; L3-A6 WeakPolarHBondContact O-CA 3.31Å; L3-A6 WeakPolarHBondContact O-CB 3.14Å; L3-A6 PolarHBondContact O-N 3.43Å; A6-T8 VanDerWaalsContact C-N 3.34Å; A6-T8 PolarHBondContact O-N 3.4Å; A6-M9 PolarHBondContact O-N 2.62Å; A6-L10 VanDerWaalsContact O-CB 3.31Å; A6-L10 WeakPolarHBondContact O-CB 3.38Å; A6-L10 VanDerWaalsContact O-CG 3.23Å; A6-L10 WeakPolarHBondContact O-CG 3.41Å; A6-L10 PolarHBondContact O-N 3.3Å
7	E	51.2	Low	57.9	Low	129 Å²	129	104.8 Å²	104.8	60%	0.603	58%	0.575	S	S	*	*	H	α-helix	trans	-59.4	-43.8	174.4	-70.7	165.8	148.1	0	0	111.4	L3 C4 G11	L3-E7 WeakPolarHBondContact O-CG 3.39Å; L3-E7 PolarHBondContact O-N 2.84Å; C4-E7 WeakPolarHBondContact CA-OE2 3.2Å; E7-G11 PolarHBondContact O-N 2.85Å
8	T	59.8	Low	58.8	Low	74 Å²	74	103.8 Å²	103.8	45%	0.454	57%	0.568	S	S	.	*	H	α-helix	trans	-63.8	-48.4	176.1	-53.6	0	0	0	0	111.3	C4 I5 A6 L10 G11 H12	C4-T8 WeakPolarHBondContact O-CB 3.12Å; C4-T8 PolarHBondContact O-N 2.92Å; C4-T8 PolarHBondContact O-OG1 3.22Å; I5-T8 PolarHBondContact O-N 3.41Å; A6-T8 VanDerWaalsContact C-N 3.34Å; A6-T8 PolarHBondContact O-N 3.4Å; T8-L10 PolarHBondContact O-N 3Å; T8-G11 PolarHBondContact O-N 3.18Å; T8-H12 PolarHBondContact O-CD2 3.48Å; T8-H12 VanDerWaalsContact O-CD2 3.31Å; T8-H12 PolarHBondContact O-N 3.46Å
9	M	55.8	Low	59.6	Low	115 Å²	115	102.1 Å²	102.1	57%	0.567	56%	0.555	S	S	*	*	H	α-helix	trans	-62.3	-41.7	179.2	-69.3	-82.3	-78	0	0	111.9	I5 A6 H13	I5-M9 HydrophobicContact CG2-CG 4.24Å; I5-M9 WeakPolarHBondContact O-CB 3.46Å; I5-M9 WeakPolarHBondContact O-CG 3.31Å; I5-M9 PolarHBondContact O-N 3.46Å; A6-M9 PolarHBondContact O-N 2.62Å; M9-H13 WeakPolarHBondContact O-CB 3.17Å; M9-H13 PolarHBondContact O-CD2 2.76Å; M9-H13 PolarHBondContact O-N 3.1Å
10	L	57.1	Low	60.6	Low	125 Å²	125	100.3 Å²	100.3	65%	0.654	55%	0.55	S	S	*	.	H	α-helix	trans	-65.7	-43.4	175.7	-73.4	167.6	0	0	0	111.6	A6 T8 H13 Y14	A6-L10 VanDerWaalsContact O-CB 3.31Å; A6-L10 WeakPolarHBondContact O-CB 3.38Å; A6-L10 VanDerWaalsContact O-CG 3.23Å; A6-L10 WeakPolarHBondContact O-CG 3.41Å; A6-L10 PolarHBondContact O-N 3.3Å; T8-L10 PolarHBondContact O-N 3Å; L10-H13 PolarHBondContact O-N 3.43Å; L10-Y14 WeakPolarHBondContact O-CB 3.31Å; L10-Y14 PolarHBondContact O-N 3.04Å
11	G	56.2	Low	61.6	Low	33 Å²	33	100.7 Å²	100.7	34%	0.34	55%	0.548	S	S	.	.	H	α-helix	trans	-59.9	-45.8	175.7	0	0	0	0	0	112.9	E7 T8 Y14 Q15	E7-G11 PolarHBondContact O-N 2.85Å; T8-G11 PolarHBondContact O-N 3.18Å; G11-Y14 PolarHBondContact O-N 3.4Å; G11-Q15 WeakPolarHBondContact O-CG 3.22Å; G11-Q15 PolarHBondContact O-N 3.22Å
12	H	56.9	Low	62.8	Low	110 Å²	110	97.5 Å²	97.5	51%	0.509	51%	0.514	S	S	.	.	H	α-helix	trans	-64.4	-40	174.8	-86.1	-90.9	0	0	0	112.7	T8 N16	T8-H12 PolarHBondContact O-CD2 3.48Å; T8-H12 VanDerWaalsContact O-CD2 3.31Å; T8-H12 PolarHBondContact O-N 3.46Å; H12-N16 WeakPolarHBondContact O-CB 3.38Å; H12-N16 VanDerWaalsContact O-CG 3.24Å; H12-N16 PolarHBondContact O-N 3.3Å; H12-N16 PolarHBondContact O-ND2 3.16Å
13	H	58.3	Low	63.9	Low	134 Å²	134	94.6 Å²	94.6	62%	0.62	50%	0.499	S	S	*	.	H	α-helix	trans	-64.6	-39	174.2	-94.5	-79	0	0	0	112.5	M9 L10 N16 A17	M9-H13 WeakPolarHBondContact O-CB 3.17Å; M9-H13 PolarHBondContact O-CD2 2.76Å; M9-H13 PolarHBondContact O-N 3.1Å; L10-H13 PolarHBondContact O-N 3.43Å; H13-N16 PolarHBondContact O-N 2.82Å; H13-A17 PolarHBondContact O-N 2.73Å
14	Y	57.7	Low	65.4	Low	187 Å²	187	91 Å²	91	73%	0.733	48%	0.482	S	S	*	.	H	α-helix	trans	-67.2	-44.8	178.5	-155.9	-88.4	0	0	0	111.6	L10 G11 N16 A17 D18	L10-Y14 WeakPolarHBondContact O-CB 3.31Å; L10-Y14 PolarHBondContact O-N 3.04Å; G11-Y14 PolarHBondContact O-N 3.4Å; Y14-N16 VanDerWaalsContact C-N 3.32Å; Y14-N16 PolarHBondContact O-N 2.84Å; Y14-A17 PolarHBondContact O-N 2.63Å; Y14-D18 PolarHBondContact O-N 3.06Å
15	Q	59.8	Low	66.9	Low	106 Å²	106	90.6 Å²	90.6	50%	0.495	48%	0.475	S	S	.	.	H	α-helix	trans	-62.6	-36.3	174.2	-73.6	179.6	-14	0	0	112.9	G11 K19	G11-Q15 WeakPolarHBondContact O-CG 3.22Å; G11-Q15 PolarHBondContact O-N 3.22Å; Q15-K19 VanDerWaalsContact O-CG 3.31Å; Q15-K19 WeakPolarHBondContact O-CG 3.22Å; Q15-K19 PolarHBondContact O-N 3.28Å; Q15-K19 VanDerWaalsContact O-N 3.12Å
16	N	61.3	Low	68.1	Low	89 Å²	89	88.7 Å²	88.7	48%	0.476	46%	0.462	S	S	.	.	H	α-helix	trans	-72.2	-31.9	176	-73.6	-15.3	0	0	0	112.4	H12 H13 Y14 S20	H12-N16 WeakPolarHBondContact O-CB 3.38Å; H12-N16 VanDerWaalsContact O-CG 3.24Å; H12-N16 PolarHBondContact O-N 3.3Å; H12-N16 PolarHBondContact O-ND2 3.16Å; H13-N16 PolarHBondContact O-N 2.82Å; Y14-N16 VanDerWaalsContact C-N 3.32Å; Y14-N16 PolarHBondContact O-N 2.84Å; N16-S20 WeakPolarHBondContact O-CB 3.47Å; N16-S20 PolarHBondContact O-N 2.76Å; N16-S20 PolarHBondContact O-OG 3.46Å
17	A	66.6	Low	69.7	Low	59 Å²	59	90 Å²	90	49%	0.488	47%	0.466	S	S	.	.	H	α-helix	trans	-68.8	-44.4	174.3	0	0	0	0	0	111.6	H13 Y14 S20 Q21	H13-A17 PolarHBondContact O-N 2.73Å; Y14-A17 PolarHBondContact O-N 2.63Å; A17-S20 WeakPolarHBondContact O-CB 3.45Å; A17-S20 PolarHBondContact O-N 2.74Å; A17-S20 VanDerWaalsContact O-N 3.12Å; A17-Q21 PolarHBondContact O-N 2.97Å
18	D	74.1	Confident	71.5	Confident	87 Å²	87	89.4 Å²	89.4	47%	0.465	46%	0.463	S	S	.	.	H	α-helix	trans	-59.2	-50	176.3	-174.5	27.2	0	0	0	111.8	Y14 S20 Q21 Q22	Y14-D18 PolarHBondContact O-N 3.06Å; D18-S20 VanDerWaalsContact C-N 3.26Å; D18-S20 PolarHBondContact O-N 3.25Å; D18-Q21 WeakPolarHBondContact O-CB 3.48Å; D18-Q21 PolarHBondContact O-N 3.49Å; D18-Q21 VanDerWaalsContact O-N 3.09Å; D18-Q22 VanDerWaalsContact O-CG 3.28Å; D18-Q22 WeakPolarHBondContact O-CG 3.12Å; D18-Q22 PolarHBondContact O-N 3.22Å; D18-Q22 PolarHBondContact OD1-NE2 3.5Å; D18-Q22 PolarHBondContact OD2-NE2 3.18Å; D18-Q22 VanDerWaalsContact OD2-NE2 3.08Å
19	K	74.4	Confident	72.9	Confident	70 Å²	70	87.6 Å²	87.6	30%	0.304	45%	0.45	S	S	.	.	H	α-helix	trans	-59.8	-33.5	172.7	-70.1	173.1	-169.9	180	0	113.5	Q15 Q22 L23 E126	Q15-K19 VanDerWaalsContact O-CG 3.31Å; Q15-K19 WeakPolarHBondContact O-CG 3.22Å; Q15-K19 PolarHBondContact O-N 3.28Å; Q15-K19 VanDerWaalsContact O-N 3.12Å; K19-Q22 PolarHBondContact O-N 2.91Å; K19-L23 WeakPolarHBondContact O-CB 3.36Å; K19-L23 WeakPolarHBondContact O-CG 3.4Å; K19-L23 PolarHBondContact O-N 2.84Å; K19-E126 IonicContact NZ-OE1 2.74Å; K19-E126 PolarHBondContact NZ-OE1 2.73Å
20	S	80.1	Confident	74.6	Confident	66 Å²	66	87.4 Å²	87.4	46%	0.462	44%	0.444	S	S	.	.	H	α-helix	trans	-69.3	-37.3	176.4	-58.7	0	0	0	0	111.5	N16 A17 D18 V24	N16-S20 WeakPolarHBondContact O-CB 3.47Å; N16-S20 PolarHBondContact O-N 2.76Å; N16-S20 PolarHBondContact O-OG 3.46Å; A17-S20 WeakPolarHBondContact O-CB 3.45Å; A17-S20 PolarHBondContact O-N 2.74Å; A17-S20 VanDerWaalsContact O-N 3.12Å; D18-S20 VanDerWaalsContact C-N 3.26Å; D18-S20 PolarHBondContact O-N 3.25Å; S20-V24 WeakPolarHBondContact O-CG2 3.45Å; S20-V24 PolarHBondContact O-N 3.19Å; S20-V24 VanDerWaalsContact O-N 3.1Å
21	Q	81.4	Confident	76.2	Confident	110 Å²	110	86.4 Å²	86.4	51%	0.514	44%	0.439	S	S	.	.	H	α-helix	trans	-67.8	-43.1	172.9	-169.2	63.5	59.9	0	0	111.3	A17 D18 L23 V24 N25	A17-Q21 PolarHBondContact O-N 2.97Å; D18-Q21 WeakPolarHBondContact O-CB 3.48Å; D18-Q21 PolarHBondContact O-N 3.49Å; D18-Q21 VanDerWaalsContact O-N 3.09Å; Q21-L23 VanDerWaalsContact C-N 3.3Å; Q21-L23 PolarHBondContact O-N 3.46Å; Q21-V24 PolarHBondContact O-N 3.36Å; Q21-V24 VanDerWaalsContact O-N 3.13Å; Q21-N25 PolarHBondContact NE2-OD1 3.47Å; Q21-N25 PolarHBondContact O-N 2.94Å; Q21-N25 PolarHBondContact O-OD1 2.91Å
22	Q	81.5	Confident	77.8	Confident	45 Å²	45	89.8 Å²	89.8	21%	0.21	45%	0.446	C	S	.	.	H	α-helix	trans	-59.6	-39.5	175.9	-66.4	157.9	13	0	0	111.9	D18 K19 Y26 C123 L124	D18-Q22 VanDerWaalsContact O-CG 3.28Å; D18-Q22 WeakPolarHBondContact O-CG 3.12Å; D18-Q22 PolarHBondContact O-N 3.22Å; D18-Q22 PolarHBondContact OD1-NE2 3.5Å; D18-Q22 PolarHBondContact OD2-NE2 3.18Å; D18-Q22 VanDerWaalsContact OD2-NE2 3.08Å; K19-Q22 PolarHBondContact O-N 2.91Å; Q22-Y26 WeakPolarHBondContact O-CB 3.28Å; Q22-Y26 PolarHBondContact O-N 2.96Å; Q22-C123 PolarHBondContact OE1-SG 3.44Å; Q22-L124 HydrophobicContact CB-CD2 4.45Å
23	L	83.6	Confident	79.5	Confident	86 Å²	86	85.3 Å²	85.3	45%	0.45	43%	0.427	S	S	.	.	H	α-helix	trans	-64.2	-41.5	172.5	-80.5	167.2	0	0	0	113.1	K19 Q21 Y26 V27 L124	K19-L23 WeakPolarHBondContact O-CB 3.36Å; K19-L23 WeakPolarHBondContact O-CG 3.4Å; K19-L23 PolarHBondContact O-N 2.84Å; Q21-L23 VanDerWaalsContact C-N 3.3Å; Q21-L23 PolarHBondContact O-N 3.46Å; L23-Y26 PolarHBondContact O-N 2.84Å; L23-V27 WeakPolarHBondContact O-CG2 3.39Å; L23-V27 PolarHBondContact O-N 3.07Å; L23-V27 VanDerWaalsContact O-N 3.09Å; L23-L124 HydrophobicContact CD2-CD1 3.77Å; L23-L124 HydrophobicContact CD2-CD2 3.59Å; L23-L124 HydrophobicContact CD2-CG 4.31Å; L23-L124 HydrophobicContact CG-CD2 3.64Å
24	V	86.7	Confident	81.1	Confident	66 Å²	66	82.6 Å²	82.6	40%	0.4	42%	0.419	S	S	.	.	H	α-helix	trans	-63.1	-53.5	176.4	168.2	0	0	0	0	110.2	S20 Q21 Y26 V27 E28	S20-V24 WeakPolarHBondContact O-CG2 3.45Å; S20-V24 PolarHBondContact O-N 3.19Å; S20-V24 VanDerWaalsContact O-N 3.1Å; Q21-V24 PolarHBondContact O-N 3.36Å; Q21-V24 VanDerWaalsContact O-N 3.13Å; V24-Y26 VanDerWaalsContact C-N 3.26Å; V24-Y26 PolarHBondContact O-N 3.45Å; V24-V27 PolarHBondContact O-N 3.26Å; V24-E28 HydrophobicContact CG1-CG 4.34Å; V24-E28 WeakPolarHBondContact O-CG 3.41Å; V24-E28 PolarHBondContact O-N 3.46Å
25	N	85.2	Confident	82.8	Confident	65 Å²	65	80.9 Å²	80.9	35%	0.348	42%	0.418	S	S	.	.	H	α-helix	trans	-56.5	-39.5	178.4	-64.6	22.4	0	0	0	111.8	Q21 E28 D29	Q21-N25 PolarHBondContact NE2-OD1 3.47Å; Q21-N25 PolarHBondContact O-N 2.94Å; Q21-N25 PolarHBondContact O-OD1 2.91Å; N25-E28 PolarHBondContact O-N 2.86Å; N25-D29 WeakPolarHBondContact O-CB 3.2Å; N25-D29 PolarHBondContact O-N 3.37Å
26	Y	86.9	Confident	84.4	Confident	61 Å²	61	77 Å²	77	24%	0.239	40%	0.402	C	S	.	.	H	α-helix	trans	-64.2	-41.4	175.6	173.9	-112	0	0	0	113.3	Q22 L23 V24 Y30 M117 H120 L124	Q22-Y26 WeakPolarHBondContact O-CB 3.28Å; Q22-Y26 PolarHBondContact O-N 2.96Å; L23-Y26 PolarHBondContact O-N 2.84Å; V24-Y26 VanDerWaalsContact C-N 3.26Å; V24-Y26 PolarHBondContact O-N 3.45Å; Y26-Y30 WeakPolarHBondContact O-CB 3.47Å; Y26-Y30 PolarHBondContact O-N 3.02Å; Y26-M117 HydrophobicContact CD2-CE 4.45Å; Y26-M117 HydrophobicContact CD2-SD 4.44Å; Y26-M117 HydrophobicContact CE2-CE 3.41Å; Y26-M117 VanDerWaalsContact CE2-CE 3.41Å; Y26-M117 HydrophobicContact CE2-SD 3.89Å; Y26-M117 WeakPolarHBondContact OH-CE 3.26Å; Y26-H120 HydrophobicContact CD2-CB 3.44Å; Y26-H120 VanDerWaalsContact CD2-CB 3.44Å; Y26-H120 HydrophobicContact CE2-CB 4.23Å; Y26-H120 HydrophobicContact CG-CB 4.14Å; Y26-L124 HydrophobicContact CD1-CD1 3.77Å; Y26-L124 HydrophobicContact CE1-CD1 4.3Å; Y26-L124 HydrophobicContact CG-CD1 3.94Å
27	V	89.1	Confident	85.9	Confident	74 Å²	74	74.1 Å²	74.1	45%	0.448	39%	0.387	S	S	.	.	H	α-helix	trans	-70.2	-38.2	177.7	171.3	0	0	0	0	111	L23 V24 L31	L23-V27 WeakPolarHBondContact O-CG2 3.39Å; L23-V27 PolarHBondContact O-N 3.07Å; L23-V27 VanDerWaalsContact O-N 3.09Å; V24-V27 PolarHBondContact O-N 3.26Å; V27-L31 HydrophobicContact CG1-CD1 3.89Å; V27-L31 HydrophobicContact CG1-CG 4.44Å; V27-L31 WeakPolarHBondContact O-CB 3.44Å; V27-L31 WeakPolarHBondContact O-CG 3.18Å; V27-L31 PolarHBondContact O-N 3Å
28	E	89.2	Confident	87.3	Confident	115 Å²	115	74.9 Å²	74.9	54%	0.537	39%	0.387	S	S	.	.	H	α-helix	trans	-63.4	-52.1	175.3	-69.9	173.6	157.3	0	0	111.2	V24 N25 Y30 L31 E32	V24-E28 HydrophobicContact CG1-CG 4.34Å; V24-E28 WeakPolarHBondContact O-CG 3.41Å; V24-E28 PolarHBondContact O-N 3.46Å; N25-E28 PolarHBondContact O-N 2.86Å; E28-Y30 VanDerWaalsContact C-N 3.33Å; E28-Y30 PolarHBondContact O-N 3.24Å; E28-L31 PolarHBondContact O-N 3.44Å; E28-E32 PolarHBondContact O-N 3.28Å
29	D	88.8	Confident	88.4	Confident	36 Å²	36	74.4 Å²	74.4	19%	0.193	38%	0.384	C	S	.	.	H	α-helix	trans	-59.5	-40	176	-81.3	-0.3	0	0	0	112.8	N25 C33 Q116 H120	N25-D29 WeakPolarHBondContact O-CB 3.2Å; N25-D29 PolarHBondContact O-N 3.37Å; D29-C33 WeakPolarHBondContact O-CB 3.47Å; D29-C33 PolarHBondContact O-N 3.29Å; D29-Q116 PolarHBondContact OD1-NE2 3.45Å; D29-Q116 WeakPolarHBondContact OD2-CG 3.37Å; D29-Q116 PolarHBondContact OD2-NE2 2.82Å; D29-H120 IonicContact OD2-CE1 3.51Å; D29-H120 PolarHBondContact OD2-CE1 3.34Å; D29-H120 IonicContact OD2-ND1 2.67Å
30	Y	90.8	Very high	89.4	Confident	112 Å²	112	73.3 Å²	73.3	44%	0.439	38%	0.382	S	S	.	.	H	α-helix	trans	-64.9	-43.9	177.1	173.4	-112.9	0	0	0	112	Y26 E28 C33 V34 M117	Y26-Y30 WeakPolarHBondContact O-CB 3.47Å; Y26-Y30 PolarHBondContact O-N 3.02Å; E28-Y30 VanDerWaalsContact C-N 3.33Å; E28-Y30 PolarHBondContact O-N 3.24Å; Y30-C33 PolarHBondContact O-N 3.22Å; Y30-V34 HydrophobicContact CD2-CG2 3.97Å; Y30-V34 HydrophobicContact CE1-CG2 4.26Å; Y30-V34 HydrophobicContact CE2-CG2 3.51Å; Y30-V34 WeakPolarHBondContact O-CB 3.34Å; Y30-V34 VanDerWaalsContact O-CG2 3.31Å; Y30-V34 WeakPolarHBondContact O-CG2 3.41Å; Y30-V34 PolarHBondContact O-N 3.31Å; Y30-M117 HydrophobicContact CD2-CE 3.4Å; Y30-M117 HydrophobicContact CD2-SD 3.93Å; Y30-M117 HydrophobicContact CE2-CE 4.19Å; Y30-M117 HydrophobicContact CG-CE 4.1Å; Y30-M117 HydrophobicContact CG-SD 4.42Å
31	L	91.8	Very high	90.3	Very high	104 Å²	104	72.7 Å²	72.7	55%	0.545	37%	0.373	S	S	.	.	H	α-helix	trans	-66.1	-44.8	177.9	-71.5	169.4	0	0	0	111.1	V27 E28 C33 V34 E35	V27-L31 HydrophobicContact CG1-CD1 3.89Å; V27-L31 HydrophobicContact CG1-CG 4.44Å; V27-L31 WeakPolarHBondContact O-CB 3.44Å; V27-L31 WeakPolarHBondContact O-CG 3.18Å; V27-L31 PolarHBondContact O-N 3Å; E28-L31 PolarHBondContact O-N 3.44Å; L31-C33 VanDerWaalsContact C-N 3.31Å; L31-C33 PolarHBondContact O-N 3.5Å; L31-V34 PolarHBondContact O-N 3.4Å; L31-E35 WeakPolarHBondContact O-CB 3.29Å; L31-E35 PolarHBondContact O-N 2.91Å
32	E	90.1	Very high	91	Very high	103 Å²	103	73.4 Å²	73.4	48%	0.481	38%	0.376	S	S	.	.	H	α-helix	trans	-59.9	-42.7	174.7	-164.9	-156.6	102.1	0	0	111.2	E28 E35 S36 R113	E28-E32 PolarHBondContact O-N 3.28Å; E32-E35 PolarHBondContact O-N 2.88Å; E32-S36 VanDerWaalsContact O-CB 3.24Å; E32-S36 WeakPolarHBondContact O-CB 3.43Å; E32-S36 PolarHBondContact O-N 3.34Å; E32-S36 PolarHBondContact O-OG 2.95Å; E32-R113 IonicContact OE1-CZ 2.65Å; E32-R113 IonicContact OE1-NH1 3.73Å; E32-R113 PolarHBondContact OE1-NH1 2.81Å; E32-R113 IonicContact OE1-NH2 2.62Å; E32-R113 PolarHBondContact OE1-NH2 3.14Å
33	C	92.3	Very high	91.8	Very high	16 Å²	16	78.2 Å²	78.2	11%	0.108	39%	0.392	C	S	.	.	H	α-helix	trans	-61.4	-48.3	176.7	-178.3	0	0	0	0	112	D29 Y30 L31 E35 L37	D29-C33 WeakPolarHBondContact O-CB 3.47Å; D29-C33 PolarHBondContact O-N 3.29Å; Y30-C33 PolarHBondContact O-N 3.22Å; L31-C33 VanDerWaalsContact C-N 3.31Å; L31-C33 PolarHBondContact O-N 3.5Å; C33-E35 VanDerWaalsContact C-N 3.33Å; C33-E35 PolarHBondContact O-N 3.46Å; C33-L37 WeakPolarHBondContact O-CB 3.44Å; C33-L37 PolarHBondContact O-N 2.9Å
34	V	91.9	Very high	92.5	Very high	77 Å²	77	74.8 Å²	74.8	47%	0.467	37%	0.374	S	S	.	.	H	α-helix	trans	-66.2	-32.8	-179.5	169.5	0	0	0	0	112.5	Y30 L31 P38	Y30-V34 HydrophobicContact CD2-CG2 3.97Å; Y30-V34 HydrophobicContact CE1-CG2 4.26Å; Y30-V34 HydrophobicContact CE2-CG2 3.51Å; Y30-V34 WeakPolarHBondContact O-CB 3.34Å; Y30-V34 VanDerWaalsContact O-CG2 3.31Å; Y30-V34 WeakPolarHBondContact O-CG2 3.41Å; Y30-V34 PolarHBondContact O-N 3.31Å; L31-V34 PolarHBondContact O-N 3.4Å; V34-P38 VanDerWaalsContact O-CD 3.28Å; V34-P38 WeakPolarHBondContact O-CD 3.5Å; V34-P38 WeakPolarHBondContact O-CG 3.3Å
