A0A087Y174_POEFO Loading...

CBY1 interacting BAR domain containing 1

AlphaFold DB , UniProt , Accession A0A087Y174, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 309 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.8	Very low	49.2	Very low	241 Å²	241	126.8 Å²	126.8	100%	1.187	70%	0.699	S	S	*	*				0	101.3	0	-86.1	171.9	147.1	0	0	107.8	V3	M1-V3 PolarHBondContact O-N 3.27Å
2	S	35.1	Very low	51.3	Low	123 Å²	123	128.1 Å²	128.1	86%	0.86	69%	0.685	S	S	*	*			trans	-67.9	115.4	178.2	-53.4	0	0	0	0	108.2	E4	S2-E4 VanDerWaalsContact C-N 3.34Å; S2-E4 PolarHBondContact O-N 3.38Å
3	V	34.6	Very low	53.5	Low	130 Å²	130	122.5 Å²	122.5	79%	0.788	67%	0.667	S	S	*	*			trans	-71.2	97.3	171.2	179.1	0	0	0	0	106	M1 M5	M1-V3 PolarHBondContact O-N 3.27Å; V3-M5 HydrophobicContact CG1-CG 4.28Å; V3-M5 PolarHBondContact O-N 3.01Å
4	E	40.3	Very low	55.4	Low	185 Å²	185	119.8 Å²	119.8	86%	0.864	64%	0.643	S	S	*	*			trans	-59.1	95.4	157.6	-88	-174.2	139	0	0	106.7	S2 S6	S2-E4 VanDerWaalsContact C-N 3.34Å; S2-E4 PolarHBondContact O-N 3.38Å; E4-S6 VanDerWaalsContact C-N 3.27Å; E4-S6 PolarHBondContact O-N 3.05Å
5	M	44.9	Very low	57.1	Low	145 Å²	145	115 Å²	115	71%	0.714	62%	0.617	S	S	*	*			trans	-60.6	99.2	164.5	-73.1	-162.1	-71.8	0	0	106.5	V3 R7	V3-M5 HydrophobicContact CG1-CG 4.28Å; V3-M5 PolarHBondContact O-N 3.01Å; M5-R7 VanDerWaalsContact C-N 3.31Å; M5-R7 PolarHBondContact O-N 3.49Å
6	S	40	Very low	58.9	Low	98 Å²	98	112.3 Å²	112.3	69%	0.685	60%	0.602	S	S	*	*			trans	-50	97.4	168.9	175.2	0	0	0	0	108.4	E4 T8	E4-S6 VanDerWaalsContact C-N 3.27Å; E4-S6 PolarHBondContact O-N 3.05Å; S6-T8 PolarHBondContact O-N 2.89Å
7	R	55.3	Low	60.6	Low	151 Å²	151	109.6 Å²	109.6	57%	0.57	59%	0.585	S	S	*	*			trans	-53	130.7	172.6	-71.5	-174.6	-177.9	174	5	107.6	M5 A11 R12 D15	M5-R7 VanDerWaalsContact C-N 3.31Å; M5-R7 PolarHBondContact O-N 3.49Å; R7-A11 HydrophobicContact CB-CB 4.32Å; R7-R12 HydrophobicContact CB-CG 3.91Å; R7-D15 IonicContact CZ-OD2 3.68Å; R7-D15 IonicContact NH1-OD2 3.57Å; R7-D15 PolarHBondContact NH1-OD2 3.45Å
8	T	58.5	Low	62.2	Low	89 Å²	89	104.6 Å²	104.6	55%	0.546	56%	0.559	S	S	.	*			trans	-53.6	146.2	175.9	55.9	0	0	0	0	109.7	S6 D10 A11 R12	S6-T8 PolarHBondContact O-N 2.89Å; T8-D10 PolarHBondContact O-N 3Å; T8-A11 WeakPolarHBondContact O-CB 3.04Å; T8-A11 PolarHBondContact O-N 3.21Å; T8-R12 PolarHBondContact O-N 3.07Å
9	P	61.7	Low	63.7	Low	113 Å²	113	106.3 Å²	106.3	73%	0.734	56%	0.557	S	S	*	*	H	α-helix	trans	-52.2	-33.5	-179.1	-28.1	34.5	0	0	0	113.5	R12 A13	P9-R12 PolarHBondContact O-N 3.35Å; P9-A13 PolarHBondContact O-N 3.2Å; P9-A13 VanDerWaalsContact O-N 3.14Å