35	E	92.5	Very high	93.1	Very high	151 Å²	151	73.8 Å²	73.8	71%	0.706	37%	0.368	S	S	*	.	H	α-helix	trans	-83	-43.8	178.2	-171.9	167.1	-166.6	0	0	113.1	L31 E32 C33 L39	L31-E35 WeakPolarHBondContact O-CB 3.29Å; L31-E35 PolarHBondContact O-N 2.91Å; E32-E35 PolarHBondContact O-N 2.88Å; C33-E35 VanDerWaalsContact C-N 3.33Å; C33-E35 PolarHBondContact O-N 3.46Å; E35-L39 WeakPolarHBondContact O-CD1 3.44Å
36	S	93.3	Very high	93.7	Very high	24 Å²	24	74 Å²	74	17%	0.168	37%	0.374	C	S	.	.	H	α-helix	trans	-80.9	-48.1	-175	63	0	0	0	0	114	E32 L39 D40 R113	E32-S36 VanDerWaalsContact O-CB 3.24Å; E32-S36 WeakPolarHBondContact O-CB 3.43Å; E32-S36 PolarHBondContact O-N 3.34Å; E32-S36 PolarHBondContact O-OG 2.95Å; S36-L39 WeakPolarHBondContact O-CA 3.32Å; S36-L39 WeakPolarHBondContact O-CB 3.44Å; S36-L39 PolarHBondContact O-N 2.99Å; S36-D40 PolarHBondContact O-N 3.31Å; S36-R113 PolarHBondContact OG-NH2 3Å
37	L	94.4	Very high	94.3	Very high	29 Å²	29	74.5 Å²	74.5	15%	0.152	38%	0.381	C	S	.	.	H	α-helix	trans	-59.4	-40	-168.5	-175.7	62	0	0	0	113.5	C33 L39 D40 I41 L109 V110 R113	C33-L37 WeakPolarHBondContact O-CB 3.44Å; C33-L37 PolarHBondContact O-N 2.9Å; L37-L39 VanDerWaalsContact C-N 3.3Å; L37-L39 PolarHBondContact O-N 3.27Å; L37-D40 PolarHBondContact O-N 2.92Å; L37-I41 HydrophobicContact CD1-CD1 3.91Å; L37-I41 HydrophobicContact CD1-CG1 4.08Å; L37-I41 HydrophobicContact CD2-CD1 4.48Å; L37-I41 HydrophobicContact CG-CD1 3.79Å; L37-I41 HydrophobicContact CG-CG1 4.37Å; L37-I41 WeakPolarHBondContact O-CB 3.48Å; L37-I41 VanDerWaalsContact O-CG1 3.27Å; L37-I41 WeakPolarHBondContact O-CG1 3.3Å; L37-I41 PolarHBondContact O-N 3.35Å; L37-L109 HydrophobicContact CD1-CB 4.31Å; L37-V110 HydrophobicContact CD1-CG2 4.3Å; L37-R113 HydrophobicContact CD1-CG 4.3Å; L37-R113 HydrophobicContact CD2-CB 4.21Å; L37-R113 HydrophobicContact CD2-CG 4.3Å
38	P	96.3	Very high	94.7	Very high	76 Å²	76	72.5 Å²	72.5	49%	0.494	37%	0.367	S	S	.	.	H	α-helix	trans	-62.8	-35.9	174.9	-22.7	35.2	0	0	0	113.1	V34 Q42	V34-P38 VanDerWaalsContact O-CD 3.28Å; V34-P38 WeakPolarHBondContact O-CD 3.5Å; V34-P38 WeakPolarHBondContact O-CG 3.3Å; P38-Q42 VanDerWaalsContact O-CB 3.25Å; P38-Q42 WeakPolarHBondContact O-CB 3.45Å; P38-Q42 PolarHBondContact O-N 3.11Å
39	L	96.2	Very high	95.1	Very high	77 Å²	77	75.5 Å²	75.5	40%	0.403	37%	0.374	S	S	.	.	H	α-helix	trans	-72.4	-40.6	179.1	-60.3	175.1	0	0	0	111.2	E35 S36 L37 Q42 R43	E35-L39 WeakPolarHBondContact O-CD1 3.44Å; S36-L39 WeakPolarHBondContact O-CA 3.32Å; S36-L39 WeakPolarHBondContact O-CB 3.44Å; S36-L39 PolarHBondContact O-N 2.99Å; L37-L39 VanDerWaalsContact C-N 3.3Å; L37-L39 PolarHBondContact O-N 3.27Å; L39-Q42 PolarHBondContact O-N 3.02Å; L39-R43 VanDerWaalsContact O-CG 3.25Å; L39-R43 WeakPolarHBondContact O-CG 3.41Å; L39-R43 PolarHBondContact O-N 3.1Å
40	D	96.4	Very high	95.6	Very high	47 Å²	47	78.9 Å²	78.9	25%	0.251	39%	0.389	S	S	.	.	H	α-helix	trans	-69.3	-40.6	176.1	-72.2	-47	0	0	0	112.7	S36 L37 Q42 R43 N44	S36-D40 PolarHBondContact O-N 3.31Å; L37-D40 PolarHBondContact O-N 2.92Å; D40-Q42 VanDerWaalsContact C-N 3.32Å; D40-Q42 PolarHBondContact O-N 3.37Å; D40-R43 PolarHBondContact O-N 3.31Å; D40-R43 IonicContact OD1-CZ 2.73Å; D40-R43 IonicContact OD1-NH1 2.63Å; D40-R43 PolarHBondContact OD1-NH1 3.37Å; D40-R43 IonicContact OD2-NH1 3.01Å; D40-N44 PolarHBondContact O-N 3.14Å; D40-N44 PolarHBondContact O-ND2 2.98Å
41	I	96.9	Very high	96	Very high	53 Å²	53	73.8 Å²	73.8	27%	0.272	37%	0.369	S	S	.	.	H	α-helix	trans	-59.9	-44	169.4	-71.2	171.6	0	0	0	110.2	L37 R43 N44 V45 M106 V110	L37-I41 HydrophobicContact CD1-CD1 3.91Å; L37-I41 HydrophobicContact CD1-CG1 4.08Å; L37-I41 HydrophobicContact CD2-CD1 4.48Å; L37-I41 HydrophobicContact CG-CD1 3.79Å; L37-I41 HydrophobicContact CG-CG1 4.37Å; L37-I41 WeakPolarHBondContact O-CB 3.48Å; L37-I41 VanDerWaalsContact O-CG1 3.27Å; L37-I41 WeakPolarHBondContact O-CG1 3.3Å; L37-I41 PolarHBondContact O-N 3.35Å; I41-R43 PolarHBondContact O-N 2.98Å; I41-N44 PolarHBondContact O-N 3.29Å; I41-V45 HydrophobicContact CG2-CG2 4.22Å; I41-V45 WeakPolarHBondContact O-CB 3.33Å; I41-V45 VanDerWaalsContact O-CG2 3.29Å; I41-V45 WeakPolarHBondContact O-CG2 3.26Å; I41-V45 PolarHBondContact O-N 2.64Å; I41-M106 HydrophobicContact CG2-CE 4.32Å; I41-V110 HydrophobicContact CD1-CG2 3.8Å; I41-V110 HydrophobicContact CG1-CG2 4.47Å
42	Q	98	Very high	96.3	Very high	124 Å²	124	71.2 Å²	71.2	58%	0.579	36%	0.356	S	S	*	.	H	α-helix	trans	-63.5	-39.8	178.4	-174.1	178.3	6.7	0	0	112.5	P38 L39 D40 V45 S46	P38-Q42 VanDerWaalsContact O-CB 3.25Å; P38-Q42 WeakPolarHBondContact O-CB 3.45Å; P38-Q42 PolarHBondContact O-N 3.11Å; L39-Q42 PolarHBondContact O-N 3.02Å; D40-Q42 VanDerWaalsContact C-N 3.32Å; D40-Q42 PolarHBondContact O-N 3.37Å; Q42-V45 PolarHBondContact O-N 3.06Å; Q42-S46 WeakPolarHBondContact O-CB 3.4Å; Q42-S46 PolarHBondContact O-N 2.82Å; Q42-S46 PolarHBondContact O-OG 3.23Å; Q42-S46 VanDerWaalsContact O-OG 3.11Å
43	R	98	Very high	96.7	Very high	147 Å²	147	69 Å²	69	56%	0.555	36%	0.355	S	S	*	.	H	α-helix	trans	-59.4	-49.9	174.2	-71.9	162.1	-172.6	140.6	4.4	110.9	L39 D40 I41 S46 L47	L39-R43 VanDerWaalsContact O-CG 3.25Å; L39-R43 WeakPolarHBondContact O-CG 3.41Å; L39-R43 PolarHBondContact O-N 3.1Å; D40-R43 PolarHBondContact O-N 3.31Å; D40-R43 IonicContact OD1-CZ 2.73Å; D40-R43 IonicContact OD1-NH1 2.63Å; D40-R43 PolarHBondContact OD1-NH1 3.37Å; D40-R43 IonicContact OD2-NH1 3.01Å; I41-R43 PolarHBondContact O-N 2.98Å; R43-S46 WeakPolarHBondContact O-CB 3.41Å; R43-S46 PolarHBondContact O-N 2.84Å; R43-L47 PolarHBondContact O-N 3.43Å
44	N	98.2	Very high	97	Very high	14 Å²	14	72.3 Å²	72.3	8%	0.075	37%	0.367	C	S	.	.	H	α-helix	trans	-64.8	-42.1	178.8	-76.5	-79	0	0	0	112.7	D40 I41 S46 L47 L48 V102 Q105 M106	D40-N44 PolarHBondContact O-N 3.14Å; D40-N44 PolarHBondContact O-ND2 2.98Å; I41-N44 PolarHBondContact O-N 3.29Å; N44-S46 VanDerWaalsContact C-N 3.3Å; N44-S46 PolarHBondContact O-N 3.35Å; N44-L47 PolarHBondContact O-N 3.5Å; N44-L48 WeakPolarHBondContact O-CB 3.27Å; N44-L48 PolarHBondContact O-N 3Å; N44-V102 HydrophobicContact CB-CG1 4.05Å; N44-V102 WeakPolarHBondContact O-CG1 3.42Å; N44-Q105 PolarHBondContact OD1-OE1 3.5Å; N44-M106 HydrophobicContact CB-CG 3.31Å; N44-M106 HydrophobicContact CB-SD 3.67Å
45	V	98.3	Very high	97.3	Very high	44 Å²	44	71.6 Å²	71.6	27%	0.267	36%	0.357	S	S	.	.	H	α-helix	trans	-62.9	-35.6	175	169.6	0	0	0	0	111.8	I41 Q42 R49 M106	I41-V45 HydrophobicContact CG2-CG2 4.22Å; I41-V45 WeakPolarHBondContact O-CB 3.33Å; I41-V45 VanDerWaalsContact O-CG2 3.29Å; I41-V45 WeakPolarHBondContact O-CG2 3.26Å; I41-V45 PolarHBondContact O-N 2.64Å; Q42-V45 PolarHBondContact O-N 3.06Å; V45-R49 WeakPolarHBondContact O-CB 3.49Å; V45-R49 VanDerWaalsContact O-CG 3.27Å; V45-R49 WeakPolarHBondContact O-CG 3.39Å; V45-R49 PolarHBondContact O-N 2.92Å; V45-M106 HydrophobicContact CG2-CE 3.56Å; V45-M106 HydrophobicContact CG2-SD 4.19Å
46	S	98.4	Very high	97.6	Very high	69 Å²	69	69.1 Å²	69.1	48%	0.483	35%	0.345	S	S	.	.	H	α-helix	trans	-66.5	-43.9	173.9	-71	0	0	0	0	112.2	Q42 R43 N44 R49 E50	Q42-S46 WeakPolarHBondContact O-CB 3.4Å; Q42-S46 PolarHBondContact O-N 2.82Å; Q42-S46 PolarHBondContact O-OG 3.23Å; Q42-S46 VanDerWaalsContact O-OG 3.11Å; R43-S46 WeakPolarHBondContact O-CB 3.41Å; R43-S46 PolarHBondContact O-N 2.84Å; N44-S46 VanDerWaalsContact C-N 3.3Å; N44-S46 PolarHBondContact O-N 3.35Å; S46-R49 PolarHBondContact O-N 3.27Å; S46-E50 PolarHBondContact O-N 3.34Å; S46-E50 VanDerWaalsContact O-N 3.11Å
47	L	98.4	Very high	97.8	Very high	73 Å²	73	73.2 Å²	73.2	38%	0.382	36%	0.362	S	S	.	.	H	α-helix	trans	-62.7	-46.2	174.5	176.5	59.3	0	0	0	111.5	R43 N44 R49 E50 I51 V102	R43-L47 PolarHBondContact O-N 3.43Å; N44-L47 PolarHBondContact O-N 3.5Å; L47-R49 VanDerWaalsContact C-N 3.27Å; L47-R49 PolarHBondContact O-N 3.46Å; L47-E50 WeakPolarHBondContact O-CB 3.41Å; L47-E50 PolarHBondContact O-N 3.05Å; L47-I51 HydrophobicContact CD1-CD1 4.06Å; L47-I51 HydrophobicContact CD1-CG1 4.24Å; L47-I51 HydrophobicContact CG-CD1 3.92Å; L47-I51 WeakPolarHBondContact O-CG1 3.28Å; L47-I51 PolarHBondContact O-N 3.03Å; L47-V102 HydrophobicContact CD2-CG2 3.74Å; L47-V102 HydrophobicContact CG-CG2 4.1Å
48	L	98.6	Very high	98	Very high	31 Å²	31	72.5 Å²	72.5	16%	0.162	36%	0.359	C	S	.	.	H	α-helix	trans	-56.2	-42	176.7	-175.4	64.1	0	0	0	111.6	N44 I51 D52 K99 V102 V103	N44-L48 WeakPolarHBondContact O-CB 3.27Å; N44-L48 PolarHBondContact O-N 3Å; L48-I51 PolarHBondContact O-N 2.91Å; L48-D52 WeakPolarHBondContact O-CB 3.46Å; L48-D52 PolarHBondContact O-N 2.65Å; L48-K99 HydrophobicContact CD1-CB 3.96Å; L48-K99 HydrophobicContact CD1-CG 3.91Å; L48-V102 HydrophobicContact CB-CG1 4.09Å; L48-V103 HydrophobicContact CD1-CG2 4.07Å; L48-V103 HydrophobicContact CD2-CG2 3.95Å
49	R	98.5	Very high	98.1	Very high	178 Å²	178	71.5 Å²	71.5	67%	0.672	35%	0.349	S	S	*	.	H	α-helix	trans	-66	-33.6	174.9	-75.6	173.4	179.1	-163.8	1.2	113.5	V45 S46 L47 A53	V45-R49 WeakPolarHBondContact O-CB 3.49Å; V45-R49 VanDerWaalsContact O-CG 3.27Å; V45-R49 WeakPolarHBondContact O-CG 3.39Å; V45-R49 PolarHBondContact O-N 2.92Å; S46-R49 PolarHBondContact O-N 3.27Å; L47-R49 VanDerWaalsContact C-N 3.27Å; L47-R49 PolarHBondContact O-N 3.46Å; R49-A53 WeakPolarHBondContact O-CB 3.32Å; R49-A53 PolarHBondContact O-N 3.28Å
50	E	98.4	Very high	98.2	Very high	108 Å²	108	72.5 Å²	72.5	51%	0.505	35%	0.35	S	S	.	.	H	α-helix	trans	-69.1	-42.2	174.8	-162.2	-165.3	126.7	0	0	111.2	S46 L47 A53 K54	S46-E50 PolarHBondContact O-N 3.34Å; S46-E50 VanDerWaalsContact O-N 3.11Å; L47-E50 WeakPolarHBondContact O-CB 3.41Å; L47-E50 PolarHBondContact O-N 3.05Å; E50-A53 PolarHBondContact O-N 3.5Å; E50-K54 WeakPolarHBondContact O-CG 3.31Å; E50-K54 PolarHBondContact O-N 3.02Å; E50-K54 VanDerWaalsContact O-N 3.14Å; E50-K54 WeakPolarHBondContact OE1-CE 3.25Å; E50-K54 IonicContact OE1-NZ 3.48Å; E50-K54 PolarHBondContact OE1-NZ 2.69Å
51	I	98.4	Very high	98.3	Very high	4 Å²	4	74.1 Å²	74.1	2%	0.021	36%	0.356	C	S	.	.	H	α-helix	trans	-68.6	-39.4	176.1	-52.8	158.3	0	0	0	110.4	L47 L48 A53 K54 Y55 L95 E98 K99 V102	L47-I51 HydrophobicContact CD1-CD1 4.06Å; L47-I51 HydrophobicContact CD1-CG1 4.24Å; L47-I51 HydrophobicContact CG-CD1 3.92Å; L47-I51 WeakPolarHBondContact O-CG1 3.28Å; L47-I51 PolarHBondContact O-N 3.03Å; L48-I51 PolarHBondContact O-N 2.91Å; I51-A53 PolarHBondContact O-N 3.03Å; I51-K54 PolarHBondContact O-N 2.82Å; I51-Y55 VanDerWaalsContact O-CB 3.28Å; I51-Y55 WeakPolarHBondContact O-CB 3.39Å; I51-Y55 PolarHBondContact O-N 3.08Å; I51-L95 HydrophobicContact CG2-CB 4.23Å; I51-L95 HydrophobicContact CG2-CD2 3.89Å; I51-L95 WeakPolarHBondContact CG2-O 3.31Å; I51-E98 HydrophobicContact CD1-CB 4.2Å; I51-E98 HydrophobicContact CG2-CB 4.23Å; I51-K99 HydrophobicContact CB-CG 4Å; I51-K99 HydrophobicContact CG2-CD 4.18Å; I51-K99 HydrophobicContact CG2-CG 3.55Å; I51-V102 HydrophobicContact CD1-CG2 3.92Å
52	D	98.4	Very high	98.3	Very high	51 Å²	51	72.4 Å²	72.4	27%	0.273	35%	0.348	S	S	.	.	H	α-helix	trans	-56.7	-45.6	171.3	-93.9	-38.3	0	0	0	112.2	L48 K54 Y55 Q56 K99	L48-D52 WeakPolarHBondContact O-CB 3.46Å; L48-D52 PolarHBondContact O-N 2.65Å; D52-K54 PolarHBondContact O-N 3.09Å; D52-Y55 PolarHBondContact O-N 3.11Å; D52-Q56 VanDerWaalsContact O-CG 3.29Å; D52-Q56 WeakPolarHBondContact O-CG 3.41Å; D52-Q56 PolarHBondContact O-N 2.97Å; D52-K99 VanDerWaalsContact OD1-CE 3.25Å; D52-K99 WeakPolarHBondContact OD1-CE 3.48Å; D52-K99 IonicContact OD1-NZ 2.75Å; D52-K99 PolarHBondContact OD1-NZ 3.4Å
53	A	98.5	Very high	98.4	Very high	55 Å²	55	71.7 Å²	71.7	46%	0.455	35%	0.348	S	S	.	.	H	α-helix	trans	-61.1	-45.8	177.8	0	0	0	0	0	111.5	R49 E50 I51 Y55 Q56 E57	R49-A53 WeakPolarHBondContact O-CB 3.32Å; R49-A53 PolarHBondContact O-N 3.28Å; E50-A53 PolarHBondContact O-N 3.5Å; I51-A53 PolarHBondContact O-N 3.03Å; A53-Y55 PolarHBondContact O-N 3.24Å; A53-Q56 PolarHBondContact O-N 2.86Å; A53-E57 PolarHBondContact O-N 3.02Å
54	K	98.3	Very high	98.4	Very high	87 Å²	87	70 Å²	70	38%	0.378	35%	0.347	S	S	.	.	H	α-helix	trans	-59.4	-46.9	174.4	-65.9	165.9	-169	164.1	0	111.4	E50 I51 D52 Q56 E57 V58 L95	E50-K54 WeakPolarHBondContact O-CG 3.31Å; E50-K54 PolarHBondContact O-N 3.02Å; E50-K54 VanDerWaalsContact O-N 3.14Å; E50-K54 WeakPolarHBondContact OE1-CE 3.25Å; E50-K54 IonicContact OE1-NZ 3.48Å; E50-K54 PolarHBondContact OE1-NZ 2.69Å; I51-K54 PolarHBondContact O-N 2.82Å; D52-K54 PolarHBondContact O-N 3.09Å; K54-Q56 VanDerWaalsContact C-N 3.35Å; K54-Q56 PolarHBondContact O-N 3.3Å; K54-E57 PolarHBondContact O-N 3.37Å; K54-V58 WeakPolarHBondContact O-CG2 3.4Å; K54-V58 PolarHBondContact O-N 3.5Å; K54-L95 HydrophobicContact CB-CD1 4.11Å; K54-L95 HydrophobicContact CB-CD2 4.1Å; K54-L95 HydrophobicContact CD-CD2 4.25Å
55	Y	98.4	Very high	98.4	Very high	62 Å²	62	69.5 Å²	69.5	24%	0.243	34%	0.344	C	S	.	.	H	α-helix	trans	-61.3	-40.7	-179.6	-178.4	-101.4	0	0	0	112	I51 D52 A53 V58 L59 S92 L95	I51-Y55 VanDerWaalsContact O-CB 3.28Å; I51-Y55 WeakPolarHBondContact O-CB 3.39Å; I51-Y55 PolarHBondContact O-N 3.08Å; D52-Y55 PolarHBondContact O-N 3.11Å; A53-Y55 PolarHBondContact O-N 3.24Å; Y55-V58 PolarHBondContact O-N 3.01Å; Y55-L59 HydrophobicContact CD1-CD1 4.01Å; Y55-L59 HydrophobicContact CD1-CG 4.34Å; Y55-L59 HydrophobicContact CE1-CD1 3.51Å; Y55-L59 HydrophobicContact CE1-CD2 4.48Å; Y55-L59 HydrophobicContact CE1-CG 4.01Å; Y55-L59 WeakPolarHBondContact O-CG 3.5Å; Y55-L59 PolarHBondContact O-N 3.13Å; Y55-S92 VanDerWaalsContact CE2-O 3.32Å; Y55-S92 WeakPolarHBondContact CE2-O 3.24Å; Y55-L95 HydrophobicContact CD2-CB 4.1Å
56	Q	98.3	Very high	98.4	Very high	99 Å²	99	71.7 Å²	71.7	46%	0.463	35%	0.35	S	S	.	.	H	α-helix	trans	-65	-37.9	175.6	-70.4	-65.3	-31.1	0	0	113	D52 A53 K54 K60	D52-Q56 VanDerWaalsContact O-CG 3.29Å; D52-Q56 WeakPolarHBondContact O-CG 3.41Å; D52-Q56 PolarHBondContact O-N 2.97Å; A53-Q56 PolarHBondContact O-N 2.86Å; K54-Q56 VanDerWaalsContact C-N 3.35Å; K54-Q56 PolarHBondContact O-N 3.3Å; Q56-K60 WeakPolarHBondContact O-CG 3.25Å; Q56-K60 PolarHBondContact O-N 3.37Å
57	E	98.4	Very high	98.3	Very high	110 Å²	110	73.2 Å²	73.2	51%	0.514	35%	0.349	S	S	.	.	H	α-helix	trans	-70.2	-36.3	173.8	-58.3	-47.4	136.3	0	0	112.2	A53 K54 K60 E61	A53-E57 PolarHBondContact O-N 3.02Å; K54-E57 PolarHBondContact O-N 3.37Å; E57-K60 PolarHBondContact O-N 3.45Å; E57-K60 IonicContact OE1-NZ 2.62Å; E57-K60 PolarHBondContact OE1-NZ 3.1Å; E57-K60 WeakPolarHBondContact OE2-CD 3.43Å; E57-K60 WeakPolarHBondContact OE2-CE 3.48Å; E57-K60 IonicContact OE2-NZ 2.64Å; E57-K60 PolarHBondContact OE2-NZ 3.49Å; E57-E61 PolarHBondContact O-N 3.32Å
58	V	98.3	Very high	98.3	Very high	14 Å²	14	74.8 Å²	74.8	9%	0.085	35%	0.353	C	S	.	.	H	α-helix	trans	-66	-39.1	174.9	174.1	0	0	0	0	111.6	K54 Y55 K60 E61 V62 A88 L91 L95	K54-V58 WeakPolarHBondContact O-CG2 3.4Å; K54-V58 PolarHBondContact O-N 3.5Å; Y55-V58 PolarHBondContact O-N 3.01Å; V58-K60 VanDerWaalsContact C-N 3.32Å; V58-K60 PolarHBondContact O-N 3.45Å; V58-E61 PolarHBondContact O-N 3.25Å; V58-V62 WeakPolarHBondContact O-CG2 3.37Å; V58-V62 PolarHBondContact O-N 2.93Å; V58-A88 WeakPolarHBondContact CG1-O 3.42Å; V58-L91 HydrophobicContact CG1-CB 4.47Å; V58-L91 HydrophobicContact CG1-CD2 4.49Å; V58-L91 HydrophobicContact CG1-CG 4.41Å; V58-L91 HydrophobicContact CG2-CD2 3.72Å; V58-L91 HydrophobicContact CG2-CG 4.07Å; V58-L95 HydrophobicContact CB-CD1 4.39Å; V58-L95 HydrophobicContact CG2-CD1 3.82Å