10	D	69.3	Low	65.2	Low	88 Å²	88	107.6 Å²	107.6	47%	0.471	56%	0.558	S	S	.	*	H	α-helix	trans	-66.3	-41.1	175.8	-170.8	19.7	0	0	0	112.5	T8 R12 A13 R14	T8-D10 PolarHBondContact O-N 3Å; D10-R12 PolarHBondContact O-N 3.45Å; D10-A13 PolarHBondContact O-N 3.02Å; D10-R14 VanDerWaalsContact O-CG 3.28Å; D10-R14 WeakPolarHBondContact O-CG 3.49Å; D10-R14 PolarHBondContact O-N 3.42Å; D10-R14 VanDerWaalsContact O-N 3.1Å; D10-R14 IonicContact OD1-CZ 3.56Å; D10-R14 IonicContact OD1-NE 3.53Å; D10-R14 PolarHBondContact OD1-NE 3.13Å; D10-R14 IonicContact OD1-NH2 3.3Å; D10-R14 IonicContact OD2-CZ 2.68Å; D10-R14 VanDerWaalsContact OD2-CZ 3.3Å; D10-R14 IonicContact OD2-NE 2.68Å; D10-R14 PolarHBondContact OD2-NE 3.34Å; D10-R14 IonicContact OD2-NH2 3.7Å; D10-R14 PolarHBondContact OD2-NH2 3.42Å
11	A	69.3	Low	66.6	Low	32 Å²	32	103.3 Å²	103.3	26%	0.264	54%	0.535	S	S	.	.	H	α-helix	trans	-63.8	-41.2	175.7	0	0	0	0	0	112.3	R7 T8 A13 R14 D15	R7-A11 HydrophobicContact CB-CB 4.32Å; T8-A11 WeakPolarHBondContact O-CB 3.04Å; T8-A11 PolarHBondContact O-N 3.21Å; A11-A13 PolarHBondContact O-N 3.36Å; A11-R14 PolarHBondContact O-N 3.43Å; A11-D15 VanDerWaalsContact O-CG 3.3Å; A11-D15 PolarHBondContact O-N 2.99Å
12	R	74.5	Confident	69.6	Low	142 Å²	142	95 Å²	95	54%	0.536	49%	0.494	S	S	.	.	H	α-helix	trans	-65.3	-37.6	176.5	-66.2	-176.3	-177.3	-171.2	-2.9	112.5	R7 T8 P9 D10 N16	R7-R12 HydrophobicContact CB-CG 3.91Å; T8-R12 PolarHBondContact O-N 3.07Å; P9-R12 PolarHBondContact O-N 3.35Å; D10-R12 PolarHBondContact O-N 3.45Å; R12-N16 PolarHBondContact O-N 3.16Å; R12-N16 VanDerWaalsContact O-N 3.11Å; R12-N16 PolarHBondContact O-ND2 2.92Å
13	A	79.6	Confident	72.5	Confident	55 Å²	55	93 Å²	93	46%	0.455	47%	0.471	S	S	.	.	H	α-helix	trans	-64.4	-44	177.1	0	0	0	0	0	111.6	P9 D10 A11 N16 Q17	P9-A13 PolarHBondContact O-N 3.2Å; P9-A13 VanDerWaalsContact O-N 3.14Å; D10-A13 PolarHBondContact O-N 3.02Å; A11-A13 PolarHBondContact O-N 3.36Å; A13-N16 PolarHBondContact O-N 2.87Å; A13-Q17 PolarHBondContact O-N 3.44Å
14	R	79.3	Confident	75.4	Confident	85 Å²	85	89.8 Å²	89.8	32%	0.321	45%	0.449	S	S	.	.	H	α-helix	trans	-64.5	-40.4	177.2	-66.3	171.5	-168.3	-163.8	-0.9	112.5	D10 A11 Q17 T18	D10-R14 VanDerWaalsContact O-CG 3.28Å; D10-R14 WeakPolarHBondContact O-CG 3.49Å; D10-R14 PolarHBondContact O-N 3.42Å; D10-R14 VanDerWaalsContact O-N 3.1Å; D10-R14 IonicContact OD1-CZ 3.56Å; D10-R14 IonicContact OD1-NE 3.53Å; D10-R14 PolarHBondContact OD1-NE 3.13Å; D10-R14 IonicContact OD1-NH2 3.3Å; D10-R14 IonicContact OD2-CZ 2.68Å; D10-R14 VanDerWaalsContact OD2-CZ 3.3Å; D10-R14 IonicContact OD2-NE 2.68Å; D10-R14 PolarHBondContact OD2-NE 3.34Å; D10-R14 IonicContact OD2-NH2 3.7Å; D10-R14 PolarHBondContact OD2-NH2 3.42Å; A11-R14 PolarHBondContact O-N 3.43Å; R14-Q17 WeakPolarHBondContact O-CB 3.41Å; R14-Q17 PolarHBondContact O-N 3.19Å; R14-T18 PolarHBondContact O-N 3.1Å; R14-T18 PolarHBondContact O-OG1 3.01Å