59	L	98.2	Very high	98.3	Very high	54 Å²	54	76 Å²	76	28%	0.283	36%	0.356	S	S	.	.	H	α-helix	trans	-60.8	-40	173.2	-73.5	-176.8	0	0	0	112.2	Y55 E61 V62 D63	Y55-L59 HydrophobicContact CD1-CD1 4.01Å; Y55-L59 HydrophobicContact CD1-CG 4.34Å; Y55-L59 HydrophobicContact CE1-CD1 3.51Å; Y55-L59 HydrophobicContact CE1-CD2 4.48Å; Y55-L59 HydrophobicContact CE1-CG 4.01Å; Y55-L59 WeakPolarHBondContact O-CG 3.5Å; Y55-L59 PolarHBondContact O-N 3.13Å; L59-E61 PolarHBondContact O-N 2.86Å; L59-V62 WeakPolarHBondContact O-CB 3.14Å; L59-V62 PolarHBondContact O-N 2.62Å; L59-D63 PolarHBondContact O-N 3.19Å
60	K	98.4	Very high	98.2	Very high	99 Å²	99	73 Å²	73	43%	0.43	35%	0.347	S	S	.	.	H	α-helix	trans	-63.1	-40.2	173.5	-65	173	-147	167.4	0	112.1	Q56 E57 V58 D63 E64	Q56-K60 WeakPolarHBondContact O-CG 3.25Å; Q56-K60 PolarHBondContact O-N 3.37Å; E57-K60 PolarHBondContact O-N 3.45Å; E57-K60 IonicContact OE1-NZ 2.62Å; E57-K60 PolarHBondContact OE1-NZ 3.1Å; E57-K60 WeakPolarHBondContact OE2-CD 3.43Å; E57-K60 WeakPolarHBondContact OE2-CE 3.48Å; E57-K60 IonicContact OE2-NZ 2.64Å; E57-K60 PolarHBondContact OE2-NZ 3.49Å; V58-K60 VanDerWaalsContact C-N 3.32Å; V58-K60 PolarHBondContact O-N 3.45Å; K60-D63 PolarHBondContact O-N 3.12Å; K60-E64 VanDerWaalsContact O-CB 3.31Å; K60-E64 WeakPolarHBondContact O-CB 3.29Å; K60-E64 PolarHBondContact O-N 2.99Å
61	E	98.1	Very high	98	Very high	80 Å²	80	70.5 Å²	70.5	37%	0.374	35%	0.351	S	S	.	.	H	α-helix	trans	-62.5	-42.9	173.2	-173	-179.3	174.5	0	0	111.1	E57 V58 L59 D63 E64 V65 Q84	E57-E61 PolarHBondContact O-N 3.32Å; V58-E61 PolarHBondContact O-N 3.25Å; L59-E61 PolarHBondContact O-N 2.86Å; E61-D63 PolarHBondContact O-N 3.46Å; E61-E64 PolarHBondContact O-N 3.41Å; E61-V65 HydrophobicContact CG-CG2 3.85Å; E61-V65 VanDerWaalsContact O-CB 3.28Å; E61-V65 WeakPolarHBondContact O-CB 3.35Å; E61-V65 WeakPolarHBondContact O-CG2 3.47Å; E61-V65 PolarHBondContact O-N 2.97Å; E61-Q84 PolarHBondContact OE1-NE2 3.27Å
62	V	98.4	Very high	98	Very high	17 Å²	17	72.2 Å²	72.2	10%	0.103	36%	0.359	C	S	.	.	H	α-helix	trans	-56.5	-51	176.2	168.5	0	0	0	0	111	V58 L59 V65 F66 L85 A88 L89	V58-V62 WeakPolarHBondContact O-CG2 3.37Å; V58-V62 PolarHBondContact O-N 2.93Å; L59-V62 WeakPolarHBondContact O-CB 3.14Å; L59-V62 PolarHBondContact O-N 2.62Å; V62-V65 PolarHBondContact O-N 3.4Å; V62-F66 WeakPolarHBondContact O-CB 3.42Å; V62-F66 PolarHBondContact O-N 3.05Å; V62-L85 HydrophobicContact CB-CD1 4.46Å; V62-L85 HydrophobicContact CG1-CD1 3.94Å; V62-L85 WeakPolarHBondContact O-CD1 3.5Å; V62-A88 HydrophobicContact CG2-CB 3.61Å; V62-L89 HydrophobicContact CG1-CD2 3.92Å; V62-L89 HydrophobicContact CG2-CD2 4.17Å; V62-L89 HydrophobicContact CG2-CG 4.39Å
63	D	98.4	Very high	97.9	Very high	109 Å²	109	78.1 Å²	78.1	58%	0.583	39%	0.385	S	S	*	.	H	α-helix	trans	-63.6	-46.1	179	-76	-23.9	0	0	0	112.1	L59 K60 E61 V65 F66 E67	L59-D63 PolarHBondContact O-N 3.19Å; K60-D63 PolarHBondContact O-N 3.12Å; E61-D63 PolarHBondContact O-N 3.46Å; D63-V65 PolarHBondContact O-N 3.3Å; D63-F66 PolarHBondContact O-N 2.93Å; D63-E67 PolarHBondContact O-N 3.47Å
64	E	98.2	Very high	97.9	Very high	113 Å²	113	78.3 Å²	78.3	53%	0.528	38%	0.378	S	S	.	.	H	α-helix	trans	-60.5	-44.5	177.6	-89.2	-158.8	-139	0	0	112.5	K60 E61 K68	K60-E64 VanDerWaalsContact O-CB 3.31Å; K60-E64 WeakPolarHBondContact O-CB 3.29Å; K60-E64 PolarHBondContact O-N 2.99Å; E61-E64 PolarHBondContact O-N 3.41Å; E64-K68 WeakPolarHBondContact O-CB 3.44Å; E64-K68 WeakPolarHBondContact O-CD 3.5Å; E64-K68 VanDerWaalsContact O-CE 3.31Å; E64-K68 WeakPolarHBondContact O-CE 3.39Å; E64-K68 WeakPolarHBondContact O-CG 3.5Å; E64-K68 PolarHBondContact O-N 2.9Å; E64-K68 IonicContact OE2-NZ 2.7Å; E64-K68 PolarHBondContact OE2-NZ 3Å
65	V	98.1	Very high	97.8	Very high	2 Å²	2	78.8 Å²	78.8	1%	0.012	39%	0.393	C	S	.	.	H	α-helix	trans	-73	-32.8	179.7	175.7	0	0	0	0	110.6	E61 V62 D63 Y69 L81 Q84 L85	E61-V65 HydrophobicContact CG-CG2 3.85Å; E61-V65 VanDerWaalsContact O-CB 3.28Å; E61-V65 WeakPolarHBondContact O-CB 3.35Å; E61-V65 WeakPolarHBondContact O-CG2 3.47Å; E61-V65 PolarHBondContact O-N 2.97Å; V62-V65 PolarHBondContact O-N 3.4Å; D63-V65 PolarHBondContact O-N 3.3Å; V65-Y69 WeakPolarHBondContact O-CB 3.48Å; V65-Y69 PolarHBondContact O-N 3.04Å; V65-L81 HydrophobicContact CG1-CD2 4.32Å; V65-Q84 HydrophobicContact CG1-CB 4.09Å; V65-Q84 HydrophobicContact CG1-CG 4.11Å; V65-Q84 HydrophobicContact CG2-CG 4.01Å; V65-L85 HydrophobicContact CB-CD1 4.46Å; V65-L85 HydrophobicContact CG1-CB 3.93Å; V65-L85 HydrophobicContact CG1-CD1 4.41Å
66	F	98.3	Very high	97.8	Very high	91 Å²	91	78.2 Å²	78.2	40%	0.399	40%	0.4	S	S	.	.	H	α-helix	trans	-65.3	-49.4	175.6	178.3	-100.8	0	0	0	112.3	V62 D63 K68 Y69 K70 L85	V62-F66 WeakPolarHBondContact O-CB 3.42Å; V62-F66 PolarHBondContact O-N 3.05Å; D63-F66 PolarHBondContact O-N 2.93Å; F66-K68 VanDerWaalsContact C-N 3.33Å; F66-K68 PolarHBondContact O-N 2.8Å; F66-Y69 WeakPolarHBondContact O-CB 3.34Å; F66-Y69 PolarHBondContact O-N 3.25Å; F66-K70 HydrophobicContact CE1-CD 4.13Å; F66-K70 VanDerWaalsContact O-CB 3.22Å; F66-K70 WeakPolarHBondContact O-CB 3.27Å; F66-K70 PolarHBondContact O-N 3.34Å; F66-L85 HydrophobicContact CB-CD1 4.18Å; F66-L85 HydrophobicContact CD2-CD2 4.1Å
67	E	98.3	Very high	97.8	Very high	100 Å²	100	78 Å²	78	47%	0.467	40%	0.399	S	S	.	.	H	α-helix	trans	-65.8	-36	178.1	-72	-61.6	123.5	0	0	111.9	D63 K70 G71	D63-E67 PolarHBondContact O-N 3.47Å; E67-K70 PolarHBondContact O-N 3.33Å; E67-K70 WeakPolarHBondContact OE1-CD 3.26Å; E67-K70 IonicContact OE1-NZ 2.66Å; E67-K70 PolarHBondContact OE1-NZ 3.34Å; E67-K70 WeakPolarHBondContact OE2-CD 3.49Å; E67-K70 IonicContact OE2-NZ 3.14Å; E67-K70 PolarHBondContact OE2-NZ 3.46Å; E67-G71 PolarHBondContact O-N 2.96Å; E67-G71 VanDerWaalsContact O-N 3.17Å
68	K	97.6	Very high	97.7	Very high	107 Å²	107	76.6 Å²	76.6	47%	0.465	39%	0.389	S	S	.	.	H	α-helix	trans	-60.9	-47.7	170.1	-68.9	162.2	-159.1	167.1	0	111.3	E64 F66 K70 G71 E72 L81	E64-K68 WeakPolarHBondContact O-CB 3.44Å; E64-K68 WeakPolarHBondContact O-CD 3.5Å; E64-K68 VanDerWaalsContact O-CE 3.31Å; E64-K68 WeakPolarHBondContact O-CE 3.39Å; E64-K68 WeakPolarHBondContact O-CG 3.5Å; E64-K68 PolarHBondContact O-N 2.9Å; E64-K68 IonicContact OE2-NZ 2.7Å; E64-K68 PolarHBondContact OE2-NZ 3Å; F66-K68 VanDerWaalsContact C-N 3.33Å; F66-K68 PolarHBondContact O-N 2.8Å; K68-K70 VanDerWaalsContact C-N 3.35Å; K68-K70 PolarHBondContact O-N 2.91Å; K68-G71 PolarHBondContact O-N 3.33Å; K68-E72 WeakPolarHBondContact O-CB 3.4Å; K68-E72 PolarHBondContact O-N 3.45Å; K68-E72 VanDerWaalsContact O-N 3.1Å; K68-L81 HydrophobicContact CB-CD1 4.26Å; K68-L81 HydrophobicContact CB-CD2 4.27Å
69	Y	97.9	Very high	97.7	Very high	55 Å²	55	82.4 Å²	82.4	22%	0.216	41%	0.414	C	S	.	.	H	α-helix	trans	-61.9	-39.6	178	168.7	-97.4	0	0	0	113.1	V65 F66 E72 R78 L81 Q82	V65-Y69 WeakPolarHBondContact O-CB 3.48Å; V65-Y69 PolarHBondContact O-N 3.04Å; F66-Y69 WeakPolarHBondContact O-CB 3.34Å; F66-Y69 PolarHBondContact O-N 3.25Å; Y69-E72 PolarHBondContact O-N 3.39Å; Y69-R78 HydrophobicContact CD2-CG 3.71Å; Y69-R78 WeakPolarHBondContact CD2-O 3.3Å; Y69-R78 HydrophobicContact CE2-CG 3.39Å; Y69-R78 WeakPolarHBondContact CE2-O 3.42Å; Y69-R78 PolarHBondContact O-NH1 3.16Å; Y69-R78 VanDerWaalsContact O-NH1 3.16Å; Y69-L81 HydrophobicContact CD2-CB 4.15Å; Y69-Q82 HydrophobicContact CD2-CB 4.22Å; Y69-Q82 HydrophobicContact CE2-CB 3.86Å; Y69-Q82 HydrophobicContact CE2-CG 4.37Å
70	K	96.9	Very high	97.7	Very high	115 Å²	115	88.5 Å²	88.5	50%	0.5	43%	0.433	S	S	.	.	H	α-helix	trans	-63.2	-45.6	-179.7	177.4	-173.3	175	-166.1	0	111.4	F66 E67 K68 R78	F66-K70 HydrophobicContact CE1-CD 4.13Å; F66-K70 VanDerWaalsContact O-CB 3.22Å; F66-K70 WeakPolarHBondContact O-CB 3.27Å; F66-K70 PolarHBondContact O-N 3.34Å; E67-K70 PolarHBondContact O-N 3.33Å; E67-K70 WeakPolarHBondContact OE1-CD 3.26Å; E67-K70 IonicContact OE1-NZ 2.66Å; E67-K70 PolarHBondContact OE1-NZ 3.34Å; E67-K70 WeakPolarHBondContact OE2-CD 3.49Å; E67-K70 IonicContact OE2-NZ 3.14Å; E67-K70 PolarHBondContact OE2-NZ 3.46Å; K68-K70 VanDerWaalsContact C-N 3.35Å; K68-K70 PolarHBondContact O-N 2.91Å; K70-R78 PolarHBondContact O-NH1 3.46Å
71	G	95.3	Very high	97.7	Very high	56 Å²	56	85 Å²	85	58%	0.577	42%	0.419	S	S	*	.	H	α-helix	trans	-78.1	-17.4	177	0	0	0	0	0	115.7	E67 K68	E67-G71 PolarHBondContact O-N 2.96Å; E67-G71 VanDerWaalsContact O-N 3.17Å; K68-G71 PolarHBondContact O-N 3.33Å
72	E	97.9	Very high	97.7	Very high	40 Å²	40	86.1 Å²	86.1	19%	0.187	42%	0.424	C	S	.	.			trans	-71.4	130.2	-174	-176.5	57.9	-86.5	0	0	113.2	K68 Y69 D74 Q77 R78 L81	K68-E72 WeakPolarHBondContact O-CB 3.4Å; K68-E72 PolarHBondContact O-N 3.45Å; K68-E72 VanDerWaalsContact O-N 3.1Å; Y69-E72 PolarHBondContact O-N 3.39Å; E72-D74 PolarHBondContact OE1-N 2.89Å; E72-Q77 HydrophobicContact CG-CB 3.76Å; E72-Q77 WeakPolarHBondContact OE2-CB 3.25Å; E72-Q77 PolarHBondContact OE2-NE2 3.19Å; E72-R78 HydrophobicContact CB-CB 4.27Å; E72-R78 HydrophobicContact CG-CB 3.84Å; E72-R78 PolarHBondContact O-NH1 2.86Å; E72-L81 HydrophobicContact CB-CD1 3.91Å; E72-L81 HydrophobicContact CG-CD1 4.05Å
73	Q	96.8	Very high	97.7	Very high	175 Å²	175	88.8 Å²	88.8	82%	0.818	44%	0.437	S	S	*	.			trans	-104.6	-27.8	-177	-59.7	-71.7	14.4	0	0	112.5	S75	Q73-S75 PolarHBondContact O-N 2.86Å
74	D	97.9	Very high	97.7	Very high	60 Å²	60	87.4 Å²	87.4	32%	0.321	43%	0.427	S	S	.	.			trans	-73.1	126.1	174.8	170.9	47.9	0	0	0	111.2	E72 A76 Q77 R78	E72-D74 PolarHBondContact OE1-N 2.89Å; D74-A76 VanDerWaalsContact C-N 3.25Å; D74-A76 PolarHBondContact O-N 3.36Å; D74-A76 PolarHBondContact OD1-N 2.76Å; D74-A76 WeakPolarHBondContact OD2-CA 3.49Å; D74-A76 VanDerWaalsContact OD2-CB 3.31Å; D74-A76 WeakPolarHBondContact OD2-CB 3.27Å; D74-A76 PolarHBondContact OD2-N 3.5Å; D74-Q77 HydrophobicContact CB-CB 4.15Å; D74-Q77 HydrophobicContact CB-CG 4.29Å; D74-Q77 PolarHBondContact O-N 2.85Å; D74-Q77 WeakPolarHBondContact OD2-CG 3.36Å; D74-Q77 PolarHBondContact OD2-N 3.19Å; D74-R78 WeakPolarHBondContact O-CB 3.41Å; D74-R78 PolarHBondContact O-N 2.96Å
75	S	96.8	Very high	97.7	Very high	97 Å²	97	83 Å²	83	68%	0.678	41%	0.407	S	S	*	.	H	α-helix	trans	-57.8	-30.9	178.2	66.9	0	0	0	0	114.4	Q73 K79	Q73-S75 PolarHBondContact O-N 2.86Å; S75-K79 VanDerWaalsContact O-CB 3.3Å; S75-K79 WeakPolarHBondContact O-CB 3.41Å; S75-K79 PolarHBondContact O-N 3.47Å
76	A	97.8	Very high	97.7	Very high	49 Å²	49	88.6 Å²	88.6	41%	0.405	43%	0.433	S	S	.	.	H	α-helix	trans	-83.5	-41.9	-179.2	0	0	0	0	0	112	D74 K79 R80	D74-A76 VanDerWaalsContact C-N 3.25Å; D74-A76 PolarHBondContact O-N 3.36Å; D74-A76 PolarHBondContact OD1-N 2.76Å; D74-A76 WeakPolarHBondContact OD2-CA 3.49Å; D74-A76 VanDerWaalsContact OD2-CB 3.31Å; D74-A76 WeakPolarHBondContact OD2-CB 3.27Å; D74-A76 PolarHBondContact OD2-N 3.5Å; A76-K79 PolarHBondContact O-N 3.39Å; A76-R80 WeakPolarHBondContact O-CG 3.44Å; A76-R80 PolarHBondContact O-N 3.44Å; A76-R80 VanDerWaalsContact O-N 3.07Å
77	Q	97.4	Very high	97.7	Very high	95 Å²	95	92.6 Å²	92.6	44%	0.444	45%	0.445	S	S	.	.	H	α-helix	trans	-64.1	-47.1	172.1	-70.4	171.3	-117.6	0	0	111.2	E72 D74 K79 R80 L81	E72-Q77 HydrophobicContact CG-CB 3.76Å; E72-Q77 WeakPolarHBondContact OE2-CB 3.25Å; E72-Q77 PolarHBondContact OE2-NE2 3.19Å; D74-Q77 HydrophobicContact CB-CB 4.15Å; D74-Q77 HydrophobicContact CB-CG 4.29Å; D74-Q77 PolarHBondContact O-N 2.85Å; D74-Q77 WeakPolarHBondContact OD2-CG 3.36Å; D74-Q77 PolarHBondContact OD2-N 3.19Å; Q77-K79 VanDerWaalsContact C-N 3.25Å; Q77-K79 PolarHBondContact O-N 2.97Å; Q77-R80 WeakPolarHBondContact O-CA 3.44Å; Q77-R80 WeakPolarHBondContact O-CB 3.49Å; Q77-R80 PolarHBondContact O-N 2.99Å; Q77-L81 PolarHBondContact O-N 2.96Å
78	R	97.6	Very high	97.7	Very high	80 Å²	80	88 Å²	88	30%	0.302	43%	0.425	S	S	.	.	H	α-helix	trans	-56.4	-40.5	176.3	-169.2	171.4	-174.1	108.6	6.2	111.6	Y69 K70 E72 D74 L81 Q82	Y69-R78 HydrophobicContact CD2-CG 3.71Å; Y69-R78 WeakPolarHBondContact CD2-O 3.3Å; Y69-R78 HydrophobicContact CE2-CG 3.39Å; Y69-R78 WeakPolarHBondContact CE2-O 3.42Å; Y69-R78 PolarHBondContact O-NH1 3.16Å; Y69-R78 VanDerWaalsContact O-NH1 3.16Å; K70-R78 PolarHBondContact O-NH1 3.46Å; E72-R78 HydrophobicContact CB-CB 4.27Å; E72-R78 HydrophobicContact CG-CB 3.84Å; E72-R78 PolarHBondContact O-NH1 2.86Å; D74-R78 WeakPolarHBondContact O-CB 3.41Å; D74-R78 PolarHBondContact O-N 2.96Å; R78-L81 PolarHBondContact O-N 2.62Å; R78-Q82 WeakPolarHBondContact O-CB 3.28Å; R78-Q82 PolarHBondContact O-N 3.21Å
79	K	97.9	Very high	97.8	Very high	136 Å²	136	86.9 Å²	86.9	59%	0.591	42%	0.423	S	S	*	.	H	α-helix	trans	-70.3	-30.8	175	-172.3	167.9	-175.5	169.9	0	113.9	S75 A76 Q77 I83	S75-K79 VanDerWaalsContact O-CB 3.3Å; S75-K79 WeakPolarHBondContact O-CB 3.41Å; S75-K79 PolarHBondContact O-N 3.47Å; A76-K79 PolarHBondContact O-N 3.39Å; Q77-K79 VanDerWaalsContact C-N 3.25Å; Q77-K79 PolarHBondContact O-N 2.97Å; K79-I83 HydrophobicContact CG-CD1 4.48Å; K79-I83 WeakPolarHBondContact O-CD1 3.46Å; K79-I83 WeakPolarHBondContact O-CG1 3.31Å; K79-I83 PolarHBondContact O-N 2.98Å
80	R	98.1	Very high	97.8	Very high	183 Å²	183	88 Å²	88	69%	0.691	43%	0.432	S	S	*	.	H	α-helix	trans	-68.4	-46.5	171.8	-69.8	169.9	-171.5	-171.5	4.3	110.9	A76 Q77 Q82 I83 Q84	A76-R80 WeakPolarHBondContact O-CG 3.44Å; A76-R80 PolarHBondContact O-N 3.44Å; A76-R80 VanDerWaalsContact O-N 3.07Å; Q77-R80 WeakPolarHBondContact O-CA 3.44Å; Q77-R80 WeakPolarHBondContact O-CB 3.49Å; Q77-R80 PolarHBondContact O-N 2.99Å; R80-Q82 VanDerWaalsContact C-N 3.32Å; R80-Q82 PolarHBondContact O-N 3.25Å; R80-I83 PolarHBondContact O-N 3.45Å; R80-I83 VanDerWaalsContact O-N 3.1Å; R80-Q84 PolarHBondContact O-N 3.47Å
81	L	98.2	Very high	97.9	Very high	26 Å²	26	85.9 Å²	85.9	14%	0.136	43%	0.426	C	S	.	.	H	α-helix	trans	-61.6	-39.5	177	-67.9	167.4	0	0	0	111.5	V65 K68 Y69 E72 Q77 R78 I83 Q84 L85	V65-L81 HydrophobicContact CG1-CD2 4.32Å; K68-L81 HydrophobicContact CB-CD1 4.26Å; K68-L81 HydrophobicContact CB-CD2 4.27Å; Y69-L81 HydrophobicContact CD2-CB 4.15Å; E72-L81 HydrophobicContact CB-CD1 3.91Å; E72-L81 HydrophobicContact CG-CD1 4.05Å; Q77-L81 PolarHBondContact O-N 2.96Å; R78-L81 PolarHBondContact O-N 2.62Å; L81-I83 VanDerWaalsContact C-N 3.3Å; L81-I83 PolarHBondContact O-N 2.67Å; L81-Q84 PolarHBondContact O-N 2.92Å; L81-L85 WeakPolarHBondContact O-CB 3.47Å; L81-L85 PolarHBondContact O-N 3.04Å
82	Q	98.1	Very high	98	Very high	103 Å²	103	84 Å²	84	48%	0.481	40%	0.404	S	S	.	.	H	α-helix	trans	-57.6	-40.9	172.4	-169.4	-176.9	10.7	0	0	112.7	Y69 R78 R80 Q86	Y69-Q82 HydrophobicContact CD2-CB 4.22Å; Y69-Q82 HydrophobicContact CE2-CB 3.86Å; Y69-Q82 HydrophobicContact CE2-CG 4.37Å; R78-Q82 WeakPolarHBondContact O-CB 3.28Å; R78-Q82 PolarHBondContact O-N 3.21Å; R80-Q82 VanDerWaalsContact C-N 3.32Å; R80-Q82 PolarHBondContact O-N 3.25Å; Q82-Q86 WeakPolarHBondContact O-CB 3.24Å; Q82-Q86 PolarHBondContact O-N 2.87Å
83	I	98.3	Very high	98	Very high	73 Å²	73	88 Å²	88	37%	0.374	42%	0.423	S	S	.	.	H	α-helix	trans	-72.6	-33.1	178.6	-67.2	165.6	0	0	0	111.3	K79 R80 L81 R87	K79-I83 HydrophobicContact CG-CD1 4.48Å; K79-I83 WeakPolarHBondContact O-CD1 3.46Å; K79-I83 WeakPolarHBondContact O-CG1 3.31Å; K79-I83 PolarHBondContact O-N 2.98Å; R80-I83 PolarHBondContact O-N 3.45Å; R80-I83 VanDerWaalsContact O-N 3.1Å; L81-I83 VanDerWaalsContact C-N 3.3Å; L81-I83 PolarHBondContact O-N 2.67Å; I83-R87 WeakPolarHBondContact O-CD 3.24Å; I83-R87 VanDerWaalsContact O-CG 3.3Å; I83-R87 WeakPolarHBondContact O-CG 3.35Å; I83-R87 PolarHBondContact O-N 2.88Å