15	D	81.1	Confident	78.1	Confident	48 Å²	48	81 Å²	81	26%	0.257	41%	0.408	S	S	.	.	H	α-helix	trans	-62.5	-43.4	175.7	-72	-18.9	0	0	0	111.6	R7 A11 Q17 T18 R19	R7-D15 IonicContact CZ-OD2 3.68Å; R7-D15 IonicContact NH1-OD2 3.57Å; R7-D15 PolarHBondContact NH1-OD2 3.45Å; A11-D15 VanDerWaalsContact O-CG 3.3Å; A11-D15 PolarHBondContact O-N 2.99Å; D15-Q17 VanDerWaalsContact C-N 3.32Å; D15-Q17 PolarHBondContact O-N 2.92Å; D15-T18 PolarHBondContact O-N 3.42Å; D15-R19 PolarHBondContact O-N 3.06Å
16	N	86.9	Confident	80.6	Confident	72 Å²	72	77.2 Å²	77.2	39%	0.385	39%	0.393	S	S	.	.	H	α-helix	trans	-63.1	-38.8	175.8	-76.2	-27.8	0	0	0	112	R12 A13 R19 K20	R12-N16 PolarHBondContact O-N 3.16Å; R12-N16 VanDerWaalsContact O-N 3.11Å; R12-N16 PolarHBondContact O-ND2 2.92Å; A13-N16 PolarHBondContact O-N 2.87Å; N16-R19 PolarHBondContact OD1-NH2 2.88Å; N16-K20 WeakPolarHBondContact O-CG 3.43Å; N16-K20 PolarHBondContact O-N 2.72Å
17	Q	87.6	Confident	83.4	Confident	66 Å²	66	78.2 Å²	78.2	31%	0.308	39%	0.385	S	S	.	.	H	α-helix	trans	-63.8	-49.5	175.7	-176.2	-172.9	1.8	0	0	111.3	A13 R14 D15 R19 K20 I21 E171	A13-Q17 PolarHBondContact O-N 3.44Å; R14-Q17 WeakPolarHBondContact O-CB 3.41Å; R14-Q17 PolarHBondContact O-N 3.19Å; D15-Q17 VanDerWaalsContact C-N 3.32Å; D15-Q17 PolarHBondContact O-N 2.92Å; Q17-R19 VanDerWaalsContact C-N 3.3Å; Q17-R19 PolarHBondContact O-N 3.01Å; Q17-K20 PolarHBondContact O-N 3.32Å; Q17-I21 HydrophobicContact CG-CD1 4.06Å; Q17-I21 WeakPolarHBondContact O-CG1 3.37Å; Q17-I21 PolarHBondContact O-N 3.46Å; Q17-E171 PolarHBondContact NE2-OE1 3.16Å
18	T	88.9	Confident	85.4	Confident	19 Å²	19	71.5 Å²	71.5	12%	0.117	36%	0.361	C	S	.	.	H	α-helix	trans	-55.9	-46.3	176.1	-60.7	0	0	0	0	111.1	R14 D15 K20 I21 Q22 L118 Q122 R125	R14-T18 PolarHBondContact O-N 3.1Å; R14-T18 PolarHBondContact O-OG1 3.01Å; D15-T18 PolarHBondContact O-N 3.42Å; T18-K20 PolarHBondContact O-N 2.73Å; T18-I21 PolarHBondContact O-N 2.96Å; T18-Q22 WeakPolarHBondContact O-CB 3.35Å; T18-Q22 PolarHBondContact O-N 3.03Å; T18-L118 HydrophobicContact CG2-CD1 3.83Å; T18-L118 HydrophobicContact CG2-CG 4.32Å; T18-Q122 PolarHBondContact OG1-OE1 2.86Å; T18-R125 PolarHBondContact OG1-NH1 3.4Å
19	R	91.1	Very high	87.3	Confident	137 Å²	137	70.9 Å²	70.9	52%	0.517	35%	0.352	S	S	.	.	H	α-helix	trans	-60.4	-45.6	179.4	-175.6	179.1	61.8	-152.4	-10.6	111.5	D15 N16 Q17 I21 Q22 E23	D15-R19 PolarHBondContact O-N 3.06Å; N16-R19 PolarHBondContact OD1-NH2 2.88Å; Q17-R19 VanDerWaalsContact C-N 3.3Å; Q17-R19 PolarHBondContact O-N 3.01Å; R19-I21 PolarHBondContact O-N 3.28Å; R19-Q22 WeakPolarHBondContact O-CB 3.4Å; R19-Q22 PolarHBondContact O-N 3.47Å; R19-E23 HydrophobicContact CG-CG 4.45Å; R19-E23 VanDerWaalsContact CG-OE1 3.28Å; R19-E23 WeakPolarHBondContact CG-OE1 3.35Å; R19-E23 IonicContact NE-OE1 3.59Å; R19-E23 WeakPolarHBondContact O-CG 3.49Å; R19-E23 PolarHBondContact O-N 3.37Å
20	K	93	Very high	89	Confident	132 Å²	132	71.6 Å²	71.6	57%	0.574	34%	0.344	S	S	*	.	H	α-helix	trans	-60.7	-43.1	176.7	-74.8	177.9	178	-172.9	0	112.4	N16 Q17 T18 Q22 E23 N24	N16-K20 WeakPolarHBondContact O-CG 3.43Å; N16-K20 PolarHBondContact O-N 2.72Å; Q17-K20 PolarHBondContact O-N 3.32Å; T18-K20 PolarHBondContact O-N 2.73Å; K20-Q22 VanDerWaalsContact C-N 3.35Å; K20-E23 PolarHBondContact O-N 3.25Å; K20-N24 WeakPolarHBondContact O-CB 3.47Å; K20-N24 VanDerWaalsContact O-CG 3.25Å; K20-N24 PolarHBondContact O-N 2.95Å; K20-N24 PolarHBondContact O-OD1 2.96Å
21	I	94.8	Very high	90.4	Very high	18 Å²	18	72.1 Å²	72.1	9%	0.092	34%	0.343	C	S	.	.	H	α-helix	trans	-62.1	-45.7	176.8	-65	167.5	0	0	0	110	Q17 T18 R19 E23 N24 I25 L118 L170 I174	Q17-I21 HydrophobicContact CG-CD1 4.06Å; Q17-I21 WeakPolarHBondContact O-CG1 3.37Å; Q17-I21 PolarHBondContact O-N 3.46Å; T18-I21 PolarHBondContact O-N 2.96Å; R19-I21 PolarHBondContact O-N 3.28Å; I21-E23 PolarHBondContact O-N 3.23Å; I21-N24 PolarHBondContact O-N 3.47Å; I21-I25 HydrophobicContact CG2-CD1 3.85Å; I21-I25 HydrophobicContact CG2-CG1 4.46Å; I21-I25 WeakPolarHBondContact O-CG1 3.32Å; I21-I25 PolarHBondContact O-N 3.42Å; I21-L118 HydrophobicContact CB-CD1 4.36Å; I21-L118 HydrophobicContact CG2-CD1 4.06Å; I21-L118 HydrophobicContact CG2-CD2 4.08Å; I21-L170 HydrophobicContact CD1-CD2 4.36Å; I21-I174 HydrophobicContact CD1-CG1 4.37Å; I21-I174 HydrophobicContact CG1-CG2 4.33Å; I21-I174 HydrophobicContact CG2-CD1 3.5Å; I21-I174 VanDerWaalsContact CG2-CD1 3.5Å; I21-I174 HydrophobicContact CG2-CG1 3.83Å; I21-I174 HydrophobicContact CG2-CG2 4.48Å