84	Q	98.2	Very high	98.1	Very high	79 Å²	79	84.7 Å²	84.7	37%	0.369	41%	0.407	S	S	.	.	H	α-helix	trans	-67.7	-48.6	172.3	-175.2	174	-2.9	0	0	111	E61 V65 R80 L81 Q86 R87 A88	E61-Q84 PolarHBondContact OE1-NE2 3.27Å; V65-Q84 HydrophobicContact CG1-CB 4.09Å; V65-Q84 HydrophobicContact CG1-CG 4.11Å; V65-Q84 HydrophobicContact CG2-CG 4.01Å; R80-Q84 PolarHBondContact O-N 3.47Å; L81-Q84 PolarHBondContact O-N 2.92Å; Q84-Q86 VanDerWaalsContact C-N 3.31Å; Q84-Q86 PolarHBondContact O-N 2.95Å; Q84-R87 WeakPolarHBondContact O-CB 3.12Å; Q84-R87 PolarHBondContact O-N 2.94Å; Q84-A88 PolarHBondContact O-N 3.16Å
85	L	98.3	Very high	98.1	Very high	22 Å²	22	82.4 Å²	82.4	12%	0.115	40%	0.395	C	S	.	.	H	α-helix	trans	-56.8	-44.2	176.8	-172.2	64	0	0	0	111.4	V62 V65 F66 L81 R87 A88 L89	V62-L85 HydrophobicContact CB-CD1 4.46Å; V62-L85 HydrophobicContact CG1-CD1 3.94Å; V62-L85 WeakPolarHBondContact O-CD1 3.5Å; V65-L85 HydrophobicContact CB-CD1 4.46Å; V65-L85 HydrophobicContact CG1-CB 3.93Å; V65-L85 HydrophobicContact CG1-CD1 4.41Å; F66-L85 HydrophobicContact CB-CD1 4.18Å; F66-L85 HydrophobicContact CD2-CD2 4.1Å; L81-L85 WeakPolarHBondContact O-CB 3.47Å; L81-L85 PolarHBondContact O-N 3.04Å; L85-R87 VanDerWaalsContact C-N 3.28Å; L85-R87 PolarHBondContact O-N 3.49Å; L85-A88 PolarHBondContact O-N 2.63Å; L85-L89 HydrophobicContact CG-CD1 4.08Å; L85-L89 WeakPolarHBondContact O-CB 3.48Å; L85-L89 VanDerWaalsContact O-CG 3.26Å; L85-L89 WeakPolarHBondContact O-CG 3.38Å; L85-L89 PolarHBondContact O-N 3.24Å
86	Q	98.4	Very high	98.2	Very high	118 Å²	118	78.7 Å²	78.7	55%	0.551	37%	0.372	S	S	*	.	H	α-helix	trans	-59.9	-36.6	175.7	-174.2	176.5	15.2	0	0	112.6	Q82 Q84 I90	Q82-Q86 WeakPolarHBondContact O-CB 3.24Å; Q82-Q86 PolarHBondContact O-N 2.87Å; Q84-Q86 VanDerWaalsContact C-N 3.31Å; Q84-Q86 PolarHBondContact O-N 2.95Å; Q86-I90 HydrophobicContact CG-CD1 4.09Å; Q86-I90 WeakPolarHBondContact O-CD1 3.32Å; Q86-I90 VanDerWaalsContact O-CG1 3.24Å; Q86-I90 WeakPolarHBondContact O-CG1 3.39Å; Q86-I90 PolarHBondContact O-N 3Å; Q86-I90 VanDerWaalsContact O-N 3.08Å
87	R	98.4	Very high	98.2	Very high	176 Å²	176	80.5 Å²	80.5	66%	0.664	38%	0.375	S	S	*	.	H	α-helix	trans	-72.5	-43.8	177.5	-70.8	166.2	178.2	-166.7	-2.8	112.2	I83 Q84 L85 L89 I90 L91	I83-R87 WeakPolarHBondContact O-CD 3.24Å; I83-R87 VanDerWaalsContact O-CG 3.3Å; I83-R87 WeakPolarHBondContact O-CG 3.35Å; I83-R87 PolarHBondContact O-N 2.88Å; Q84-R87 WeakPolarHBondContact O-CB 3.12Å; Q84-R87 PolarHBondContact O-N 2.94Å; L85-R87 VanDerWaalsContact C-N 3.28Å; L85-R87 PolarHBondContact O-N 3.49Å; R87-L89 VanDerWaalsContact C-N 3.29Å; R87-L89 PolarHBondContact O-N 2.69Å; R87-I90 PolarHBondContact O-N 2.84Å; R87-L91 WeakPolarHBondContact O-CB 3.41Å; R87-L91 PolarHBondContact O-N 3.38Å
88	A	98.2	Very high	98.3	Very high	4 Å²	4	80.5 Å²	80.5	3%	0.033	38%	0.375	C	S	.	.	H	α-helix	trans	-63.1	-38.3	177.1	0	0	0	0	0	111.2	V58 V62 Q84 L85 L91 S92	V58-A88 WeakPolarHBondContact CG1-O 3.42Å; V62-A88 HydrophobicContact CG2-CB 3.61Å; Q84-A88 PolarHBondContact O-N 3.16Å; L85-A88 PolarHBondContact O-N 2.63Å; A88-L91 PolarHBondContact O-N 3.42Å; A88-S92 WeakPolarHBondContact O-CB 3.21Å; A88-S92 PolarHBondContact O-N 3.32Å
89	L	98.4	Very high	98.3	Very high	83 Å²	83	79 Å²	79	44%	0.435	37%	0.37	S	S	.	.	H	α-helix	trans	-64.5	-44.4	172.8	-71.8	169.8	0	0	0	112.7	V62 L85 R87 S92 Q93	V62-L89 HydrophobicContact CG1-CD2 3.92Å; V62-L89 HydrophobicContact CG2-CD2 4.17Å; V62-L89 HydrophobicContact CG2-CG 4.39Å; L85-L89 HydrophobicContact CG-CD1 4.08Å; L85-L89 WeakPolarHBondContact O-CB 3.48Å; L85-L89 VanDerWaalsContact O-CG 3.26Å; L85-L89 WeakPolarHBondContact O-CG 3.38Å; L85-L89 PolarHBondContact O-N 3.24Å; R87-L89 VanDerWaalsContact C-N 3.29Å; R87-L89 PolarHBondContact O-N 2.69Å; L89-S92 PolarHBondContact O-N 2.66Å; L89-S92 PolarHBondContact O-OG 3.49Å; L89-Q93 PolarHBondContact O-N 3.02Å
90	I	98.5	Very high	98.3	Very high	77 Å²	77	77.6 Å²	77.6	40%	0.395	37%	0.368	S	S	.	.	H	α-helix	trans	-60.6	-46.8	175.1	-70.9	163.4	0	0	0	110.6	Q86 R87 S92 Q93 E94	Q86-I90 HydrophobicContact CG-CD1 4.09Å; Q86-I90 WeakPolarHBondContact O-CD1 3.32Å; Q86-I90 VanDerWaalsContact O-CG1 3.24Å; Q86-I90 WeakPolarHBondContact O-CG1 3.39Å; Q86-I90 PolarHBondContact O-N 3Å; Q86-I90 VanDerWaalsContact O-N 3.08Å; R87-I90 PolarHBondContact O-N 2.84Å; I90-S92 VanDerWaalsContact C-N 3.29Å; I90-S92 PolarHBondContact O-N 2.75Å; I90-Q93 WeakPolarHBondContact O-CA 3.17Å; I90-Q93 WeakPolarHBondContact O-CB 3.2Å; I90-Q93 PolarHBondContact O-N 3.37Å; I90-E94 HydrophobicContact CG2-CG 4.36Å; I90-E94 WeakPolarHBondContact O-CG 3.42Å; I90-E94 PolarHBondContact O-N 3.39Å
91	L	98.5	Very high	98.4	Very high	72 Å²	72	74.8 Å²	74.8	38%	0.377	36%	0.363	S	S	.	.	H	α-helix	trans	-62.2	-35.3	176.7	-179.1	61.1	0	0	0	112.3	V58 R87 A88 Q93 E94 L95	V58-L91 HydrophobicContact CG1-CB 4.47Å; V58-L91 HydrophobicContact CG1-CD2 4.49Å; V58-L91 HydrophobicContact CG1-CG 4.41Å; V58-L91 HydrophobicContact CG2-CD2 3.72Å; V58-L91 HydrophobicContact CG2-CG 4.07Å; R87-L91 WeakPolarHBondContact O-CB 3.41Å; R87-L91 PolarHBondContact O-N 3.38Å; A88-L91 PolarHBondContact O-N 3.42Å; L91-Q93 VanDerWaalsContact C-N 3.31Å; L91-Q93 PolarHBondContact O-N 2.95Å; L91-E94 PolarHBondContact O-N 2.94Å; L91-L95 HydrophobicContact CD1-CD1 4.36Å; L91-L95 HydrophobicContact CD1-CG 4.36Å; L91-L95 HydrophobicContact CG-CD1 4.16Å; L91-L95 WeakPolarHBondContact O-CB 3.17Å; L91-L95 VanDerWaalsContact O-CG 3.31Å; L91-L95 WeakPolarHBondContact O-CG 3.15Å; L91-L95 PolarHBondContact O-N 2.89Å
92	S	98.4	Very high	98.4	Very high	17 Å²	17	73.8 Å²	73.8	12%	0.119	36%	0.358	C	S	.	.	H	α-helix	trans	-66.2	-33.8	174	78.1	0	0	0	0	112.3	Y55 A88 L89 I90 G96	Y55-S92 VanDerWaalsContact CE2-O 3.32Å; Y55-S92 WeakPolarHBondContact CE2-O 3.24Å; A88-S92 WeakPolarHBondContact O-CB 3.21Å; A88-S92 PolarHBondContact O-N 3.32Å; L89-S92 PolarHBondContact O-N 2.66Å; L89-S92 PolarHBondContact O-OG 3.49Å; I90-S92 VanDerWaalsContact C-N 3.29Å; I90-S92 PolarHBondContact O-N 2.75Å; S92-G96 PolarHBondContact O-N 3.18Å
93	Q	98.6	Very high	98.4	Very high	124 Å²	124	72.2 Å²	72.2	58%	0.579	36%	0.355	S	S	*	.	H	α-helix	trans	-70.1	-47.1	173.1	-176.3	-178.9	-13.6	0	0	111.1	L89 I90 L91 L95 G96 D97	L89-Q93 PolarHBondContact O-N 3.02Å; I90-Q93 WeakPolarHBondContact O-CA 3.17Å; I90-Q93 WeakPolarHBondContact O-CB 3.2Å; I90-Q93 PolarHBondContact O-N 3.37Å; L91-Q93 VanDerWaalsContact C-N 3.31Å; L91-Q93 PolarHBondContact O-N 2.95Å; Q93-L95 VanDerWaalsContact C-N 3.33Å; Q93-L95 PolarHBondContact O-N 3.04Å; Q93-G96 CarbonylContact O-C 3.52Å; Q93-G96 WeakPolarHBondContact O-CA 3.34Å; Q93-G96 PolarHBondContact O-N 3.25Å; Q93-D97 PolarHBondContact O-N 2.91Å
94	E	98.4	Very high	98.4	Very high	104 Å²	104	71.5 Å²	71.5	49%	0.486	35%	0.354	S	S	.	.	H	α-helix	trans	-56.5	-45.5	178.2	-69.4	168.5	162.4	0	0	111.3	I90 L91 G96 D97 E98	I90-E94 HydrophobicContact CG2-CG 4.36Å; I90-E94 WeakPolarHBondContact O-CG 3.42Å; I90-E94 PolarHBondContact O-N 3.39Å; L91-E94 PolarHBondContact O-N 2.94Å; E94-G96 VanDerWaalsContact C-N 3.32Å; E94-G96 PolarHBondContact O-N 2.94Å; E94-D97 PolarHBondContact O-N 3.38Å; E94-E98 PolarHBondContact O-N 2.81Å
95	L	98.4	Very high	98.4	Very high	12 Å²	12	71.5 Å²	71.5	6%	0.063	35%	0.354	C	S	.	.	H	α-helix	trans	-67.2	-29.2	173.3	-68.3	168.1	0	0	0	113.1	I51 K54 Y55 V58 L91 Q93 K99	I51-L95 HydrophobicContact CG2-CB 4.23Å; I51-L95 HydrophobicContact CG2-CD2 3.89Å; I51-L95 WeakPolarHBondContact CG2-O 3.31Å; K54-L95 HydrophobicContact CB-CD1 4.11Å; K54-L95 HydrophobicContact CB-CD2 4.1Å; K54-L95 HydrophobicContact CD-CD2 4.25Å; Y55-L95 HydrophobicContact CD2-CB 4.1Å; V58-L95 HydrophobicContact CB-CD1 4.39Å; V58-L95 HydrophobicContact CG2-CD1 3.82Å; L91-L95 HydrophobicContact CD1-CD1 4.36Å; L91-L95 HydrophobicContact CD1-CG 4.36Å; L91-L95 HydrophobicContact CG-CD1 4.16Å; L91-L95 WeakPolarHBondContact O-CB 3.17Å; L91-L95 VanDerWaalsContact O-CG 3.31Å; L91-L95 WeakPolarHBondContact O-CG 3.15Å; L91-L95 PolarHBondContact O-N 2.89Å; Q93-L95 VanDerWaalsContact C-N 3.33Å; Q93-L95 PolarHBondContact O-N 3.04Å; L95-K99 VanDerWaalsContact O-CG 3.31Å; L95-K99 WeakPolarHBondContact O-CG 3.27Å; L95-K99 PolarHBondContact O-N 3.03Å; L95-K99 VanDerWaalsContact O-N 3.13Å
96	G	98.3	Very high	98.4	Very high	19 Å²	19	72.2 Å²	72.2	20%	0.196	36%	0.357	C	S	.	.	H	α-helix	trans	-67.5	-45	173.4	0	0	0	0	0	112.2	S92 Q93 E94 K99 I100	S92-G96 PolarHBondContact O-N 3.18Å; Q93-G96 CarbonylContact O-C 3.52Å; Q93-G96 WeakPolarHBondContact O-CA 3.34Å; Q93-G96 PolarHBondContact O-N 3.25Å; E94-G96 VanDerWaalsContact C-N 3.32Å; E94-G96 PolarHBondContact O-N 2.94Å; G96-K99 WeakPolarHBondContact O-CB 3.43Å; G96-K99 PolarHBondContact O-N 2.85Å; G96-I100 WeakPolarHBondContact O-CG1 3.38Å; G96-I100 PolarHBondContact O-N 2.92Å
97	D	98.5	Very high	98.3	Very high	88 Å²	88	69.9 Å²	69.9	47%	0.471	35%	0.351	S	S	.	.	H	α-helix	trans	-65.7	-39.5	177	-65.6	-26.3	0	0	0	111	Q93 E94 K99 I100 H101	Q93-D97 PolarHBondContact O-N 2.91Å; E94-D97 PolarHBondContact O-N 3.38Å; D97-K99 PolarHBondContact O-N 3.38Å; D97-I100 PolarHBondContact O-N 3.48Å; D97-H101 PolarHBondContact O-N 3.03Å
98	E	98.4	Very high	98.3	Very high	94 Å²	94	67.3 Å²	67.3	44%	0.439	35%	0.347	S	S	.	.	H	α-helix	trans	-58.3	-44.9	170.5	-76.4	-176.4	-177.6	0	0	112.3	I51 E94 I100 H101 V102	I51-E98 HydrophobicContact CD1-CB 4.2Å; I51-E98 HydrophobicContact CG2-CB 4.23Å; E94-E98 PolarHBondContact O-N 2.81Å; E98-I100 PolarHBondContact O-N 3.48Å; E98-H101 PolarHBondContact O-N 2.88Å; E98-V102 WeakPolarHBondContact O-CG2 3.37Å; E98-V102 PolarHBondContact O-N 3.37Å; E98-V102 VanDerWaalsContact O-N 3.09Å
99	K	98.3	Very high	98.2	Very high	49 Å²	49	69.8 Å²	69.8	21%	0.213	36%	0.359	C	S	.	.	H	α-helix	trans	-63.2	-41.3	176.9	-73.7	173.1	52.5	173.7	0	112.5	L48 I51 D52 L95 G96 D97 H101 V102 V103	L48-K99 HydrophobicContact CD1-CB 3.96Å; L48-K99 HydrophobicContact CD1-CG 3.91Å; I51-K99 HydrophobicContact CB-CG 4Å; I51-K99 HydrophobicContact CG2-CD 4.18Å; I51-K99 HydrophobicContact CG2-CG 3.55Å; D52-K99 VanDerWaalsContact OD1-CE 3.25Å; D52-K99 WeakPolarHBondContact OD1-CE 3.48Å; D52-K99 IonicContact OD1-NZ 2.75Å; D52-K99 PolarHBondContact OD1-NZ 3.4Å; L95-K99 VanDerWaalsContact O-CG 3.31Å; L95-K99 WeakPolarHBondContact O-CG 3.27Å; L95-K99 PolarHBondContact O-N 3.03Å; L95-K99 VanDerWaalsContact O-N 3.13Å; G96-K99 WeakPolarHBondContact O-CB 3.43Å; G96-K99 PolarHBondContact O-N 2.85Å; D97-K99 PolarHBondContact O-N 3.38Å; K99-H101 VanDerWaalsContact C-N 3.34Å; K99-V102 PolarHBondContact O-N 2.99Å; K99-V103 WeakPolarHBondContact O-CG2 3.21Å; K99-V103 PolarHBondContact O-N 3.17Å; K99-V103 VanDerWaalsContact O-N 3.1Å
100	I	98.4	Very high	98.1	Very high	106 Å²	106	69.1 Å²	69.1	54%	0.544	36%	0.358	S	S	.	.	H	α-helix	trans	-60.6	-47.1	175.9	-69.1	166.9	0	0	0	109.3	G96 D97 E98 V102 V103 T104	G96-I100 WeakPolarHBondContact O-CG1 3.38Å; G96-I100 PolarHBondContact O-N 2.92Å; D97-I100 PolarHBondContact O-N 3.48Å; E98-I100 PolarHBondContact O-N 3.48Å; I100-V102 PolarHBondContact O-N 3.09Å; I100-V103 PolarHBondContact O-N 3.24Å; I100-T104 PolarHBondContact O-N 2.99Å; I100-T104 PolarHBondContact O-OG1 2.92Å
101	H	98.5	Very high	97.9	Very high	125 Å²	125	69.8 Å²	69.8	58%	0.579	36%	0.36	S	S	*	.	H	α-helix	trans	-57.7	-44.9	178.8	-178.2	48.9	0	0	0	113.1	D97 E98 K99 V103 T104 Q105	D97-H101 PolarHBondContact O-N 3.03Å; E98-H101 PolarHBondContact O-N 2.88Å; K99-H101 VanDerWaalsContact C-N 3.34Å; H101-V103 PolarHBondContact O-N 3.26Å; H101-T104 PolarHBondContact O-N 3.01Å; H101-Q105 WeakPolarHBondContact O-CB 3.46Å; H101-Q105 PolarHBondContact O-N 3.35Å
102	V	98.4	Very high	97.7	Very high	5 Å²	5	71.6 Å²	71.6	3%	0.03	37%	0.37	C	S	.	.	H	α-helix	trans	-64.2	-40.5	177.1	175.9	0	0	0	0	111.9	N44 L47 L48 I51 E98 K99 I100 Q105 M106	N44-V102 HydrophobicContact CB-CG1 4.05Å; N44-V102 WeakPolarHBondContact O-CG1 3.42Å; L47-V102 HydrophobicContact CD2-CG2 3.74Å; L47-V102 HydrophobicContact CG-CG2 4.1Å; L48-V102 HydrophobicContact CB-CG1 4.09Å; I51-V102 HydrophobicContact CD1-CG2 3.92Å; E98-V102 WeakPolarHBondContact O-CG2 3.37Å; E98-V102 PolarHBondContact O-N 3.37Å; E98-V102 VanDerWaalsContact O-N 3.09Å; K99-V102 PolarHBondContact O-N 2.99Å; I100-V102 PolarHBondContact O-N 3.09Å; V102-Q105 PolarHBondContact O-N 3.07Å; V102-M106 HydrophobicContact CG1-SD 4.34Å; V102-M106 VanDerWaalsContact O-CG 3.3Å; V102-M106 WeakPolarHBondContact O-CG 3.29Å; V102-M106 PolarHBondContact O-N 3.37Å
103	V	98.4	Very high	97.4	Very high	69 Å²	69	72.9 Å²	72.9	42%	0.418	37%	0.372	S	S	.	.	H	α-helix	trans	-69.3	-37.3	177.3	173.5	0	0	0	0	111.8	L48 K99 I100 H101 M106 T107	L48-V103 HydrophobicContact CD1-CG2 4.07Å; L48-V103 HydrophobicContact CD2-CG2 3.95Å; K99-V103 WeakPolarHBondContact O-CG2 3.21Å; K99-V103 PolarHBondContact O-N 3.17Å; K99-V103 VanDerWaalsContact O-N 3.1Å; I100-V103 PolarHBondContact O-N 3.24Å; H101-V103 PolarHBondContact O-N 3.26Å; V103-M106 PolarHBondContact O-N 3.11Å; V103-T107 PolarHBondContact O-N 3.48Å; V103-T107 PolarHBondContact O-OG1 3.5Å
104	T	98.3	Very high	97	Very high	59 Å²	59	69.8 Å²	69.8	36%	0.362	36%	0.364	S	S	.	.	H	α-helix	trans	-60.4	-50.1	170.6	-66.1	0	0	0	0	110.7	I100 H101 M106 T107 E108	I100-T104 PolarHBondContact O-N 2.99Å; I100-T104 PolarHBondContact O-OG1 2.92Å; H101-T104 PolarHBondContact O-N 3.01Å; T104-M106 VanDerWaalsContact C-N 3.33Å; T104-M106 PolarHBondContact O-N 3.38Å; T104-T107 WeakPolarHBondContact O-CA 3.08Å; T104-T107 WeakPolarHBondContact O-CB 3.4Å; T104-T107 PolarHBondContact O-N 3.33Å; T104-E108 HydrophobicContact CG2-CG 4.26Å; T104-E108 WeakPolarHBondContact CG2-OE1 3.27Å; T104-E108 WeakPolarHBondContact O-CG 3.29Å; T104-E108 PolarHBondContact O-N 2.77Å
105	Q	97.9	Very high	96.7	Very high	79 Å²	79	72.2 Å²	72.2	37%	0.369	37%	0.369	S	S	.	.	H	α-helix	trans	-58.2	-42	177.8	-174.8	175.7	23.8	0	0	112.4	N44 H101 V102 T107 L109	N44-Q105 PolarHBondContact OD1-OE1 3.5Å; H101-Q105 WeakPolarHBondContact O-CB 3.46Å; H101-Q105 PolarHBondContact O-N 3.35Å; V102-Q105 PolarHBondContact O-N 3.07Å; Q105-T107 VanDerWaalsContact C-N 3.31Å; Q105-T107 PolarHBondContact O-N 3.45Å; Q105-L109 HydrophobicContact CG-CD1 4.23Å; Q105-L109 WeakPolarHBondContact O-CB 3.42Å; Q105-L109 WeakPolarHBondContact O-CD1 3.38Å; Q105-L109 VanDerWaalsContact O-CG 3.24Å; Q105-L109 WeakPolarHBondContact O-CG 3.43Å; Q105-L109 PolarHBondContact O-N 3.05Å
106	M	97.8	Very high	96.1	Very high	37 Å²	37	74 Å²	74	18%	0.182	38%	0.377	C	S	.	.	H	α-helix	trans	-60.7	-39.7	173.5	-73.7	173.4	60.1	0	0	112.7	I41 N44 V45 V102 V103 T104 V110	I41-M106 HydrophobicContact CG2-CE 4.32Å; N44-M106 HydrophobicContact CB-CG 3.31Å; N44-M106 HydrophobicContact CB-SD 3.67Å; V45-M106 HydrophobicContact CG2-CE 3.56Å; V45-M106 HydrophobicContact CG2-SD 4.19Å; V102-M106 HydrophobicContact CG1-SD 4.34Å; V102-M106 VanDerWaalsContact O-CG 3.3Å; V102-M106 WeakPolarHBondContact O-CG 3.29Å; V102-M106 PolarHBondContact O-N 3.37Å; V103-M106 PolarHBondContact O-N 3.11Å; T104-M106 VanDerWaalsContact C-N 3.33Å; T104-M106 PolarHBondContact O-N 3.38Å; M106-V110 WeakPolarHBondContact O-CG2 3.33Å; M106-V110 PolarHBondContact O-N 3.23Å
107	T	98.1	Very high	95.5	Very high	69 Å²	69	74.8 Å²	74.8	42%	0.423	38%	0.376	S	S	.	.	H	α-helix	trans	-70.4	-45.8	-179.4	-52.8	0	0	0	0	110.6	V103 T104 Q105 L109 V110 E111	V103-T107 PolarHBondContact O-N 3.48Å; V103-T107 PolarHBondContact O-OG1 3.5Å; T104-T107 WeakPolarHBondContact O-CA 3.08Å; T104-T107 WeakPolarHBondContact O-CB 3.4Å; T104-T107 PolarHBondContact O-N 3.33Å; Q105-T107 VanDerWaalsContact C-N 3.31Å; Q105-T107 PolarHBondContact O-N 3.45Å; T107-L109 PolarHBondContact O-N 3.36Å; T107-V110 PolarHBondContact O-N 3.15Å; T107-E111 WeakPolarHBondContact O-CB 3.32Å; T107-E111 PolarHBondContact O-N 3.27Å