22	Q	95.7	Very high	91.8	Very high	66 Å²	66	71.2 Å²	71.2	31%	0.308	33%	0.333	S	S	.	.	H	α-helix	trans	-59.8	-47.6	177.9	-175.5	57.3	69.4	0	0	112	T18 R19 K20 N24 I25 T26 L118	T18-Q22 WeakPolarHBondContact O-CB 3.35Å; T18-Q22 PolarHBondContact O-N 3.03Å; R19-Q22 WeakPolarHBondContact O-CB 3.4Å; R19-Q22 PolarHBondContact O-N 3.47Å; K20-Q22 VanDerWaalsContact C-N 3.35Å; Q22-N24 VanDerWaalsContact C-N 3.33Å; Q22-N24 PolarHBondContact O-N 3.04Å; Q22-I25 PolarHBondContact O-N 3.29Å; Q22-T26 PolarHBondContact NE2-OG1 3.04Å; Q22-T26 PolarHBondContact O-N 3.47Å; Q22-T26 PolarHBondContact O-OG1 3.07Å; Q22-T26 VanDerWaalsContact O-OG1 3.07Å; Q22-L118 HydrophobicContact CB-CD2 3.83Å; Q22-L118 HydrophobicContact CG-CD2 4.48Å; Q22-L118 VanDerWaalsContact OE1-CD2 3.32Å
23	E	96.4	Very high	92.9	Very high	83 Å²	83	65.9 Å²	65.9	39%	0.388	32%	0.322	S	S	.	.	H	α-helix	trans	-59.8	-43.6	177.3	-74.5	169.4	-167.5	0	0	111.4	R19 K20 I21 T26 K27	R19-E23 HydrophobicContact CG-CG 4.45Å; R19-E23 VanDerWaalsContact CG-OE1 3.28Å; R19-E23 WeakPolarHBondContact CG-OE1 3.35Å; R19-E23 IonicContact NE-OE1 3.59Å; R19-E23 WeakPolarHBondContact O-CG 3.49Å; R19-E23 PolarHBondContact O-N 3.37Å; K20-E23 PolarHBondContact O-N 3.25Å; I21-E23 PolarHBondContact O-N 3.23Å; E23-T26 PolarHBondContact O-N 2.83Å; E23-K27 WeakPolarHBondContact O-CG 3.38Å; E23-K27 PolarHBondContact O-N 3.26Å
24	N	95.7	Very high	93.9	Very high	62 Å²	62	66.3 Å²	66.3	33%	0.332	32%	0.317	S	S	.	.	H	α-helix	trans	-63.7	-44.9	178.2	-74.7	-2.2	0	0	0	112	K20 I21 Q22 T26 K27 V28	K20-N24 WeakPolarHBondContact O-CB 3.47Å; K20-N24 VanDerWaalsContact O-CG 3.25Å; K20-N24 PolarHBondContact O-N 2.95Å; K20-N24 PolarHBondContact O-OD1 2.96Å; I21-N24 PolarHBondContact O-N 3.47Å; Q22-N24 VanDerWaalsContact C-N 3.33Å; Q22-N24 PolarHBondContact O-N 3.04Å; N24-T26 VanDerWaalsContact C-N 3.31Å; N24-T26 PolarHBondContact O-N 2.68Å; N24-K27 PolarHBondContact O-N 3.08Å; N24-V28 WeakPolarHBondContact O-CG2 3.42Å; N24-V28 PolarHBondContact O-N 3.4Å
25	I	97.1	Very high	94.8	Very high	1 Å²	1	64.4 Å²	64.4	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-59.5	-44.6	176.1	-69	169.3	0	0	0	110.4	I21 Q22 V28 E29 V111 K114 L118 I174 F177	I21-I25 HydrophobicContact CG2-CD1 3.85Å; I21-I25 HydrophobicContact CG2-CG1 4.46Å; I21-I25 WeakPolarHBondContact O-CG1 3.32Å; I21-I25 PolarHBondContact O-N 3.42Å; Q22-I25 PolarHBondContact O-N 3.29Å; I25-V28 PolarHBondContact O-N 3.37Å; I25-E29 PolarHBondContact O-N 2.99Å; I25-V111 HydrophobicContact CG2-CB 4.41Å; I25-V111 HydrophobicContact CG2-CG1 3.42Å; I25-V111 VanDerWaalsContact CG2-CG1 3.42Å; I25-K114 HydrophobicContact CD1-CB 3.8Å; I25-K114 HydrophobicContact CG1-CB 4.35Å; I25-L118 HydrophobicContact CD1-CD2 4.28Å; I25-I174 HydrophobicContact CD1-CD1 4.23Å; I25-F177 HydrophobicContact CG1-CE1 4.47Å