108	E	97.1	Very high	94.9	Very high	121 Å²	121	74.7 Å²	74.7	57%	0.565	38%	0.375	S	S	*	.	H	α-helix	trans	-60.2	-41.7	176	-71	173.6	170.5	0	0	112.1	T104 E111 N112	T104-E108 HydrophobicContact CG2-CG 4.26Å; T104-E108 WeakPolarHBondContact CG2-OE1 3.27Å; T104-E108 WeakPolarHBondContact O-CG 3.29Å; T104-E108 PolarHBondContact O-N 2.77Å; E108-E111 PolarHBondContact O-N 3.47Å; E108-N112 WeakPolarHBondContact O-CB 3.41Å; E108-N112 PolarHBondContact O-N 3.13Å
109	L	95.9	Very high	94.1	Very high	56 Å²	56	73.6 Å²	73.6	29%	0.293	38%	0.378	S	S	.	.	H	α-helix	trans	-59.7	-46.1	175	-77.1	166.7	0	0	0	112.1	L37 Q105 T107 R113	L37-L109 HydrophobicContact CD1-CB 4.31Å; Q105-L109 HydrophobicContact CG-CD1 4.23Å; Q105-L109 WeakPolarHBondContact O-CB 3.42Å; Q105-L109 WeakPolarHBondContact O-CD1 3.38Å; Q105-L109 VanDerWaalsContact O-CG 3.24Å; Q105-L109 WeakPolarHBondContact O-CG 3.43Å; Q105-L109 PolarHBondContact O-N 3.05Å; T107-L109 PolarHBondContact O-N 3.36Å; L109-R113 WeakPolarHBondContact O-CG 3.49Å; L109-R113 PolarHBondContact O-N 2.89Å
110	V	95.9	Very high	92.9	Very high	69 Å²	69	73.6 Å²	73.6	42%	0.418	38%	0.379	S	S	.	.	H	α-helix	trans	-68.5	-45.1	178.6	172.7	0	0	0	0	111.4	L37 I41 M106 T107 N112 R113 S114	L37-V110 HydrophobicContact CD1-CG2 4.3Å; I41-V110 HydrophobicContact CD1-CG2 3.8Å; I41-V110 HydrophobicContact CG1-CG2 4.47Å; M106-V110 WeakPolarHBondContact O-CG2 3.33Å; M106-V110 PolarHBondContact O-N 3.23Å; T107-V110 PolarHBondContact O-N 3.15Å; V110-N112 PolarHBondContact O-N 3.24Å; V110-R113 PolarHBondContact O-N 3.22Å; V110-S114 PolarHBondContact O-N 2.99Å
111	E	95.8	Very high	91.7	Very high	91 Å²	91	70.7 Å²	70.7	43%	0.425	37%	0.368	S	S	.	.	H	α-helix	trans	-61.9	-43.7	177.9	-81.7	-161.2	-145.4	0	0	112.4	T107 E108 S114 R115	T107-E111 WeakPolarHBondContact O-CB 3.32Å; T107-E111 PolarHBondContact O-N 3.27Å; E108-E111 PolarHBondContact O-N 3.47Å; E111-S114 PolarHBondContact O-N 3.23Å; E111-R115 WeakPolarHBondContact O-CD 3.46Å; E111-R115 WeakPolarHBondContact O-CG 3.42Å; E111-R115 PolarHBondContact O-N 3.34Å; E111-R115 IonicContact OE2-CZ 3.91Å; E111-R115 IonicContact OE2-NE 3.79Å; E111-R115 PolarHBondContact OE2-NE 3.31Å; E111-R115 IonicContact OE2-NH2 2.6Å; E111-R115 PolarHBondContact OE2-NH2 3.49Å
112	N	92.9	Very high	90.4	Very high	111 Å²	111	70.6 Å²	70.6	59%	0.594	37%	0.371	S	S	*	.	H	α-helix	trans	-67.1	-40.9	-177.6	-161.7	46.7	0	0	0	111.3	E108 V110 R115 Q116	E108-N112 WeakPolarHBondContact O-CB 3.41Å; E108-N112 PolarHBondContact O-N 3.13Å; V110-N112 PolarHBondContact O-N 3.24Å; N112-R115 PolarHBondContact O-N 3.26Å; N112-Q116 PolarHBondContact O-N 3Å
113	R	92.3	Very high	88.8	Confident	44 Å²	44	73.7 Å²	73.7	17%	0.166	39%	0.392	C	S	.	.	H	α-helix	trans	-65.8	-36.1	172.7	-69.8	-62.2	-163.6	-175.4	7.2	112.9	E32 S36 L37 L109 V110 M117	E32-R113 IonicContact OE1-CZ 2.65Å; E32-R113 IonicContact OE1-NH1 3.73Å; E32-R113 PolarHBondContact OE1-NH1 2.81Å; E32-R113 IonicContact OE1-NH2 2.62Å; E32-R113 PolarHBondContact OE1-NH2 3.14Å; S36-R113 PolarHBondContact OG-NH2 3Å; L37-R113 HydrophobicContact CD1-CG 4.3Å; L37-R113 HydrophobicContact CD2-CB 4.21Å; L37-R113 HydrophobicContact CD2-CG 4.3Å; L109-R113 WeakPolarHBondContact O-CG 3.49Å; L109-R113 PolarHBondContact O-N 2.89Å; V110-R113 PolarHBondContact O-N 3.22Å; R113-M117 WeakPolarHBondContact O-CG 3.36Å; R113-M117 PolarHBondContact O-N 3.4Å
114	S	91.8	Very high	87.2	Confident	58 Å²	58	73.2 Å²	73.2	41%	0.406	39%	0.387	S	S	.	.	H	α-helix	trans	-61.8	-51.4	171.7	-166.3	0	0	0	0	110.7	V110 E111 Q116 M117 D118	V110-S114 PolarHBondContact O-N 2.99Å; E111-S114 PolarHBondContact O-N 3.23Å; S114-Q116 VanDerWaalsContact C-N 3.27Å; S114-Q116 PolarHBondContact O-N 3.43Å; S114-M117 WeakPolarHBondContact O-CB 3.33Å; S114-M117 PolarHBondContact O-N 3.25Å; S114-D118 WeakPolarHBondContact O-CB 3.34Å; S114-D118 VanDerWaalsContact O-CG 3.25Å; S114-D118 PolarHBondContact O-N 2.83Å; S114-D118 PolarHBondContact OG-OD2 3.34Å
115	R	90.9	Very high	85.6	Confident	155 Å²	155	76.8 Å²	76.8	59%	0.585	40%	0.399	S	S	*	.	H	α-helix	trans	-59	-36.4	-179	-67.8	162.1	-170.2	-88.9	5.3	112.5	E111 N112 S119	E111-R115 WeakPolarHBondContact O-CD 3.46Å; E111-R115 WeakPolarHBondContact O-CG 3.42Å; E111-R115 PolarHBondContact O-N 3.34Å; E111-R115 IonicContact OE2-CZ 3.91Å; E111-R115 IonicContact OE2-NE 3.79Å; E111-R115 PolarHBondContact OE2-NE 3.31Å; E111-R115 IonicContact OE2-NH2 2.6Å; E111-R115 PolarHBondContact OE2-NH2 3.49Å; N112-R115 PolarHBondContact O-N 3.26Å; R115-S119 VanDerWaalsContact O-CB 3.27Å; R115-S119 WeakPolarHBondContact O-CB 3.45Å; R115-S119 PolarHBondContact O-N 2.8Å
116	Q	86.6	Confident	83.7	Confident	50 Å²	50	78.1 Å²	78.1	23%	0.234	41%	0.406	C	S	.	.	H	α-helix	trans	-60.1	-52.5	172.2	-173.8	174.4	14.1	0	0	111.1	D29 N112 S114 S119 H120	D29-Q116 PolarHBondContact OD1-NE2 3.45Å; D29-Q116 WeakPolarHBondContact OD2-CG 3.37Å; D29-Q116 PolarHBondContact OD2-NE2 2.82Å; N112-Q116 PolarHBondContact O-N 3Å; S114-Q116 VanDerWaalsContact C-N 3.27Å; S114-Q116 PolarHBondContact O-N 3.43Å; Q116-S119 PolarHBondContact O-N 2.96Å; Q116-H120 PolarHBondContact O-N 3.38Å
117	M	85.6	Confident	81.6	Confident	36 Å²	36	80.2 Å²	80.2	18%	0.177	42%	0.422	C	S	.	.	H	α-helix	trans	-61.7	-44.4	177.2	-71.4	-66.6	-62.9	0	0	113.2	Y26 Y30 R113 S114 H120 S121	Y26-M117 HydrophobicContact CD2-CE 4.45Å; Y26-M117 HydrophobicContact CD2-SD 4.44Å; Y26-M117 HydrophobicContact CE2-CE 3.41Å; Y26-M117 VanDerWaalsContact CE2-CE 3.41Å; Y26-M117 HydrophobicContact CE2-SD 3.89Å; Y26-M117 WeakPolarHBondContact OH-CE 3.26Å; Y30-M117 HydrophobicContact CD2-CE 3.4Å; Y30-M117 HydrophobicContact CD2-SD 3.93Å; Y30-M117 HydrophobicContact CE2-CE 4.19Å; Y30-M117 HydrophobicContact CG-CE 4.1Å; Y30-M117 HydrophobicContact CG-SD 4.42Å; R113-M117 WeakPolarHBondContact O-CG 3.36Å; R113-M117 PolarHBondContact O-N 3.4Å; S114-M117 WeakPolarHBondContact O-CB 3.33Å; S114-M117 PolarHBondContact O-N 3.25Å; M117-H120 PolarHBondContact O-N 3.1Å; M117-S121 WeakPolarHBondContact O-CB 3.39Å; M117-S121 PolarHBondContact O-N 3.13Å
118	D	86.1	Confident	79.1	Confident	85 Å²	85	81.4 Å²	81.4	46%	0.455	43%	0.433	S	S	.	.	H	α-helix	trans	-64.4	-41.8	-179.1	-68.9	-46.9	0	0	0	111.4	S114 H120 S121 L122	S114-D118 WeakPolarHBondContact O-CB 3.34Å; S114-D118 VanDerWaalsContact O-CG 3.25Å; S114-D118 PolarHBondContact O-N 2.83Å; S114-D118 PolarHBondContact OG-OD2 3.34Å; D118-H120 PolarHBondContact O-N 3.47Å; D118-S121 PolarHBondContact O-N 2.6Å; D118-L122 WeakPolarHBondContact O-CG 3.04Å; D118-L122 PolarHBondContact O-N 2.88Å
119	S	81.4	Confident	76.9	Confident	71 Å²	71	82.8 Å²	82.8	50%	0.497	44%	0.439	S	S	.	.	H	α-helix	trans	-57.1	-47	175.7	-176.8	0	0	0	0	112.1	R115 Q116 L122 C123	R115-S119 VanDerWaalsContact O-CB 3.27Å; R115-S119 WeakPolarHBondContact O-CB 3.45Å; R115-S119 PolarHBondContact O-N 2.8Å; Q116-S119 PolarHBondContact O-N 2.96Å; S119-L122 PolarHBondContact O-N 2.92Å; S119-C123 PolarHBondContact O-N 2.95Å
120	H	72.8	Confident	74.7	Confident	49 Å²	49	83.4 Å²	83.4	23%	0.227	45%	0.453	C	S	.	.	H	α-helix	trans	-72.9	-38.5	-179.4	-69.2	-172.1	0	0	0	111.6	Y26 D29 Q116 M117 D118 L122 C123 L124	Y26-H120 HydrophobicContact CD2-CB 3.44Å; Y26-H120 VanDerWaalsContact CD2-CB 3.44Å; Y26-H120 HydrophobicContact CE2-CB 4.23Å; Y26-H120 HydrophobicContact CG-CB 4.14Å; D29-H120 IonicContact OD2-CE1 3.51Å; D29-H120 PolarHBondContact OD2-CE1 3.34Å; D29-H120 IonicContact OD2-ND1 2.67Å; Q116-H120 PolarHBondContact O-N 3.38Å; M117-H120 PolarHBondContact O-N 3.1Å; D118-H120 PolarHBondContact O-N 3.47Å; H120-L122 VanDerWaalsContact C-N 3.31Å; H120-L122 PolarHBondContact O-N 2.92Å; H120-C123 WeakPolarHBondContact O-CB 3.43Å; H120-C123 PolarHBondContact O-N 3.42Å; H120-C123 VanDerWaalsContact O-N 3.11Å; H120-L124 WeakPolarHBondContact O-CG 3.14Å; H120-L124 PolarHBondContact O-N 2.89Å; H120-L124 VanDerWaalsContact O-N 3.07Å
121	S	73	Confident	72.5	Confident	46 Å²	46	86.3 Å²	86.3	32%	0.322	46%	0.462	S	S	.	.	H	α-helix	trans	-57.1	-41.8	173	-174.7	0	0	0	0	112.5	M117 D118 L124 Q125	M117-S121 WeakPolarHBondContact O-CB 3.39Å; M117-S121 PolarHBondContact O-N 3.13Å; D118-S121 PolarHBondContact O-N 2.6Å; S121-L124 PolarHBondContact O-N 2.8Å; S121-Q125 PolarHBondContact O-N 3.14Å
122	L	70.4	Confident	70.3	Confident	122 Å²	122	89.9 Å²	89.9	64%	0.639	47%	0.471	S	S	*	.	H	α-helix	trans	-66.7	-34	175.2	-71.8	168.8	0	0	0	113	D118 S119 H120 L124 Q125	D118-L122 WeakPolarHBondContact O-CG 3.04Å; D118-L122 PolarHBondContact O-N 2.88Å; S119-L122 PolarHBondContact O-N 2.92Å; H120-L122 VanDerWaalsContact C-N 3.31Å; H120-L122 PolarHBondContact O-N 2.92Å; L122-L124 VanDerWaalsContact C-N 3.33Å; L122-Q125 PolarHBondContact O-N 3.2Å
123	C	65.8	Low	68.3	Low	71 Å²	71	91 Å²	91	48%	0.48	48%	0.477	S	S	.	.	H	α-helix	trans	-70.1	-31.3	176.8	-161.4	0	0	0	0	112.3	Q22 S119 H120	Q22-C123 PolarHBondContact OE1-SG 3.44Å; S119-C123 PolarHBondContact O-N 2.95Å; H120-C123 WeakPolarHBondContact O-CB 3.43Å; H120-C123 PolarHBondContact O-N 3.42Å; H120-C123 VanDerWaalsContact O-N 3.11Å
124	L	65.1	Low	66.4	Low	59 Å²	59	93.5 Å²	93.5	31%	0.309	50%	0.497	S	S	.	.	H	α-helix	trans	-83.9	-10.4	178.6	-63.1	175.3	0	0	0	114.1	Q22 L23 Y26 H120 S121 L122 E126	Q22-L124 HydrophobicContact CB-CD2 4.45Å; L23-L124 HydrophobicContact CD2-CD1 3.77Å; L23-L124 HydrophobicContact CD2-CD2 3.59Å; L23-L124 HydrophobicContact CD2-CG 4.31Å; L23-L124 HydrophobicContact CG-CD2 3.64Å; Y26-L124 HydrophobicContact CD1-CD1 3.77Å; Y26-L124 HydrophobicContact CE1-CD1 4.3Å; Y26-L124 HydrophobicContact CG-CD1 3.94Å; H120-L124 WeakPolarHBondContact O-CG 3.14Å; H120-L124 PolarHBondContact O-N 2.89Å; H120-L124 VanDerWaalsContact O-N 3.07Å; S121-L124 PolarHBondContact O-N 2.8Å; L122-L124 VanDerWaalsContact C-N 3.33Å; L124-E126 PolarHBondContact O-N 3.14Å
125	Q	65.1	Low	64.2	Low	133 Å²	133	95.8 Å²	95.8	62%	0.621	51%	0.509	S	S	*	.			trans	-80.4	99.7	171.8	-75.1	-175.2	17.3	0	0	111	S121 L122	S121-Q125 PolarHBondContact O-N 3.14Å; L122-Q125 PolarHBondContact O-N 3.2Å
126	E	57.8	Low	62.1	Low	108 Å²	108	95.7 Å²	95.7	51%	0.505	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-51.4	138.4	159.8	-79.9	-81.1	114.3	0	0	109.9	K19 L124 S128 R132	K19-E126 IonicContact NZ-OE1 2.74Å; K19-E126 PolarHBondContact NZ-OE1 2.73Å; L124-E126 PolarHBondContact O-N 3.14Å; E126-S128 PolarHBondContact O-N 3.25Å; E126-S128 VanDerWaalsContact O-N 3.14Å; E126-R132 IonicContact OE2-NH2 3.89Å
127	P	52.3	Low	60.1	Low	81 Å²	81	104.2 Å²	104.2	53%	0.526	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-60.6	121.1	170.9	25.9	-33	0	0	0	109.1
128	S	45.8	Very low	58.4	Low	93 Å²	93	113.6 Å²	113.6	65%	0.65	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-52.4	142.9	-175.1	-177.6	0	0	0	0	112.1	E126 A130 E131	E126-S128 PolarHBondContact O-N 3.25Å; E126-S128 VanDerWaalsContact O-N 3.14Å; S128-A130 PolarHBondContact O-N 2.72Å; S128-E131 PolarHBondContact O-N 2.64Å; S128-E131 VanDerWaalsContact O-N 3.14Å
129	E	52.4	Low	56.5	Low	150 Å²	150	114.2 Å²	114.2	70%	0.701	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	-16.2	-169.9	-58.2	-174.6	110.1	0	0	114.6	E131 R132	E129-E131 PolarHBondContact O-N 3.04Å; E129-R132 PolarHBondContact O-N 3.22Å; E129-R132 VanDerWaalsContact O-N 3.14Å
130	A	49.8	Very low	54.7	Low	69 Å²	69	116 Å²	116	57%	0.57	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-46.8	-38	170	0	0	0	0	0	114.2	S128	S128-A130 PolarHBondContact O-N 2.72Å
131	E	49.2	Very low	53.3	Low	130 Å²	130	121.6 Å²	121.6	61%	0.607	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-37	179.7	-69.1	-158.5	118.4	0	0	112.9	S128 E129 L133 T134	S128-E131 PolarHBondContact O-N 2.64Å; S128-E131 VanDerWaalsContact O-N 3.14Å; E129-E131 PolarHBondContact O-N 3.04Å; E131-L133 VanDerWaalsContact C-N 3.26Å; E131-L133 PolarHBondContact O-N 3.05Å; E131-T134 WeakPolarHBondContact O-CB 3.38Å; E131-T134 PolarHBondContact O-N 3.09Å; E131-T134 PolarHBondContact O-OG1 2.98Å
132	R	49.1	Very low	51.7	Low	167 Å²	167	128 Å²	128	63%	0.63	66%	0.656	S	S	*	*	H	α-helix	trans	-60.5	-35.8	-176.9	-69.2	-172.6	176.9	-175.6	3.2	112.4	E126 E129 T134 T135	E126-R132 IonicContact OE2-NH2 3.89Å; E129-R132 PolarHBondContact O-N 3.22Å; E129-R132 VanDerWaalsContact O-N 3.14Å; R132-T134 PolarHBondContact O-N 2.96Å; R132-T135 PolarHBondContact O-N 3.23Å
133	L	51.8	Low	49.9	Very low	135 Å²	135	130 Å²	130	71%	0.707	66%	0.662	S	S	*	*	H	α-helix	trans	-66.7	-15.1	178.5	-68.3	171.4	0	0	0	114.1	E131	E131-L133 VanDerWaalsContact C-N 3.26Å; E131-L133 PolarHBondContact O-N 3.05Å
134	T	50.8	Low	48.2	Very low	96 Å²	96	131.8 Å²	131.8	59%	0.589	68%	0.676	S	S	*	*	H	α-helix	trans	-83	-33.9	-179.1	70.2	0	0	0	0	113.1	E131 R132	E131-T134 WeakPolarHBondContact O-CB 3.38Å; E131-T134 PolarHBondContact O-N 3.09Å; E131-T134 PolarHBondContact O-OG1 2.98Å; R132-T134 PolarHBondContact O-N 2.96Å
135	T	46.5	Very low	47.1	Very low	106 Å²	106	135 Å²	135	65%	0.65	70%	0.7	S	S	*	*	H	α-helix	trans	-80.7	-44.7	-174.6	-58.4	0	0	0	0	112.3	R132 R137 R138	R132-T135 PolarHBondContact O-N 3.23Å; T135-R137 PolarHBondContact O-N 3.27Å; T135-R137 VanDerWaalsContact O-N 3.11Å; T135-R138 PolarHBondContact O-N 3.12Å; T135-R138 VanDerWaalsContact O-N 3.14Å
136	E	45.9	Very low	45.5	Very low	152 Å²	152	133 Å²	133	71%	0.71	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-52.4	-33.7	175.8	-78.7	-72.5	104	0	0	112.6	R138 S139	E136-R138 VanDerWaalsContact C-N 3.26Å; E136-R138 PolarHBondContact O-N 3.03Å; E136-S139 PolarHBondContact O-OG 3.4Å; E136-S139 VanDerWaalsContact O-OG 3.09Å
137	R	46.2	Very low	44.9	Very low	229 Å²	229	133.5 Å²	133.5	86%	0.864	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-79.7	-1	-174.3	-141	176.8	-171.5	-145.1	0.6	114.7	T135	T135-R137 PolarHBondContact O-N 3.27Å; T135-R137 VanDerWaalsContact O-N 3.11Å
138	R	48.9	Very low	44	Very low	234 Å²	234	136.4 Å²	136.4	88%	0.883	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-106.6	-8.7	-175.8	-157.7	173.2	-176.6	-173.9	0.8	114.3	T135 E136	T135-R138 PolarHBondContact O-N 3.12Å; T135-R138 VanDerWaalsContact O-N 3.14Å; E136-R138 VanDerWaalsContact C-N 3.26Å; E136-R138 PolarHBondContact O-N 3.03Å
139	S	45.8	Very low	43.6	Very low	98 Å²	98	141.3 Å²	141.3	69%	0.685	73%	0.73	S	S	*	*	S	Bend	trans	-92.2	-4.2	-173.5	55.9	0	0	0	0	115.3	E136	E136-S139 PolarHBondContact O-OG 3.4Å; E136-S139 VanDerWaalsContact O-OG 3.09Å
140	S	44.4	Very low	42.6	Very low	107 Å²	107	139.9 Å²	139.9	75%	0.748	73%	0.731	S	S	*	*			trans	-128	46.7	-161.9	-153.9	0	0	0	0	115.6
141	I	42.7	Very low	41.9	Very low	168 Å²	168	141 Å²	141	86%	0.862	74%	0.735	S	S	*	*			trans	-140.9	107.1	164.7	-53.8	-179	0	0	0	111.9
142	Q	38.9	Very low	41.4	Very low	180 Å²	180	141.9 Å²	141.9	84%	0.841	74%	0.744	S	S	*	*			trans	-158.3	141.1	165	-104.9	-174.5	-17.2	0	0	106.1
143	E	33.2	Very low	40.9	Very low	164 Å²	164	145.7 Å²	145.7	77%	0.766	76%	0.758	S	S	*	*			cis	-146.1	164.1	8.3	-60.2	-173.5	92.1	0	0	113.6
144	S	29.9	Very low	40.5	Very low	109 Å²	109	150.6 Å²	150.6	76%	0.762	77%	0.767	S	S	*	*			trans	73.4	160.9	147	82.5	0	0	0	0	120.7
145	P	42.6	Very low	40.6	Very low	127 Å²	127	151.8 Å²	151.8	83%	0.825	78%	0.776	S	S	*	*			cis	-126.9	-170.5	-27.2	23.4	0.2	0	0	0	114.7
146	A	31.5	Very low	40.3	Very low	91 Å²	91	156.1 Å²	156.1	75%	0.752	78%	0.781	S	S	*	*			trans	-59.3	173	-176	0	0	0	0	0	116.3
147	P	45.2	Very low	40.1	Very low	117 Å²	117	158.2 Å²	158.2	76%	0.76	78%	0.782	S	S	*	*			cis	-154.3	175.3	32.9	45.3	-23.1	0	0	0	122.5
148	E	33.4	Very low	39.9	Very low	142 Å²	142	153.5 Å²	153.5	66%	0.664	77%	0.77	S	S	*	*			trans	63.5	135.2	146.8	-83.7	-146.6	125.9	0	0	125.8
149	R	36.5	Very low	39.4	Very low	197 Å²	197	152.1 Å²	152.1	74%	0.743	77%	0.765	S	S	*	*			trans	70.8	150.5	146.7	-68.2	174.5	-167.2	-125	-8.1	119
150	T	32.1	Very low	38.9	Very low	119 Å²	119	152.7 Å²	152.7	73%	0.73	76%	0.76	S	S	*	*			cis	-152.8	157.6	5.6	-6.6	0	0	0	0	114.1
151	S	35.6	Very low	38.7	Very low	94 Å²	94	151.3 Å²	151.3	66%	0.657	75%	0.75	S	S	*	*			trans	59.3	116.1	145.6	68.3	0	0	0	0	123.9
152	N	37.9	Very low	38.3	Very low	147 Å²	147	151.2 Å²	151.2	79%	0.786	75%	0.746	S	S	*	*				52	113.4	124.4	-56.8	-11	0	0	0	122
153	R	39.1	Very low	38	Very low	248 Å²	248	146.6 Å²	146.6	94%	0.936	73%	0.734	S	S	*	*				-169.8	135.9	103.9	-98	158.8	-165.9	-104.2	3.8	113.6
154	R	42.9	Very low	38.3	Very low	238 Å²	238	149 Å²	149	90%	0.898	74%	0.736	S	S	*	*			trans	-102	171.7	156	-82.8	-177.9	174.3	-178.4	-0.3	107.4
155	P	53.4	Low	38.4	Very low	120 Å²	120	150.2 Å²	150.2	78%	0.779	73%	0.734	S	S	*	*			cis	-123.4	-159.1	12	32.8	-8	0	0	0	111.4
156	R	39.1	Very low	38.2	Very low	198 Å²	198	148.7 Å²	148.7	75%	0.747	73%	0.727	S	S	*	*			cis	-169.7	123.8	27.6	177.5	179.2	170.9	156.4	-1.9	113.8
157	R	42.9	Very low	38.2	Very low	195 Å²	195	151 Å²	151	74%	0.736	73%	0.732	S	S	*	*			trans	61.2	149.5	153.7	-67.3	177.9	163.7	-152.1	2.7	117.9
158	Q	41.1	Very low	37.7	Very low	131 Å²	131	153 Å²	153	61%	0.612	73%	0.73	S	S	*	*			cis	-155.4	156.7	-11.1	-124.1	166.6	-66.4	0	0	111.4
159	R	39.3	Very low	37.7	Very low	204 Å²	204	153.6 Å²	153.6	77%	0.77	74%	0.737	S	S	*	*			trans	14.8	149.6	141.4	-67.7	-166.8	125.9	161.6	3.5	120.1
160	N	35.5	Very low	37.7	Very low	110 Å²	110	149.6 Å²	149.6	59%	0.588	74%	0.74	S	S	*	*			cis	-155.2	142.5	1.8	-118.5	21.1	0	0	0	106.1
161	S	39.1	Very low	37.8	Very low	78 Å²	78	148.9 Å²	148.9	55%	0.545	75%	0.746	S	S	.	*				71.8	134	74.9	108	0	0	0	0	112.1
162	E	35.5	Very low	37.9	Very low	166 Å²	166	152.6 Å²	152.6	78%	0.776	76%	0.759	S	S	*	*			cis	-146.2	165.3	4.6	-55	-177.4	60.4	0	0	110.6
163	S	33.3	Very low	37.5	Very low	83 Å²	83	149 Å²	149	58%	0.58	76%	0.756	S	S	*	*				61.1	130.8	106.3	-178.6	0	0	0	0	116
164	R	39.3	Very low	37.3	Very low	214 Å²	214	142.2 Å²	142.2	81%	0.808	75%	0.746	S	S	*	*			cis	-162.9	156.5	2	-114.9	-179.6	-171.5	118.3	-4.9	109.8
165	D	31.2	Very low	37.1	Very low	135 Å²	135	138.3 Å²	138.3	72%	0.722	74%	0.743	S	S	*	*				59.6	107.9	108.5	-137.2	-141	0	0	0	113.7
166	S	37.5	Very low	36.2	Very low	96 Å²	96	138.4 Å²	138.4	67%	0.671	74%	0.741	S	S	*	*				75.4	106.8	58.6	-56.4	0	0	0	0	114.6
167	T	33.3	Very low	35.7	Very low	140 Å²	140	136 Å²	136	86%	0.859	74%	0.743	S	S	*	*			trans	-179.3	115.6	145.9	20.4	0	0	0	0	106.1
168	H	34.5	Very low	35.1	Very low	157 Å²	157	133.3 Å²	133.3	73%	0.727	74%	0.743	S	S	*	*				77	107.5	61.2	-177.8	-86.8	0	0	0	113.9
169	L	32.1	Very low	34.7	Very low	155 Å²	155	131.8 Å²	131.8	81%	0.812	75%	0.747	S	S	*	*				-174.4	148	129.8	-100.5	168.4	0	0	0	110.9
170	S	36.8	Very low	34.3	Very low	114 Å²	114	128.3 Å²	128.3	80%	0.797	75%	0.748	S	S	*	*			trans	-113.8	157.9	-178.8	-51.7	0	0	0	0	112.3
171	A	33.4	Very low	33.9	Very low	104 Å²	104	130.7 Å²	130.7	86%	0.86	76%	0.761	S	S	*	*			trans	-147.2	161.1	163.5	0	0	0	0	0	110
172	N	37.8	Very low	33.4	Very low	172 Å²	172	135.1 Å²	135.1	92%	0.92	77%	0.773	S	S	*	*			trans	-129.3	147.1	-152.4	-142.6	35.3	0	0	0	114.7
173	G	31	Very low	33.3	Very low	72 Å²	72	134.3 Å²	134.3	74%	0.742	77%	0.773	S	S	*	*			trans	82.9	170.6	157	0	0	0	0	0	118.8
174	S	33.7	Very low	33.4	Very low	104 Å²	104	136 Å²	136	73%	0.727	78%	0.782	S	S	*	*			cis	-175.8	119.7	-11.5	170.4	0	0	0	0	112.7
175	L	38.7	Very low	32.9	Very low	157 Å²	157	133.4 Å²	133.4	82%	0.822	78%	0.784	S	S	*	*			trans	61.7	171.2	161.9	-55.2	170.4	0	0	0	117.5
176	V	36.1	Very low	33.4	Very low	122 Å²	122	132.5 Å²	132.5	74%	0.739	79%	0.785	S	S	*	*			cis	-119.7	-130	-5.5	-141.1	0	0	0	0	110.5
177	D	28.1	Very low	34	Very low	146 Å²	146	133.2 Å²	133.2	78%	0.781	79%	0.787	S	S	*	*			cis	-161.2	178.7	0.9	-137.7	-39.9	0	0	0	112.2
178	D	29.4	Very low	34.4	Very low	139 Å²	139	131.2 Å²	131.2	74%	0.743	78%	0.777	S	S	*	*			trans	-88.6	177.4	179.9	-156.8	-132.8	0	0	0	112.6
179	S	32.4	Very low	34.3	Very low	100 Å²	100	133.8 Å²	133.8	70%	0.699	78%	0.78	S	S	*	*			cis	-155.2	-176.6	22	-51.9	0	0	0	0	114.1
180	V	31.8	Very low	34.1	Very low	130 Å²	130	132.4 Å²	132.4	79%	0.788	77%	0.769	S	S	*	*			trans	-81.2	165.9	-178.4	-59.1	0	0	0	0	116.9
181	D	27.8	Very low	33.9	Very low	161 Å²	161	137.3 Å²	137.3	86%	0.861	78%	0.776	S	S	*	*				-175.8	-172.8	118.5	-139.5	-85.7	0	0	0	113.8
182	E	27.1	Very low	33.7	Very low	171 Å²	171	140.5 Å²	140.5	80%	0.799	77%	0.771	S	S	*	*			trans	-105.7	-165.3	-157.9	-141	-156.5	93.6	0	0	118.1
183	L	33.9	Very low	33.4	Very low	148 Å²	148	138.2 Å²	138.2	78%	0.775	77%	0.768	S	S	*	*			trans	-85.4	179.8	-174.2	-72	170.2	0	0	0	112.3
184	P	35.7	Very low	33.4	Very low	120 Å²	120	144.7 Å²	144.7	78%	0.779	78%	0.776	S	S	*	*			cis	-146.5	-166.4	19.8	43.9	-21.1	0	0	0	118.3
185	L	29.2	Very low	33.2	Very low	159 Å²	159	145.8 Å²	145.8	83%	0.832	78%	0.784	S	S	*	*			trans	-83.7	-174.8	170.9	-60.2	173.1	0	0	0	111.6
186	P	40.7	Very low	32.9	Very low	116 Å²	116	143.3 Å²	143.3	75%	0.753	78%	0.78	S	S	*	*			cis	-132.8	-114.5	5.5	26.5	1.4	0	0	0	117.9
187	P	51.4	Low	32.8	Very low	110 Å²	110	147.3 Å²	147.3	71%	0.714	79%	0.787	S	S	*	*				-114.3	-155	-114.3	39.8	-19.8	0	0	0	112.5
188	P	41.2	Very low	33	Very low	99 Å²	99	149.7 Å²	149.7	64%	0.643	79%	0.791	S	S	*	*			cis	-149.6	-165.9	4.9	45.3	-23.4	0	0	0	119
189	R	31.5	Very low	33.1	Very low	211 Å²	211	152.9 Å²	152.9	80%	0.796	80%	0.798	S	S	*	*			trans	90.5	103.9	148.4	-75.7	169.7	-160.6	-75.8	-0.3	122.8
190	E	29.4	Very low	33.1	Very low	125 Å²	125	157.9 Å²	157.9	58%	0.584	81%	0.807	S	S	*	*				34.1	132.8	125	-64.4	-163.1	96.8	0	0	122.4	K192	E190-K192 WeakPolarHBondContact OE1-CE 3.45Å; E190-K192 IonicContact OE1-NZ 2.64Å; E190-K192 PolarHBondContact OE1-NZ 3.01Å
191	K	31.4	Very low	33.4	Very low	217 Å²	217	163.6 Å²	163.6	94%	0.943	81%	0.814	S	S	*	*				-151.3	148.8	123.1	-112.3	153.8	-169.7	168.9	0	113
192	K	28.6	Very low	33.8	Very low	172 Å²	172	165.5 Å²	165.5	75%	0.748	82%	0.815	S	S	*	*			trans	-105.7	143.9	-173.5	-67.2	155	172.2	136.9	0	110.9	E190	E190-K192 WeakPolarHBondContact OE1-CE 3.45Å; E190-K192 IonicContact OE1-NZ 2.64Å; E190-K192 PolarHBondContact OE1-NZ 3.01Å
193	S	33	Very low	34.1	Very low	124 Å²	124	162.1 Å²	162.1	87%	0.867	81%	0.81	S	S	*	*			trans	-148.3	158.5	154	68.3	0	0	0	0	110.9
194	K	30.3	Very low	34.2	Very low	208 Å²	208	163.1 Å²	163.1	90%	0.904	81%	0.808	S	S	*	*			trans	-119.2	140.7	-171.7	-54.6	169	-178	173.4	0	109.5
195	S	30.1	Very low	34.4	Very low	126 Å²	126	165.5 Å²	165.5	88%	0.881	81%	0.809	S	S	*	*			trans	-168.3	149.2	135	-161.2	0	0	0	0	112.8
196	S	31.5	Very low	35.2	Very low	106 Å²	106	164.9 Å²	164.9	74%	0.741	80%	0.802	S	S	*	*			trans	-102	147.5	-176.7	53.2	0	0	0	0	112.7
197	K	33.9	Very low	35.2	Very low	206 Å²	206	170.3 Å²	170.3	90%	0.896	81%	0.807	S	S	*	*				-160.2	127	129.5	-132.2	155.3	-175.1	168.8	0	116.7
198	K	32.2	Very low	34.6	Very low	196 Å²	196	172.1 Å²	172.1	85%	0.852	81%	0.811	S	S	*	*			trans	-28.1	156.8	168.1	-112.4	168.5	177.7	170.6	0	119.9
199	K	31.6	Very low	34.4	Very low	205 Å²	205	171.8 Å²	171.8	89%	0.891	82%	0.817	S	S	*	*			trans	83	146.3	171.8	-54.5	176.3	-177.9	-179.8	0	113.1
200	K	31.9	Very low	35.2	Very low	205 Å²	205	165.3 Å²	165.3	89%	0.891	80%	0.804	S	S	*	*			cis	-142.7	152.6	19.1	-173	178.4	179.6	-178.9	0	111.1
201	R	39.6	Very low	36.1	Very low	251 Å²	251	165.8 Å²	165.8	95%	0.947	82%	0.818	S	S	*	*			trans	-59.5	139.4	173	-77.1	171.7	151.1	174.9	-9.1	111.6
202	K	35	Very low	36.6	Very low	201 Å²	201	159.4 Å²	159.4	87%	0.874	80%	0.796	S	S	*	*			trans	-143.1	154.9	151.3	-155.5	177.1	-179.3	-170.5	0	109.1
203	S	34.9	Very low	37.7	Very low	100 Å²	100	158.2 Å²	158.2	70%	0.699	80%	0.798	S	S	*	*			trans	-69.4	138.5	-172.3	38.1	0	0	0	0	113.5
204	K	35.3	Very low	38.2	Very low	169 Å²	169	159.9 Å²	159.9	74%	0.735	79%	0.79	S	S	*	*			trans	-70	124.7	155.1	-169.7	-171.6	-170.3	-169.5	0	106.5	E206	K204-E206 HydrophobicContact CD-CG 3.98Å; K204-E206 VanDerWaalsContact CE-OE1 3.27Å; K204-E206 WeakPolarHBondContact CE-OE1 3.2Å; K204-E206 HydrophobicContact CG-CG 4.26Å; K204-E206 IonicContact NZ-OE1 3.52Å; K204-E206 PolarHBondContact NZ-OE1 3.43Å
205	Q	40.4	Very low	39.1	Very low	169 Å²	169	155.9 Å²	155.9	79%	0.79	78%	0.784	S	S	*	*			trans	-114.4	99.8	166.1	-176.4	168.3	-0.6	0	0	105.9
206	E	44.7	Very low	39.7	Very low	147 Å²	147	156.4 Å²	156.4	69%	0.687	78%	0.775	S	S	*	*			trans	-66.3	137.9	166.2	-71.1	157.6	154.6	0	0	107.3	K204	K204-E206 HydrophobicContact CD-CG 3.98Å; K204-E206 VanDerWaalsContact CE-OE1 3.27Å; K204-E206 WeakPolarHBondContact CE-OE1 3.2Å; K204-E206 HydrophobicContact CG-CG 4.26Å; K204-E206 IonicContact NZ-OE1 3.52Å; K204-E206 PolarHBondContact NZ-OE1 3.43Å
207	R	41.5	Very low	41	Very low	229 Å²	229	156.8 Å²	156.8	86%	0.864	77%	0.769	S	S	*	*			trans	-129.6	124.3	166.3	-153.7	174.7	-167.3	-169.6	0.1	108.5
208	D	38.3	Very low	42.4	Very low	149 Å²	149	153.3 Å²	153.3	80%	0.797	77%	0.767	S	S	*	*			trans	-48.3	142.5	177.3	-164.9	21.1	0	0	0	112.2
209	A	37.6	Very low	43.6	Very low	92 Å²	92	150.9 Å²	150.9	76%	0.76	76%	0.763	S	S	*	*			trans	-121.5	63.2	-178	0	0	0	0	0	109.5
210	S	48.1	Very low	45.4	Very low	75 Å²	75	145.1 Å²	145.1	52%	0.524	74%	0.74	S	S	.	*			trans	-62	132	166.7	55.9	0	0	0	0	109.7	V212	S210-V212 PolarHBondContact O-N 3.12Å; S210-V212 VanDerWaalsContact O-N 3.12Å
211	P	47.3	Very low	47.3	Very low	135 Å²	135	139 Å²	139	88%	0.877	72%	0.721	S	S	*	*			trans	-60.6	115.6	167.1	-20.7	32.8	0	0	0	109.2
212	V	43.7	Very low	49.3	Very low	82 Å²	82	131.2 Å²	131.2	50%	0.497	70%	0.701	S	S	.	*			trans	-102.2	112.9	173.8	-178.1	0	0	0	0	107.5	S210 F214	S210-V212 PolarHBondContact O-N 3.12Å; S210-V212 VanDerWaalsContact O-N 3.12Å; V212-F214 HydrophobicContact CB-CD2 4.11Å; V212-F214 HydrophobicContact CB-CE2 3.65Å; V212-F214 HydrophobicContact CB-CZ 3.98Å; V212-F214 HydrophobicContact CG1-CD1 4.2Å; V212-F214 HydrophobicContact CG1-CD2 4.02Å; V212-F214 HydrophobicContact CG1-CE1 3.89Å; V212-F214 HydrophobicContact CG1-CE2 3.7Å; V212-F214 HydrophobicContact CG1-CG 4.27Å; V212-F214 HydrophobicContact CG1-CZ 3.64Å; V212-F214 VanDerWaalsContact O-CD2 3.26Å; V212-F214 WeakPolarHBondContact O-CD2 3.3Å; V212-F214 PolarHBondContact O-N 3.08Å
213	D	49.8	Very low	51.7	Low	148 Å²	148	125.2 Å²	125.2	79%	0.791	67%	0.674	S	S	*	*			trans	-67.4	106.8	169	-179.9	24	0	0	0	108.8	T215	D213-T215 PolarHBondContact O-N 2.84Å
214	F	44.2	Very low	54.2	Low	158 Å²	158	120.5 Å²	120.5	69%	0.693	64%	0.641	S	S	*	*			trans	-94.5	93.2	-179.4	-78.2	-74.7	0	0	0	110.3	V212 I216	V212-F214 HydrophobicContact CB-CD2 4.11Å; V212-F214 HydrophobicContact CB-CE2 3.65Å; V212-F214 HydrophobicContact CB-CZ 3.98Å; V212-F214 HydrophobicContact CG1-CD1 4.2Å; V212-F214 HydrophobicContact CG1-CD2 4.02Å; V212-F214 HydrophobicContact CG1-CE1 3.89Å; V212-F214 HydrophobicContact CG1-CE2 3.7Å; V212-F214 HydrophobicContact CG1-CG 4.27Å; V212-F214 HydrophobicContact CG1-CZ 3.64Å; V212-F214 VanDerWaalsContact O-CD2 3.26Å; V212-F214 WeakPolarHBondContact O-CD2 3.3Å; V212-F214 PolarHBondContact O-N 3.08Å; F214-I216 VanDerWaalsContact C-N 3.34Å; F214-I216 PolarHBondContact O-N 2.98Å
215	T	49.1	Very low	56.6	Low	125 Å²	125	115.7 Å²	115.7	77%	0.767	62%	0.623	S	S	*	*			trans	-58.8	101	151.9	54.7	0	0	0	0	107.8	D213 D217	D213-T215 PolarHBondContact O-N 2.84Å; T215-D217 PolarHBondContact O-N 3.08Å; T215-D217 VanDerWaalsContact O-N 3.16Å
216	I	43.9	Very low	58.9	Low	137 Å²	137	109.8 Å²	109.8	70%	0.703	60%	0.6	S	S	*	*			trans	-59.9	118.5	-170.8	-58.3	176.2	0	0	0	109.9	F214 P218	F214-I216 VanDerWaalsContact C-N 3.34Å; F214-I216 PolarHBondContact O-N 2.98Å; I216-P218 WeakPolarHBondContact O-CD 3.39Å
217	D	57.1	Low	60.7	Low	113 Å²	113	109.4 Å²	109.4	60%	0.604	60%	0.598	S	S	*	*			trans	-68.5	121.9	173.4	-172.2	-31.3	0	0	0	108.7	T215 N219	T215-D217 PolarHBondContact O-N 3.08Å; T215-D217 VanDerWaalsContact O-N 3.16Å; D217-N219 PolarHBondContact O-N 2.92Å; D217-N219 WeakPolarHBondContact OD1-CB 3.36Å; D217-N219 PolarHBondContact OD1-N 3.3Å; D217-N219 VanDerWaalsContact OD1-N 3.16Å
218	P	63.4	Low	62.6	Low	134 Å²	134	103.3 Å²	103.3	87%	0.87	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	5.2	-178.1	-24.2	35.4	0	0	0	116.3	I216	I216-P218 WeakPolarHBondContact O-CD 3.39Å
219	N	57.9	Low	64.8	Low	144 Å²	144	98.3 Å²	98.3	77%	0.77	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.1	9.4	-170	-154.8	47.8	0	0	0	114.5	D217	D217-N219 PolarHBondContact O-N 2.92Å; D217-N219 WeakPolarHBondContact OD1-CB 3.36Å; D217-N219 PolarHBondContact OD1-N 3.3Å; D217-N219 VanDerWaalsContact OD1-N 3.16Å
220	E	69.4	Low	67	Low	85 Å²	85	97 Å²	97	40%	0.397	54%	0.54	S	S	.	.	S	Bend	trans	-74	130.8	169.8	-169.3	-178.6	157.1	0	0	110.7	V229 S230	E220-V229 HydrophobicContact CB-CG1 3.92Å; E220-V229 HydrophobicContact CG-CB 4.41Å; E220-V229 HydrophobicContact CG-CG1 4.02Å; E220-S230 PolarHBondContact OE1-N 2.84Å; E220-S230 PolarHBondContact OE1-OG 2.74Å
221	P	72.2	Confident	68.7	Low	76 Å²	76	98.3 Å²	98.3	49%	0.494	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-64.4	137.7	177	26.2	-35.3	0	0	0	112.3	Y223	P221-Y223 HydrophobicContact CB-CE2 4.34Å; P221-Y223 HydrophobicContact CG-CE2 4.02Å; P221-Y223 WeakPolarHBondContact CG-OH 3.45Å; P221-Y223 VanDerWaalsContact O-CD2 3.3Å; P221-Y223 WeakPolarHBondContact O-CD2 3.23Å; P221-Y223 WeakPolarHBondContact O-CE2 3.47Å
222	T	81	Confident	70.5	Confident	87 Å²	87	95.6 Å²	95.6	53%	0.534	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-87.1	147.3	179.8	53.2	0	0	0	0	112.3	E227	T222-E227 WeakPolarHBondContact CB-O 3.34Å; T222-E227 WeakPolarHBondContact CG2-O 3.4Å
223	Y	85.2	Confident	72.7	Confident	75 Å²	75	97.5 Å²	97.5	29%	0.294	53%	0.534	S	S	.	.	B	Isolated β-bridge	trans	-134.3	175.4	-175.2	-61.8	-72.4	0	0	0	111.5	P221 E227 Q228 M234 W246	P221-Y223 HydrophobicContact CB-CE2 4.34Å; P221-Y223 HydrophobicContact CG-CE2 4.02Å; P221-Y223 WeakPolarHBondContact CG-OH 3.45Å; P221-Y223 VanDerWaalsContact O-CD2 3.3Å; P221-Y223 WeakPolarHBondContact O-CD2 3.23Å; P221-Y223 WeakPolarHBondContact O-CE2 3.47Å; Y223-E227 WeakPolarHBondContact O-CA 3.45Å; Y223-E227 PolarHBondContact O-N 2.84Å; Y223-Q228 PolarHBondContact N-O 2.86Å; Y223-Q228 PolarHBondContact O-N 2.79Å; Y223-M234 HydrophobicContact CG-CE 4.42Å; Y223-W246 HydrophobicContact CD1-CB 4.17Å
224	C	88.6	Confident	74.7	Confident	2 Å²	2	92.8 Å²	92.8	1%	0.014	51%	0.507	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	-171.4	179.4	-160.2	0	0	0	0	114.5	C226 I244 W246 F247 H248 C251	C224-C226 VanDerWaalsContact C-N 3.33Å; C224-I244 VanDerWaalsContact N-CG2 3.35Å; C224-W246 VanDerWaalsContact CA-O 3.23Å; C224-W246 WeakPolarHBondContact CA-O 3.2Å; C224-W246 PolarHBondContact N-O 2.88Å; C224-F247 HydrophobicContact CB-CD1 4.42Å; C224-F247 VanDerWaalsContact SG-CA 3.58Å; C224-H248 WeakPolarHBondContact CB-CE1 3.11Å; C224-H248 WeakPolarHBondContact CB-ND1 3.41Å; C224-H248 PolarHBondContact SG-N 2.97Å; C224-H248 PolarHBondContact SG-ND1 3.05Å; C224-C251 WeakPolarHBondContact SG-CB 3.31Å