26	T	97.5	Very high	95.6	Very high	65 Å²	65	63 Å²	63	40%	0.399	31%	0.306	S	S	.	.	H	α-helix	trans	-63.8	-41.5	177.8	-60.9	0	0	0	0	112.2	Q22 E23 N24 V28 E29 K30	Q22-T26 PolarHBondContact NE2-OG1 3.04Å; Q22-T26 PolarHBondContact O-N 3.47Å; Q22-T26 PolarHBondContact O-OG1 3.07Å; Q22-T26 VanDerWaalsContact O-OG1 3.07Å; E23-T26 PolarHBondContact O-N 2.83Å; N24-T26 VanDerWaalsContact C-N 3.31Å; N24-T26 PolarHBondContact O-N 2.68Å; T26-V28 VanDerWaalsContact C-N 3.35Å; T26-V28 PolarHBondContact O-N 3.39Å; T26-E29 PolarHBondContact O-N 3.15Å; T26-K30 WeakPolarHBondContact O-CB 3.33Å; T26-K30 PolarHBondContact O-N 3.35Å
27	K	97.9	Very high	96.2	Very high	119 Å²	119	66 Å²	66	52%	0.517	32%	0.318	S	S	.	.	H	α-helix	trans	-61.7	-43.2	175.6	-75.5	174.2	-178.3	177.6	0	111.8	E23 N24 H31	E23-K27 WeakPolarHBondContact O-CG 3.38Å; E23-K27 PolarHBondContact O-N 3.26Å; N24-K27 PolarHBondContact O-N 3.08Å; K27-H31 PolarHBondContact O-CD2 2.99Å; K27-H31 PolarHBondContact O-N 3.05Å
28	V	97.9	Very high	96.7	Very high	10 Å²	10	68.8 Å²	68.8	6%	0.061	33%	0.334	C	S	.	.	H	α-helix	trans	-63.4	-48.2	177.3	174	0	0	0	0	110.5	N24 I25 T26 K30 F32 Y107 V111 F177 K181	N24-V28 WeakPolarHBondContact O-CG2 3.42Å; N24-V28 PolarHBondContact O-N 3.4Å; I25-V28 PolarHBondContact O-N 3.37Å; T26-V28 VanDerWaalsContact C-N 3.35Å; T26-V28 PolarHBondContact O-N 3.39Å; V28-K30 VanDerWaalsContact C-N 3.34Å; V28-K30 PolarHBondContact O-N 2.9Å; V28-F32 HydrophobicContact CG1-CD1 4.17Å; V28-F32 HydrophobicContact CG1-CD2 4.26Å; V28-F32 HydrophobicContact CG1-CE1 4.35Å; V28-F32 HydrophobicContact CG1-CE2 4.43Å; V28-F32 HydrophobicContact CG1-CG 4.13Å; V28-F32 HydrophobicContact CG1-CZ 4.46Å; V28-F32 WeakPolarHBondContact O-CB 3.41Å; V28-F32 PolarHBondContact O-N 3.4Å; V28-Y107 HydrophobicContact CG1-CD1 3.92Å; V28-Y107 HydrophobicContact CG1-CE1 4.33Å; V28-V111 HydrophobicContact CG1-CG2 4.05Å; V28-F177 HydrophobicContact CB-CZ 4.26Å; V28-F177 HydrophobicContact CG1-CZ 4.04Å; V28-F177 HydrophobicContact CG2-CE1 4.39Å; V28-F177 HydrophobicContact CG2-CZ 4.14Å; V28-K181 HydrophobicContact CG2-CD 3.49Å; V28-K181 VanDerWaalsContact CG2-CD 3.49Å
29	E	97.6	Very high	97.2	Very high	76 Å²	76	69.6 Å²	69.6	36%	0.355	34%	0.336	S	S	.	.	H	α-helix	trans	-55.4	-49.1	178.2	-167.4	177.5	-133.6	0	0	112	I25 T26 G33 V111 R115	I25-E29 PolarHBondContact O-N 2.99Å; T26-E29 PolarHBondContact O-N 3.15Å; E29-G33 PolarHBondContact O-N 3.05Å; E29-V111 HydrophobicContact CB-CB 4.48Å; E29-V111 HydrophobicContact CB-CG1 3.64Å; E29-V111 HydrophobicContact CB-CG2 4.34Å; E29-V111 HydrophobicContact CG-CG1 3.88Å; E29-R115 VanDerWaalsContact CD-NH2 3.32Å; E29-R115 IonicContact OE1-CZ 3.51Å; E29-R115 IonicContact OE1-NH1 3.47Å; E29-R115 PolarHBondContact OE1-NH1 3.17Å; E29-R115 IonicContact OE1-NH2 3.52Å; E29-R115 PolarHBondContact OE1-NH2 3.35Å; E29-R115 IonicContact OE2-CZ 3.04Å; E29-R115 IonicContact OE2-NH1 3.67Å; E29-R115 IonicContact OE2-NH2 2.86Å; E29-R115 PolarHBondContact OE2-NH2 2.61Å
30	K	98.2	Very high	97.6	Very high	128 Å²	128	64.3 Å²	64.3	56%	0.557	32%	0.322	S	S	*	.	H	α-helix	trans	-60.4	-64.4	179	-179.1	179.3	179.6	-177.5	0	110.6	T26 V28 F32 G33 D34	T26-K30 WeakPolarHBondContact O-CB 3.33Å; T26-K30 PolarHBondContact O-N 3.35Å; V28-K30 VanDerWaalsContact C-N 3.34Å; V28-K30 PolarHBondContact O-N 2.9Å; K30-F32 PolarHBondContact O-N 3.1Å; K30-G33 WeakPolarHBondContact O-CA 3.29Å; K30-G33 PolarHBondContact O-N 3.46Å; K30-G33 VanDerWaalsContact O-N 3.1Å; K30-D34 WeakPolarHBondContact CG-OD2 3.41Å; K30-D34 PolarHBondContact O-N 2.92Å
31	H	98.6	Very high	97.8	Very high	99 Å²	99	59.6 Å²	59.6	46%	0.458	31%	0.307	S	S	.	.	H	α-helix	trans	-67.8	-33.8	-170	-68.6	-62.3	0	0	0	113.1	K27 M35	K27-H31 PolarHBondContact O-CD2 2.99Å; K27-H31 PolarHBondContact O-N 3.05Å; H31-M35 HydrophobicContact CB-CE 4.44Å; H31-M35 VanDerWaalsContact O-CB 3.32Å; H31-M35 WeakPolarHBondContact O-CB 3.36Å; H31-M35 VanDerWaalsContact O-CE 3.3Å; H31-M35 WeakPolarHBondContact O-CE 3.48Å; H31-M35 VanDerWaalsContact O-CG 3.25Å; H31-M35 WeakPolarHBondContact O-CG 3.49Å; H31-M35 PolarHBondContact O-N 3.24Å
32	F	98.6	Very high	98	Very high	13 Å²	13	63.1 Å²	63.1	6%	0.057	32%	0.32	C	S	.	.	H	α-helix	trans	-73.1	-33.9	175.5	-78	35.6	0	0	0	111.2	V28 K30 M35 C36 L104 Y107 K181 I185	V28-F32 HydrophobicContact CG1-CD1 4.17Å; V28-F32 HydrophobicContact CG1-CD2 4.26Å; V28-F32 HydrophobicContact CG1-CE1 4.35Å; V28-F32 HydrophobicContact CG1-CE2 4.43Å; V28-F32 HydrophobicContact CG1-CG 4.13Å; V28-F32 HydrophobicContact CG1-CZ 4.46Å; V28-F32 WeakPolarHBondContact O-CB 3.41Å; V28-F32 PolarHBondContact O-N 3.4Å; K30-F32 PolarHBondContact O-N 3.1Å; F32-M35 HydrophobicContact CD1-CE 3.51Å; F32-M35 HydrophobicContact CE1-CE 3.9Å; F32-M35 HydrophobicContact CG-CE 4.24Å; F32-C36 WeakPolarHBondContact O-CB 3.49Å; F32-C36 PolarHBondContact O-N 3.49Å; F32-L104 HydrophobicContact CB-CD2 4.33Å; F32-L104 HydrophobicContact CD2-CD2 3.84Å; F32-L104 HydrophobicContact CE2-CD2 4.33Å; F32-L104 HydrophobicContact CG-CD2 4.08Å; F32-Y107 AromaticContact CD2-CD1 3.59Å; F32-Y107 HydrophobicContact CD2-CD1 3.59Å; F32-Y107 AromaticContact CD2-CD2 