225	L	84.9	Confident	77	Confident	67 Å²	67	86 Å²	86	35%	0.351	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-12.6	176.2	-62.2	176.1	0	0	0	113.3	I244 F247 P265 K266	L225-I244 HydrophobicContact CD2-CD1 4.07Å; L225-F247 HydrophobicContact CD2-CE1 3.91Å; L225-F247 HydrophobicContact CG-CD1 4.05Å; L225-F247 HydrophobicContact CG-CE1 3.84Å; L225-P265 HydrophobicContact CD1-CG 4.37Å; L225-K266 HydrophobicContact CD2-CD 3.82Å; L225-K266 HydrophobicContact CD2-CG 4.2Å
226	C	88	Confident	79	Confident	46 Å²	46	81.2 Å²	81.2	31%	0.311	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-1.9	179	56.3	0	0	0	0	113.3	C224 Q228 H248	C224-C226 VanDerWaalsContact C-N 3.33Å; C226-Q228 HydrophobicContact CB-CG 4.08Å; C226-Q228 WeakPolarHBondContact O-CG 3.48Å; C226-Q228 PolarHBondContact O-N 2.78Å; C226-Q228 PolarHBondContact O-NE2 3.4Å; C226-H248 VanDerWaalsContact SG-CE1 3.51Å; C226-H248 PolarHBondContact SG-ND1 3.09Å; C226-H248 VanDerWaalsContact SG-ND1 3.43Å
227	E	83.3	Confident	81.3	Confident	138 Å²	138	75.3 Å²	75.3	65%	0.645	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	42	178.7	-59.4	179.8	-172.3	0	0	112.2	T222 Y223	T222-E227 WeakPolarHBondContact CB-O 3.34Å; T222-E227 WeakPolarHBondContact CG2-O 3.4Å; Y223-E227 WeakPolarHBondContact O-CA 3.45Å; Y223-E227 PolarHBondContact O-N 2.84Å
228	Q	81.1	Confident	82.8	Confident	101 Å²	101	73.8 Å²	73.8	47%	0.472	42%	0.416	S	S	.	.	B	Isolated β-bridge	trans	-108.8	163.3	178.8	-62.1	-51.8	-66	0	0	111.8	Y223 C226 Y231	Y223-Q228 PolarHBondContact N-O 2.86Å; Y223-Q228 PolarHBondContact O-N 2.79Å; C226-Q228 HydrophobicContact CB-CG 4.08Å; C226-Q228 WeakPolarHBondContact O-CG 3.48Å; C226-Q228 PolarHBondContact O-N 2.78Å; C226-Q228 PolarHBondContact O-NE2 3.4Å; Q228-Y231 HydrophobicContact CB-CE1 4.01Å
229	V	85.8	Confident	83.8	Confident	44 Å²	44	69.1 Å²	69.1	27%	0.267	38%	0.383	S	S	.	.			trans	-58.1	170.5	172.4	-64	0	0	0	0	113.3	E220 Y231 H248	E220-V229 HydrophobicContact CB-CG1 3.92Å; E220-V229 HydrophobicContact CG-CB 4.41Å; E220-V229 HydrophobicContact CG-CG1 4.02Å; V229-Y231 WeakPolarHBondContact O-CD1 3.36Å; V229-Y231 PolarHBondContact O-N 3.5Å; V229-H248 PolarHBondContact O-NE2 2.97Å
230	S	82.4	Confident	85	Confident	66 Å²	66	67.5 Å²	67.5	46%	0.462	38%	0.375	S	S	.	.			trans	-72.3	119.9	179.2	61.3	0	0	0	0	112.1	E220	E220-S230 PolarHBondContact OE1-N 2.84Å; E220-S230 PolarHBondContact OE1-OG 2.74Å
231	Y	83.7	Confident	85.6	Confident	102 Å²	102	70.8 Å²	70.8	40%	0.4	39%	0.39	S	S	.	.			trans	-145.8	152.6	179.2	71	-104	0	0	0	113.6	Q228 V229 H248	Q228-Y231 HydrophobicContact CB-CE1 4.01Å; V229-Y231 WeakPolarHBondContact O-CD1 3.36Å; V229-Y231 PolarHBondContact O-N 3.5Å; Y231-H248 AromaticContact CD1-CD2 3.51Å; Y231-H248 AromaticContact CD1-NE2 3.27Å; Y231-H248 VanDerWaalsContact CD1-NE2 3.27Å; Y231-H248 WeakPolarHBondContact CD1-NE2 3.4Å; Y231-H248 AromaticContact CD2-CD2 3.85Å; Y231-H248 AromaticContact CE1-CD2 3.51Å; Y231-H248 AromaticContact CE1-CE1 3.59Å; Y231-H248 AromaticContact CE1-CG 3.91Å; Y231-H248 AromaticContact CE1-ND1 3.99Å; Y231-H248 AromaticContact CE1-NE2 3.29Å; Y231-H248 VanDerWaalsContact CE1-NE2 3.29Å; Y231-H248 WeakPolarHBondContact CE1-NE2 3.48Å; Y231-H248 HydrophobicContact CE2-CB 4.2Å; Y231-H248 AromaticContact CE2-CD2 3.84Å; Y231-H248 AromaticContact CG-CD2 3.67Å; Y231-H248 AromaticContact CG-NE2 3.89Å; Y231-H248 AromaticContact CZ-CD2 3.67Å; Y231-H248 AromaticContact CZ-CG 3.73Å; Y231-H248 AromaticContact CZ-NE2 3.92Å; Y231-H248 PolarHBondContact O-CD2 3.13Å
232	G	86.4	Confident	86.2	Confident	77 Å²	77	67.5 Å²	67.5	79%	0.794	37%	0.369	S	S	*	.	S	Bend	trans	59.4	-146.5	175.5	0	0	0	0	0	114.7
233	E	89.6	Confident	86.2	Confident	123 Å²	123	70.6 Å²	70.6	58%	0.575	38%	0.377	S	S	*	.	S	Bend	trans	-84.2	131.1	170.8	-66.5	-155.2	117.5	0	0	110.9	F249	E233-F249 HydrophobicContact CB-CB 4.23Å; E233-F249 HydrophobicContact CB-CD1 3.82Å; E233-F249 HydrophobicContact CB-CD2 3.71Å; E233-F249 HydrophobicContact CB-CE1 3.97Å; E233-F249 HydrophobicContact CB-CE2 3.88Å; E233-F249 HydrophobicContact CB-CG 3.68Å; E233-F249 HydrophobicContact CB-CZ 4Å; E233-F249 HydrophobicContact CG-CE2 4.46Å; E233-F249 WeakPolarHBondContact O-CB 3.37Å; E233-F249 VanDerWaalsContact O-CD1 3.29Å; E233-F249 WeakPolarHBondContact O-CD1 3.28Å; E233-F249 PolarHBondContact O-N 2.72Å; E233-F249 WeakPolarHBondContact OE2-CD2 3.39Å; E233-F249 WeakPolarHBondContact OE2-CE2 3.31Å
234	M	91.2	Very high	86.1	Confident	49 Å²	49	68.5 Å²	68.5	24%	0.241	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	148.1	178.6	-60.6	-174.5	80.9	0	0	112.3	Y223 W246 F247	Y223-M234 HydrophobicContact CG-CE 4.42Å; M234-W246 HydrophobicContact CE-CB 4.06Å; M234-F247 CarbonylContact C-O 3.55Å; M234-F247 VanDerWaalsContact CA-O 3.26Å; M234-F247 WeakPolarHBondContact CA-O 3.47Å
235	I	91.9	Very high	86.1	Confident	16 Å²	16	73.5 Å²	73.5	8%	0.082	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	137.7	177.1	-169.5	158.5	0	0	0	111.2	W246 F247 F249 V252 L254 P258 W262	I235-W246 WeakPolarHBondContact O-CA 3.32Å; I235-F247 HydrophobicContact CG2-CB 4.15Å; I235-F247 PolarHBondContact N-O 2.97Å; I235-F247 PolarHBondContact O-N 3.29Å; I235-F249 HydrophobicContact CB-CD1 4.18Å; I235-F249 HydrophobicContact CB-CE1 3.83Å; I235-F249 HydrophobicContact CG2-CD1 4.41Å; I235-V252 HydrophobicContact CG2-CG2 4.13Å; I235-L254 HydrophobicContact CB-CD1 4.34Å; I235-L254 HydrophobicContact CD1-CD1 3.64Å; I235-L254 HydrophobicContact CG2-CD1 3.89Å; I235-P258 HydrophobicContact CD1-CG 3.4Å; I235-P258 VanDerWaalsContact CD1-CG 3.4Å; I235-W262 HydrophobicContact CB-CE3 4.46Å; I235-W262 HydrophobicContact CD1-CB 3.72Å; I235-W262 HydrophobicContact CD1-CD2 3.56Å; I235-W262 HydrophobicContact CD1-CE3 3.91Å; I235-W262 HydrophobicContact CD1-CG 3.47Å; I235-W262 VanDerWaalsContact CD1-CG 3.47Å; I235-W262 HydrophobicContact CG1-CB 4.47Å; I235-W262 HydrophobicContact CG1-CD2 3.98Å; I235-W262 HydrophobicContact CG1-CE3 3.76Å; I235-W262 HydrophobicContact CG1-CG 4.3Å; I235-W262 HydrophobicContact CG1-CZ3 4.28Å; I235-W262 HydrophobicContact CG2-CD2 4.24Å; I235-W262 HydrophobicContact CG2-CE3 3.93Å; I235-W262 HydrophobicContact CG2-CH2 3.63Å; I235-W262 HydrophobicContact CG2-CZ2 3.97Å; I235-W262 HydrophobicContact CG2-CZ3 3.62Å
236	G	91.6	Very high	86.5	Confident	23 Å²	23	76 Å²	76	24%	0.237	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	142.5	170	0	0	0	0	0	111.4	E245	G236-E245 CarbonylContact C-O 3.51Å; G236-E245 WeakPolarHBondContact CA-O 3.41Å
237	C	92	Very high	86.7	Confident	14 Å²	14	73.8 Å²	73.8	10%	0.095	38%	0.384	C	S	.	.			trans	-83.2	120	172.6	-178.9	0	0	0	0	110.6	N239 C242 E245 F247 W262 C264	C237-N239 PolarHBondContact O-N 3.49Å; C237-C242 HydrophobicContact CB-CB 4.14Å; C237-E245 PolarHBondContact N-O 2.98Å; C237-F247 HydrophobicContact CB-CE2 3.99Å; C237-W262 HydrophobicContact CB-CE3 4.44Å; C237-W262 HydrophobicContact CB-CZ3 4.13Å; C237-C264 HydrophobicContact CB-CB 4.27Å; C237-C264 PolarHBondContact SG-N 3.27Å; C237-C264 VanDerWaalsContact SG-N 3.4Å
238	D	89.7	Confident	87.1	Confident	80 Å²	80	67.3 Å²	67.3	43%	0.428	35%	0.353	S	S	.	.	S	Bend	trans	-70.2	20.3	179.6	-75.8	-77	0	0	0	114.5	K261 W262 Y263	D238-K261 HydrophobicContact CB-CB 3.93Å; D238-K261 HydrophobicContact CB-CD 4.33Å; D238-K261 HydrophobicContact CB-CG 4.18Å; D238-K261 WeakPolarHBondContact OD2-CA 3.41Å; D238-W262 PolarHBondContact N-O 3.09Å; D238-W262 PolarHBondContact OD2-N 3.11Å; D238-Y263 HydrophobicContact CB-CD1 4.48Å; D238-Y263 HydrophobicContact CB-CE1 3.92Å; D238-Y263 VanDerWaalsContact O-CE1 3.32Å; D238-Y263 WeakPolarHBondContact O-CE1 3.49Å
239	N	85.1	Confident	87.7	Confident	36 Å²	36	63.2 Å²	63.2	19%	0.193	33%	0.334	C	S	.	.			trans	-103.5	110.3	171.9	179.3	23.4	0	0	0	109	C237 Q241 C242 Y263 C267	C237-N239 PolarHBondContact O-N 3.49Å; N239-Q241 PolarHBondContact O-N 3.17Å; N239-Q241 PolarHBondContact OD1-N 2.97Å; N239-C242 WeakPolarHBondContact O-CB 3.16Å; N239-C242 PolarHBondContact O-N 3.35Å; N239-Y263 HydrophobicContact CB-CD1 3.89Å; N239-Y263 HydrophobicContact CB-CE1 3.98Å; N239-C267 HydrophobicContact CB-CB 4.3Å; N239-C267 PolarHBondContact ND2-SG 2.88Å; N239-C267 VanDerWaalsContact ND2-SG 3.37Å
240	D	82.7	Confident	87.8	Confident	110 Å²	110	65.1 Å²	65.1	59%	0.588	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	4.4	176.9	-64	-36.2	0	0	0	113.8	R283	D240-R283 IonicContact OD1-CZ 3.78Å; D240-R283 IonicContact OD1-NH1 2.72Å; D240-R283 PolarHBondContact OD1-NH1 3.45Å; D240-R283 IonicContact OD2-CZ 2.69Å; D240-R283 IonicContact OD2-NH1 2.63Å; D240-R283 PolarHBondContact OD2-NH1 3.1Å
241	Q	81.2	Confident	88.1	Confident	154 Å²	154	64.2 Å²	64.2	72%	0.72	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.3	13.9	174.5	-58.8	-177.1	0.7	0	0	113.5	N239	N239-Q241 PolarHBondContact O-N 3.17Å; N239-Q241 PolarHBondContact OD1-N 2.97Å
242	C	84.9	Confident	88.3	Confident	7 Å²	7	60.7 Å²	60.7	5%	0.047	33%	0.331	C	S	.	.			trans	-77.6	126.8	176.6	-165	0	0	0	0	111.1	C237 N239 I244 E245 C264	C237-C242 HydrophobicContact CB-CB 4.14Å; N239-C242 WeakPolarHBondContact O-CB 3.16Å; N239-C242 PolarHBondContact O-N 3.35Å; C242-I244 PolarHBondContact O-N 3.41Å; C242-E245 WeakPolarHBondContact O-CG 3.04Å; C242-C264 VanDerWaalsContact SG-SG 3.66Å
243	H	80.2	Confident	88.4	Confident	153 Å²	153	60.3 Å²	60.3	71%	0.708	33%	0.328	S	S	*	.	S	Bend	trans	-76.8	-18.5	-177.7	57.5	-84	0	0	0	114.9	K266	H243-K266 WeakPolarHBondContact NE2-CD 3.37Å
244	I	84.3	Confident	88.2	Confident	30 Å²	30	56.1 Å²	56.1	15%	0.154	31%	0.309	C	S	.	.	S	Bend	trans	-100.7	-30.8	178.7	-76.1	156.9	0	0	0	111.6	C224 L225 C242 W246 F247	C224-I244 VanDerWaalsContact N-CG2 3.35Å; L225-I244 HydrophobicContact CD2-CD1 4.07Å; C242-I244 PolarHBondContact O-N 3.41Å; I244-W246 WeakPolarHBondContact CG2-O 3.41Å; I244-W246 PolarHBondContact O-N 3.32Å; I244-F247 HydrophobicContact CB-CE1 4.19Å; I244-F247 HydrophobicContact CB-CE2 4.31Å; I244-F247 HydrophobicContact CB-CZ 3.69Å; I244-F247 HydrophobicContact CD1-CE1 4.23Å; I244-F247 HydrophobicContact CD1-CZ 4.36Å; I244-F247 HydrophobicContact CG2-CD1 4.22Å; I244-F247 HydrophobicContact CG2-CD2 4.44Å; I244-F247 HydrophobicContact CG2-CE1 3.64Å; I244-F247 HydrophobicContact CG2-CE2 3.88Å; I244-F247 HydrophobicContact CG2-CZ 3.43Å; I244-F247 VanDerWaalsContact CG2-CZ 3.43Å
245	E	88.4	Confident	87.9	Confident	108 Å²	108	59 Å²	59	51%	0.505	33%	0.33	S	S	.	.			trans	56.7	-47.9	-171.8	-60.3	-171	174.4	0	0	116.3	G236 C237 C242	G236-E245 CarbonylContact C-O 3.51Å; G236-E245 WeakPolarHBondContact CA-O 3.41Å; C237-E245 PolarHBondContact N-O 2.98Å; C242-E245 WeakPolarHBondContact O-CG 3.04Å
246	W	92.1	Very high	87.8	Confident	118 Å²	118	67 Å²	67	45%	0.447	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	137.4	-167.8	-64.8	90.9	0	0	0	113.8	Y223 C224 M234 I235 I244	Y223-W246 HydrophobicContact CD1-CB 4.17Å; C224-W246 VanDerWaalsContact CA-O 3.23Å; C224-W246 WeakPolarHBondContact CA-O 3.2Å; C224-W246 PolarHBondContact N-O 2.88Å; M234-W246 HydrophobicContact CE-CB 4.06Å; I235-W246 WeakPolarHBondContact O-CA 3.32Å; I244-W246 WeakPolarHBondContact CG2-O 3.41Å; I244-W246 PolarHBondContact O-N 3.32Å
247	F	92.7	Very high	87.6	Confident	1 Å²	1	74 Å²	74	0%	0.004	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	135.5	-173.8	-59.1	-95.8	0	0	0	111.3	C224 L225 M234 I235 C237 I244 V252 W262 C264	C224-F247 HydrophobicContact CB-CD1 4.42Å; C224-F247 VanDerWaalsContact SG-CA 3.58Å; L225-F247 HydrophobicContact CD2-CE1 3.91Å; L225-F247 HydrophobicContact CG-CD1 4.05Å; L225-F247 HydrophobicContact CG-CE1 3.84Å; M234-F247 CarbonylContact C-O 3.55Å; M234-F247 VanDerWaalsContact CA-O 3.26Å; M234-F247 WeakPolarHBondContact CA-O 3.47Å; I235-F247 HydrophobicContact CG2-CB 4.15Å; I235-F247 PolarHBondContact N-O 2.97Å; I235-F247 PolarHBondContact O-N 3.29Å; C237-F247 HydrophobicContact CB-CE2 3.99Å; I244-F247 HydrophobicContact CB-CE1 4.19Å; I244-F247 HydrophobicContact CB-CE2 4.31Å; I244-F247 HydrophobicContact CB-CZ 3.69Å; I244-F247 HydrophobicContact CD1-CE1 4.23Å; I244-F247 HydrophobicContact CD1-CZ 4.36Å; I244-F247 HydrophobicContact CG2-CD1 4.22Å; I244-F247 HydrophobicContact CG2-CD2 4.44Å; I244-F247 HydrophobicContact CG2-CE1 3.64Å; I244-F247 HydrophobicContact CG2-CE2 3.88Å; I244-F247 HydrophobicContact CG2-CZ 3.43Å; I244-F247 VanDerWaalsContact CG2-CZ 3.43Å; F247-V252 HydrophobicContact CB-CG1 3.76Å; F247-V252 HydrophobicContact CB-CG2 4.42Å; F247-V252 HydrophobicContact CD1-CG1 3.99Å; F247-V252 HydrophobicContact CG-CG1 4.12Å; F247-W262 HydrophobicContact CB-CH2 4.15Å; F247-W262 AromaticContact CD2-CH2 3.98Å; F247-W262 HydrophobicContact CD2-CH2 3.98Å; F247-W262 AromaticContact CD2-CZ3 3.87Å; F247-W262 HydrophobicContact CD2-CZ3 3.87Å; F247-W262 HydrophobicContact CG-CH2 4.08Å; F247-W262 HydrophobicContact CG-CZ3 4.42Å; F247-C264 HydrophobicContact CD1-CB 4.24Å; F247-C264 HydrophobicContact CD2-CB 3.82Å; F247-C264 HydrophobicContact CE1-CB 3.82Å; F247-C264 HydrophobicContact CE2-CB 3.38Å; F247-C264 HydrophobicContact CG-CB 4.26Å; F247-C264 HydrophobicContact CZ-CB 3.38Å; F247-C264 WeakPolarHBondContact CZ-SG 3.42Å
248	H	92.9	Very high	87.3	Confident	1 Å²	1	75.5 Å²	75.5	1%	0.005	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	140.7	171.3	-41.5	92.8	0	0	0	110.3	C224 C226 V229 Y231 S250 C251 V252	C224-H248 WeakPolarHBondContact CB-CE1 3.11Å; C224-H248 WeakPolarHBondContact CB-ND1 3.41Å; C224-H248 PolarHBondContact SG-N 2.97Å; C224-H248 PolarHBondContact SG-ND1 3.05Å; C226-H248 VanDerWaalsContact SG-CE1 3.51Å; C226-H248 PolarHBondContact SG-ND1 3.09Å; C226-H248 VanDerWaalsContact SG-ND1 3.43Å; V229-H248 PolarHBondContact O-NE2 2.97Å; Y231-H248 AromaticContact CD1-CD2 3.51Å; Y231-H248 AromaticContact CD1-NE2 3.27Å; Y231-H248 VanDerWaalsContact CD1-NE2 3.27Å; Y231-H248 WeakPolarHBondContact CD1-NE2 3.4Å; Y231-H248 AromaticContact CD2-CD2 3.85Å; Y231-H248 AromaticContact CE1-CD2 3.51Å; Y231-H248 AromaticContact CE1-CE1 3.59Å; Y231-H248 AromaticContact CE1-CG 3.91Å; Y231-H248 AromaticContact CE1-ND1 3.99Å; Y231-H248 AromaticContact CE1-NE2 3.29Å; Y231-H248 VanDerWaalsContact CE1-NE2 3.29Å; Y231-H248 WeakPolarHBondContact CE1-NE2 3.48Å; Y231-H248 HydrophobicContact CE2-CB 4.2Å; Y231-H248 AromaticContact CE2-CD2 3.84Å; Y231-H248 AromaticContact CG-CD2 3.67Å; Y231-H248 AromaticContact CG-NE2 3.89Å; Y231-H248 AromaticContact CZ-CD2 3.67Å; Y231-H248 AromaticContact CZ-CG 3.73Å; Y231-H248 AromaticContact CZ-NE2 3.92Å; Y231-H248 PolarHBondContact O-CD2 3.13Å; H248-S250 PolarHBondContact O-N 3.29Å; H248-C251 HydrophobicContact CB-CB 4.26Å; H248-C251 PolarHBondContact O-N 3.44Å; H248-V252 PolarHBondContact O-N 3.31Å
249	F	92.2	Very high	86.9	Confident	16 Å²	16	81.9 Å²	81.9	7%	0.07	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-47	-177.8	-92.4	38	0	0	0	112.8	E233 I235 V252 G253 L254 K257	E233-F249 HydrophobicContact CB-CB 4.23Å; E233-F249 HydrophobicContact CB-CD1 3.82Å; E233-F249 HydrophobicContact CB-CD2 3.71Å; E233-F249 HydrophobicContact CB-CE1 3.97Å; E233-F249 HydrophobicContact CB-CE2 3.88Å; E233-F249 HydrophobicContact CB-CG 3.68Å; E233-F249 HydrophobicContact CB-CZ 4Å; E233-F249 HydrophobicContact CG-CE2 4.46Å; E233-F249 WeakPolarHBondContact O-CB 3.37Å; E233-F249 VanDerWaalsContact O-CD1 3.29Å; E233-F249 WeakPolarHBondContact O-CD1 3.28Å; E233-F249 PolarHBondContact O-N 2.72Å; E233-F249 WeakPolarHBondContact OE2-CD2 3.39Å; E233-F249 WeakPolarHBondContact OE2-CE2 3.31Å; I235-F249 HydrophobicContact CB-CD1 4.18Å; I235-F249 HydrophobicContact CB-CE1 3.83Å; I235-F249 HydrophobicContact CG2-CD1 4.41Å; F249-V252 CarbonylContact O-C 3.45Å; F249-V252 PolarHBondContact O-N 3.37Å; F249-G253 PolarHBondContact O-N 3.19Å; F249-G253 VanDerWaalsContact O-N 3.15Å; F249-L254 CarbonylContact C-O 3.55Å; F249-L254 HydrophobicContact CB-CB 4.17Å; F249-L254 WeakPolarHBondContact CB-O 3.36Å; F249-L254 HydrophobicContact CD1-CD1 4.48Å; F249-L254 HydrophobicContact CD2-CB 4.06Å; F249-L254 HydrophobicContact CG-CB 3.98Å; F249-L254 PolarHBondContact O-N 3.36Å; F249-K257 HydrophobicContact CZ-CB 4.11Å
250	S	88.8	Confident	87	Confident	83 Å²	83	83.4 Å²	83.4	58%	0.58	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-54.9	-52	175.8	46.9	0	0	0	0	112.3	H248 V252 G253	H248-S250 PolarHBondContact O-N 3.29Å; S250-V252 PolarHBondContact O-N 3.35Å; S250-G253 PolarHBondContact O-N 2.98Å; S250-G253 VanDerWaalsContact O-N 3.13Å
251	C	88.3	Confident	87.2	Confident	47 Å²	47	83.9 Å²	83.9	32%	0.318	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-65.4	-8	-178	-61.7	0	0	0	0	114.8	C224 H248	C224-C251 WeakPolarHBondContact SG-CB 3.31Å; H248-C251 HydrophobicContact CB-CB 4.26Å; H248-C251 PolarHBondContact O-N 3.44Å
252	V	88.2	Confident	87.6	Confident	28 Å²	28	77.4 Å²	77.4	17%	0.17	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-127.8	19.1	174.6	-58.5	0	0	0	0	113.4	I235 F247 H248 F249 S250 L254 W262	I235-V252 HydrophobicContact CG2-CG2 4.13Å; F247-V252 HydrophobicContact CB-CG1 3.76Å; F247-V252 HydrophobicContact CB-CG2 4.42Å; F247-V252 HydrophobicContact CD1-CG1 3.99Å; F247-V252 HydrophobicContact CG-CG1 4.12Å; H248-V252 PolarHBondContact O-N 3.31Å; F249-V252 CarbonylContact O-C 3.45Å; F249-V252 PolarHBondContact O-N 3.37Å; S250-V252 PolarHBondContact O-N 3.35Å; V252-L254 VanDerWaalsContact C-N 3.3Å; V252-L254 HydrophobicContact CG2-CD1 3.92Å; V252-L254 HydrophobicContact CG2-CG 4.07Å; V252-L254 PolarHBondContact O-N 3.14Å; V252-W262 HydrophobicContact CB-CH2 4.29Å; V252-W262 HydrophobicContact CB-CZ2 3.9Å; V252-W262 HydrophobicContact CG1-CH2 4.14Å; V252-W262 HydrophobicContact CG1-CZ2 4.24Å; V252-W262 HydrophobicContact CG2-CH2 4.01Å; V252-W262 HydrophobicContact CG2-CZ2 3.62Å
253	G	87.6	Confident	87.8	Confident	70 Å²	70	80.8 Å²	80.8	72%	0.722	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	22.9	173.4	0	0	0	0	0	115.1	F249 S250	F249-G253 PolarHBondContact O-N 3.19Å; F249-G253 VanDerWaalsContact O-N 3.15Å; S250-G253 PolarHBondContact O-N 2.98Å; S250-G253 VanDerWaalsContact O-N 3.13Å
254	L	86.1	Confident	88.3	Confident	34 Å²	34	73.5 Å²	73.5	18%	0.178	39%	0.386	C	S	.	.			trans	-95.2	133.9	175.3	-69.7	174.6	0	0	0	110.9	I235 F249 V252 P258 W262	I235-L254 HydrophobicContact CB-CD1 4.34Å; I235-L254 HydrophobicContact CD1-CD1 3.64Å; I235-L254 HydrophobicContact CG2-CD1 3.89Å; F249-L254 CarbonylContact C-O 3.55Å; F249-L254 HydrophobicContact CB-CB 4.17Å; F249-L254 WeakPolarHBondContact CB-O 3.36Å; F249-L254 HydrophobicContact CD1-CD1 4.48Å; F249-L254 HydrophobicContact CD2-CB 4.06Å; F249-L254 HydrophobicContact CG-CB 3.98Å; F249-L254 PolarHBondContact O-N 3.36Å; V252-L254 VanDerWaalsContact C-N 3.3Å; V252-L254 HydrophobicContact CG2-CD1 3.92Å; V252-L254 HydrophobicContact CG2-CG 4.07Å; V252-L254 PolarHBondContact O-N 3.14Å; L254-P258 HydrophobicContact CD1-CG 4.34Å; L254-P258 HydrophobicContact CD2-CG 4.43Å; L254-W262 HydrophobicContact CD1-CZ2 4.37Å
255	T	85.9	Confident	88.3	Confident	111 Å²	111	75.3 Å²	75.3	68%	0.681	40%	0.4	S	S	*	.	S	Bend	trans	-109.5	-11.4	170.2	49.7	0	0	0	0	113
256	Y	88.2	Confident	88	Confident	183 Å²	183	75.7 Å²	75.7	72%	0.718	40%	0.4	S	S	*	.	S	Bend	trans	-150.2	150.9	179.2	-61.4	-78	0	0	0	110.5	P258	Y256-P258 WeakPolarHBondContact O-CD 3.23Å
257	K	88.5	Confident	87.6	Confident	170 Å²	170	71.6 Å²	71.6	74%	0.739	39%	0.389	S	S	*	.			trans	-59.2	118.7	176.3	-175.3	163.5	-174.1	154.4	0	111.7	F249	F249-K257 HydrophobicContact CZ-CB 4.11Å
258	P	85.8	Confident	87.1	Confident	45 Å²	45	78.3 Å²	78.3	29%	0.292	41%	0.414	S	S	.	.			trans	-68.5	158.8	179.8	28.4	-34.5	0	0	0	112	I235 L254 Y256 W262	I235-P258 HydrophobicContact CD1-CG 3.4Å; I235-P258 VanDerWaalsContact CD1-CG 3.4Å; L254-P258 HydrophobicContact CD1-CG 4.34Å; L254-P258 HydrophobicContact CD2-CG 4.43Å; Y256-P258 WeakPolarHBondContact O-CD 3.23Å; P258-W262 HydrophobicContact CG-CB 4.04Å; P258-W262 HydrophobicContact CG-CG 4.08Å
259	K	81.7	Confident	85.9	Confident	214 Å²	214	80.4 Å²	80.4	93%	0.93	44%	0.436	S	S	*	.	S	Bend	trans	-103.6	106	-177.4	-65.2	173.6	-175.6	167.5	0	110.6
260	G	86.6	Confident	84.1	Confident	68 Å²	68	87.7 Å²	87.7	70%	0.701	48%	0.476	S	S	*	.	S	Bend	trans	123.1	-164.8	-179	0	0	0	0	0	111.7
261	K	86.3	Confident	82.1	Confident	120 Å²	120	90.3 Å²	90.3	52%	0.522	48%	0.483	S	S	.	.			trans	-69.5	139.1	170.3	-66.5	-171.3	-178.8	-178.4	0	109.4	D238 Y263 D280	D238-K261 HydrophobicContact CB-CB 3.93Å; D238-K261 HydrophobicContact CB-CD 4.33Å; D238-K261 HydrophobicContact CB-CG 4.18Å; D238-K261 WeakPolarHBondContact OD2-CA 3.41Å; K261-Y263 HydrophobicContact CB-CE2 4.11Å; K261-Y263 WeakPolarHBondContact CD-OH 3.47Å; K261-D280 IonicContact NZ-OD1 3.36Å; K261-D280 PolarHBondContact NZ-OD1 3.28Å; K261-D280 IonicContact NZ-OD2 3.19Å; K261-D280 PolarHBondContact NZ-OD2 3.22Å
262	W	90.9	Very high	80.6	Confident	18 Å²	18	96.8 Å²	96.8	7%	0.068	51%	0.509	C	S	.	.			trans	-123.9	140.1	174.7	178.9	98	0	0	0	111	I235 C237 D238 F247 V252 L254 P258 C264 R268	I235-W262 HydrophobicContact CB-CE3 4.46Å; I235-W262 HydrophobicContact CD1-CB 3.72Å; I235-W262 HydrophobicContact CD1-CD2 3.56Å; I235-W262 HydrophobicContact CD1-CE3 3.91Å; I235-W262 HydrophobicContact CD1-CG 3.47Å; I235-W262 VanDerWaalsContact CD1-CG 3.47Å; I235-W262 HydrophobicContact CG1-CB 4.47Å; I235-W262 HydrophobicContact CG1-CD2 3.98Å; I235-W262 HydrophobicContact CG1-CE3 3.76Å; I235-W262 HydrophobicContact CG1-CG 4.3Å; I235-W262 HydrophobicContact CG1-CZ3 4.28Å; I235-W262 HydrophobicContact CG2-CD2 4.24Å; I235-W262 HydrophobicContact CG2-CE3 3.93Å; I235-W262 HydrophobicContact CG2-CH2 3.63Å; I235-W262 HydrophobicContact CG2-CZ2 3.97Å; I235-W262 HydrophobicContact CG2-CZ3 3.62Å; C237-W262 HydrophobicContact CB-CE3 4.44Å; C237-W262 HydrophobicContact CB-CZ3 4.13Å; D238-W262 PolarHBondContact N-O 3.09Å; D238-W262 PolarHBondContact OD2-N 3.11Å; F247-W262 HydrophobicContact CB-CH2 4.15Å; F247-W262 AromaticContact CD2-CH2 3.98Å; F247-W262 HydrophobicContact CD2-CH2 3.98Å; F247-W262 AromaticContact CD2-CZ3 3.87Å; F247-W262 HydrophobicContact CD2-CZ3 3.87Å; F247-W262 HydrophobicContact CG-CH2 4.08Å; F247-W262 HydrophobicContact CG-CZ3 4.42Å; V252-W262 HydrophobicContact CB-CH2 4.29Å; V252-W262 HydrophobicContact CB-CZ2 3.9Å; V252-W262 HydrophobicContact CG1-CH2 4.14Å; V252-W262 HydrophobicContact CG1-CZ2 4.24Å; V252-W262 HydrophobicContact CG2-CH2 4.01Å; V252-W262 HydrophobicContact CG2-CZ2 3.62Å; L254-W262 HydrophobicContact CD1-CZ2 4.37Å; P258-W262 HydrophobicContact CG-CB 4.04Å; P258-W262 HydrophobicContact CG-CG 4.08Å; W262-C264 HydrophobicContact CH2-CB 3.57Å; W262-C264 HydrophobicContact CZ2-CB 4.48Å; W262-C264 HydrophobicContact CZ3-CB 3.74Å; W262-R268 VanDerWaalsContact NE1-NH2 3.12Å
263	Y	88.6	Confident	78.8	Confident	78 Å²	78	103.2 Å²	103.2	31%	0.306	53%	0.534	S	S	.	.			trans	-120.5	142.3	178.2	-60.3	-77.2	0	0	0	109.8	D238 N239 K261 R268	D238-Y263 HydrophobicContact CB-CD1 4.48Å; D238-Y263 HydrophobicContact CB-CE1 3.92Å; D238-Y263 VanDerWaalsContact O-CE1 3.32Å; D238-Y263 WeakPolarHBondContact O-CE1 3.49Å; N239-Y263 HydrophobicContact CB-CD1 3.89Å; N239-Y263 HydrophobicContact CB-CE1 3.98Å; K261-Y263 HydrophobicContact CB-CE2 4.11Å; K261-Y263 WeakPolarHBondContact CD-OH 3.47Å; Y263-R268 VanDerWaalsContact O-CZ 3.32Å; Y263-R268 PolarHBondContact O-NE 2.9Å; Y263-R268 PolarHBondContact O-NH2 2.68Å
264	C	89.3	Confident	77	Confident	0 Å²	0	106.6 Å²	106.6	0%	0	54%	0.541	C	S	.	.			trans	-74.9	164.5	176	73.5	0	0	0	0	111.7	C237 C242 F247 W262 K266 C267 R268	C237-C264 HydrophobicContact CB-CB 4.27Å; C237-C264 PolarHBondContact SG-N 3.27Å; C237-C264 VanDerWaalsContact SG-N 3.4Å; C242-C264 VanDerWaalsContact SG-SG 3.66Å; F247-C264 HydrophobicContact CD1-CB 4.24Å; F247-C264 HydrophobicContact CD2-CB 3.82Å; F247-C264 HydrophobicContact CE1-CB 3.82Å; F247-C264 HydrophobicContact CE2-CB 3.38Å; F247-C264 HydrophobicContact CG-CB 4.26Å; F247-C264 HydrophobicContact CZ-CB 3.38Å; F247-C264 WeakPolarHBondContact CZ-SG 3.42Å; W262-C264 HydrophobicContact CH2-CB 3.57Å; W262-C264 HydrophobicContact CZ2-CB 4.48Å; W262-C264 HydrophobicContact CZ3-CB 3.74Å; C264-K266 VanDerWaalsContact C-N 3.34Å; C264-K266 PolarHBondContact O-N 2.85Å; C264-C267 CarbonylContact O-C 3.51Å; C264-C267 WeakPolarHBondContact O-CA 3.34Å; C264-C267 PolarHBondContact O-N 3.46Å; C264-C267 VanDerWaalsContact SG-SG 3.66Å; C264-R268 PolarHBondContact O-N 2.91Å; C264-R268 VanDerWaalsContact O-N 3.08Å
265	P	85.8	Confident	75.3	Confident	68 Å²	68	113.8 Å²	113.8	44%	0.442	58%	0.576	S	S	.	*	H	α-helix	trans	-52.8	-48	-178.2	-28	35.9	0	0	0	113.2	L225 C267 R268 G269	L225-P265 HydrophobicContact CD1-CG 4.37Å; P265-C267 PolarHBondContact O-N 3.3Å; P265-C267 VanDerWaalsContact O-N 3.09Å; P265-R268 PolarHBondContact O-N 3.11Å; P265-G269 PolarHBondContact O-N 3.4Å; P265-G269 VanDerWaalsContact O-N 3.13Å
266	K	81.7	Confident	73.3	Confident	117 Å²	117	115 Å²	115	51%	0.509	58%	0.578	S	S	.	*	H	α-helix	trans	-60.8	-17.3	176.5	-68.1	-176.3	175.9	171.8	0	114.3	L225 H243 C264	L225-K266 HydrophobicContact CD2-CD 3.82Å; L225-K266 HydrophobicContact CD2-CG 4.2Å; H243-K266 WeakPolarHBondContact NE2-CD 3.37Å; C264-K266 VanDerWaalsContact C-N 3.34Å; C264-K266 PolarHBondContact O-N 2.85Å
267	C	84.2	Confident	71.6	Confident	32 Å²	32	115 Å²	115	22%	0.216	58%	0.583	C	S	.	*	H	α-helix	trans	-109	1	176.5	-66.5	0	0	0	0	114.1	N239 C264 P265	N239-C267 HydrophobicContact CB-CB 4.3Å; N239-C267 PolarHBondContact ND2-SG 2.88Å; N239-C267 VanDerWaalsContact ND2-SG 3.37Å; C264-C267 CarbonylContact O-C 3.51Å; C264-C267 WeakPolarHBondContact O-CA 3.34Å; C264-C267 PolarHBondContact O-N 3.46Å; C264-C267 VanDerWaalsContact SG-SG 3.66Å; P265-C267 PolarHBondContact O-N 3.3Å; P265-C267 VanDerWaalsContact O-N 3.09Å
268	R	81.3	Confident	69.6	Low	142 Å²	142	111.3 Å²	111.3	54%	0.536	58%	0.578	S	S	.	*	H	α-helix	trans	-95.7	-46.8	167.5	-65.5	-174.9	-163.9	-154.3	3.8	111.3	W262 Y263 C264 P265	W262-R268 VanDerWaalsContact NE1-NH2 3.12Å; Y263-R268 VanDerWaalsContact O-CZ 3.32Å; Y263-R268 PolarHBondContact O-NE 2.9Å; Y263-R268 PolarHBondContact O-NH2 2.68Å; C264-R268 PolarHBondContact O-N 2.91Å; C264-R268 VanDerWaalsContact O-N 3.08Å; P265-R268 PolarHBondContact O-N 3.11Å
269	G	69.2	Low	68	Low	45 Å²	45	114.6 Å²	114.6	46%	0.464	59%	0.592	S	S	.	*			trans	66.3	177.9	-172.8	0	0	0	0	0	113.4	P265 N271	P265-G269 PolarHBondContact O-N 3.4Å; P265-G269 VanDerWaalsContact O-N 3.13Å; G269-N271 PolarHBondContact O-N 2.99Å; G269-N271 VanDerWaalsContact O-N 3.11Å
270	D	52.4	Low	66.6	Low	168 Å²	168	109.2 Å²	109.2	90%	0.898	57%	0.574	S	S	*	*	S	Bend	trans	-80.9	10.9	-167.7	-47.9	-52.5	0	0	0	114.5
271	N	47.2	Very low	64.7	Low	139 Å²	139	114.6 Å²	114.6	74%	0.743	58%	0.578	S	S	*	*			trans	-116.9	97.1	-178.9	-75.9	-84.2	0	0	0	110.3	G269 K273	G269-N271 PolarHBondContact O-N 2.99Å; G269-N271 VanDerWaalsContact O-N 3.11Å; N271-K273 PolarHBondContact O-N 2.84Å
272	E	57	Low	62.5	Low	183 Å²	183	115 Å²	115	86%	0.855	59%	0.586	S	S	*	*			trans	-63.2	-1.6	-172.5	-150.5	-161.2	169.1	0	0	115.3
273	K	50.3	Low	60.7	Low	162 Å²	162	122 Å²	122	70%	0.704	61%	0.612	S	S	*	*	S	Bend	trans	-134	137.7	-169.8	-70	167	-171.1	156.7	0	111.6	N271	N271-K273 PolarHBondContact O-N 2.84Å
274	T	49.7	Very low	58.7	Low	141 Å²	141	126.5 Å²	126.5	87%	0.865	63%	0.633	S	S	*	*			trans	61.8	103	-178.6	48.8	0	0	0	0	117.9
275	M	50.3	Low	56.6	Low	186 Å²	186	132.5 Å²	132.5	92%	0.916	67%	0.666	S	S	*	*			trans	-123.6	126.7	141.6	-85.9	-69.3	175.3	0	0	108
276	D	44.4	Very low	54.8	Low	135 Å²	135	140.5 Å²	140.5	72%	0.722	69%	0.687	S	S	*	*			trans	-98.5	164.4	-166.4	-160.4	6.4	0	0	0	113.6	S278	D276-S278 PolarHBondContact O-N 3.34Å
277	K	51.7	Low	53.3	Low	185 Å²	185	145.7 Å²	145.7	80%	0.804	70%	0.703	S	S	*	*	S	Bend	trans	-73.9	34.2	-164.6	-61.7	170.7	179.6	165.9	0	115.4
278	S	46.6	Very low	51.7	Low	92 Å²	92	149.1 Å²	149.1	64%	0.643	73%	0.727	S	S	*	*			trans	-86.4	-17.4	-167.3	-68.4	0	0	0	0	115.8	D276	D276-S278 PolarHBondContact O-N 3.34Å
279	L	53.7	Low	49.8	Very low	113 Å²	113	156.7 Å²	156.7	59%	0.592	76%	0.756	S	S	*	*	S	Bend	trans	-91.8	-27.2	-174.8	-63.4	-177.9	0	0	0	115.3	K281 N282	L279-K281 PolarHBondContact O-N 3.47Å; L279-N282 PolarHBondContact O-N 2.93Å
280	D	50.9	Low	48.8	Very low	101 Å²	101	162.3 Å²	162.3	54%	0.54	77%	0.771	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64	-10.7	-178.9	-77.3	-61.8	0	0	0	113.3	K261	K261-D280 IonicContact NZ-OD1 3.36Å; K261-D280 PolarHBondContact NZ-OD1 3.28Å; K261-D280 IonicContact NZ-OD2 3.19Å; K261-D280 PolarHBondContact NZ-OD2 3.22Å
281	K	46.6	Very low	48.6	Very low	181 Å²	181	162 Å²	162	79%	0.787	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-28.8	-179.3	-149.9	170.3	-172.6	177.4	0	113.8	L279	L279-K281 PolarHBondContact O-N 3.47Å
282	N	41.3	Very low	48.7	Very low	128 Å²	128	163.3 Å²	163.3	68%	0.684	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-17.4	-170.6	-150	7.9	0	0	0	114.2	L279 K284	L279-N282 PolarHBondContact O-N 2.93Å; N282-K284 VanDerWaalsContact C-N 3.29Å; N282-K284 PolarHBondContact O-N 3.07Å
283	R	51.9	Low	48.2	Very low	165 Å²	165	162.1 Å²	162.1	62%	0.623	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-4.4	177.6	-67.4	175.5	84	146.7	-1.5	113.7	D240	D240-R283 IonicContact OD1-CZ 3.78Å; D240-R283 IonicContact OD1-NH1 2.72Å; D240-R283 PolarHBondContact OD1-NH1 3.45Å; D240-R283 IonicContact OD2-CZ 2.69Å; D240-R283 IonicContact OD2-NH1 2.63Å; D240-R283 PolarHBondContact OD2-NH1 3.1Å
284	K	47.3	Very low	48.1	Very low	173 Å²	173	162.1 Å²	162.1	75%	0.752	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-38.4	-179	-157.9	171.7	-176.5	-179.4	0	113.8	N282 R287	N282-K284 VanDerWaalsContact C-N 3.29Å; N282-K284 PolarHBondContact O-N 3.07Å; K284-R287 PolarHBondContact O-N 2.82Å
285	D	46.3	Very low	48	Very low	127 Å²	127	163.5 Å²	163.5	68%	0.679	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-70.3	-38.3	178.5	-97.8	-43	0	0	0	112.9	R287 S288	D285-R287 PolarHBondContact O-N 3.04Å; D285-S288 PolarHBondContact O-N 3.35Å
286	R	47.9	Very low	47.8	Very low	235 Å²	235	161.9 Å²	161.9	89%	0.887	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-68.3	6.2	176.6	-95.6	-172.8	176.9	-177.6	0.2	115.1
287	R	48.3	Very low	48.1	Very low	227 Å²	227	164 Å²	164	86%	0.857	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-124.4	19.5	175.5	-147.4	179.5	-171.9	-174.5	3.1	112.7	K284 D285	K284-R287 PolarHBondContact O-N 2.82Å; D285-R287 PolarHBondContact O-N 3.04Å
288	S	51.6	Low	47.8	Very low	103 Å²	103	162.3 Å²	162.3	72%	0.72	74%	0.742	S	S	*	*			trans	-142.8	29.5	175.8	-63	0	0	0	0	112.2	D285	D285-S288 PolarHBondContact O-N 3.35Å
289	R	41.4	Very low	47.9	Very low	302 Å²	302	168.6 Å²	168.6	100%	1.14	75%	0.751	S	S	*	*			trans	-136.2	0	160.9	-78.7	-170.8	171.4	-153.5	-2	107.9

Retrieved 289 of 289 residues in 70.6 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).