3.85Å; F32-Y107 HydrophobicContact CD2-CD2 3.85Å; F32-Y107 HydrophobicContact CD2-CE1 4.06Å; F32-Y107 HydrophobicContact CD2-CE2 4.3Å; F32-Y107 AromaticContact CD2-CG 3.48Å; F32-Y107 HydrophobicContact CD2-CG 3.48Å; F32-Y107 VanDerWaalsContact CD2-CG 3.48Å; F32-Y107 AromaticContact CE2-CD1 3.65Å; F32-Y107 HydrophobicContact CE2-CD1 3.65Å; F32-Y107 AromaticContact CE2-CD2 3.92Å; F32-Y107 HydrophobicContact CE2-CD2 3.92Å; F32-Y107 AromaticContact CE2-CE1 3.6Å; F32-Y107 HydrophobicContact CE2-CE1 3.6Å; F32-Y107 AromaticContact CE2-CE2 3.89Å; F32-Y107 HydrophobicContact CE2-CE2 3.89Å; F32-Y107 AromaticContact CE2-CG 3.82Å; F32-Y107 HydrophobicContact CE2-CG 3.82Å; F32-Y107 AromaticContact CE2-CZ 3.74Å; F32-Y107 HydrophobicContact CZ-CE1 4.45Å; F32-K181 HydrophobicContact CZ-CG 3.97Å; F32-I185 HydrophobicContact CE1-CD1 4.08Å; F32-I185 HydrophobicContact CE1-CG1 4.07Å; F32-I185 HydrophobicContact CZ-CD1 3.87Å; F32-I185 HydrophobicContact CZ-CG1 3.56Å
33	G	98.4	Very high	98.2	Very high	30 Å²	30	60 Å²	60	31%	0.309	31%	0.306	S	S	.	.	H	α-helix	trans	-60.8	-51.9	170.7	0	0	0	0	0	111.7	E29 K30 M35 C36 Q37	E29-G33 PolarHBondContact O-N 3.05Å; K30-G33 WeakPolarHBondContact O-CA 3.29Å; K30-G33 PolarHBondContact O-N 3.46Å; K30-G33 VanDerWaalsContact O-N 3.1Å; G33-M35 PolarHBondContact O-N 3.38Å; G33-C36 WeakPolarHBondContact O-CB 3.36Å; G33-C36 PolarHBondContact O-N 2.95Å; G33-C36 VanDerWaalsContact O-N 3.16Å; G33-Q37 WeakPolarHBondContact O-CG 3.28Å; G33-Q37 PolarHBondContact O-N 2.93Å
34	D	98.8	Very high	98.3	Very high	63 Å²	63	63.6 Å²	63.6	34%	0.337	32%	0.315	S	S	.	.	H	α-helix	trans	-59.5	-48.8	179.1	-59.5	-14.7	0	0	0	110.6	K30 C36 Q37 L38	K30-D34 WeakPolarHBondContact CG-OD2 3.41Å; K30-D34 PolarHBondContact O-N 2.92Å; D34-C36 VanDerWaalsContact C-N 3.33Å; D34-C36 PolarHBondContact O-N 3.15Å; D34-Q37 PolarHBondContact O-N 3.47Å; D34-L38 WeakPolarHBondContact O-CG 3.47Å; D34-L38 PolarHBondContact O-N 3.05Å
35	M	98.7	Very high	98.4	Very high	45 Å²	45	68 Å²	68	22%	0.222	33%	0.332	C	S	.	.	H	α-helix	trans	-60.1	-41.3	175.6	-75.3	-174	-70.8	0	0	112.1	H31 F32 G33 Q37 L38 F39 L104 F189	H31-M35 HydrophobicContact CB-CE 4.44Å; H31-M35 VanDerWaalsContact O-CB 3.32Å; H31-M35 WeakPolarHBondContact O-CB 3.36Å; H31-M35 VanDerWaalsContact O-CE 3.3Å; H31-M35 WeakPolarHBondContact O-CE 3.48Å; H31-M35 VanDerWaalsContact O-CG 3.25Å; H31-M35 WeakPolarHBondContact O-CG 3.49Å; H31-M35 PolarHBondContact O-N 3.24Å; F32-M35 HydrophobicContact CD1-CE 3.51Å; F32-M35 HydrophobicContact CE1-CE 3.9Å; F32-M35 HydrophobicContact CG-CE 4.24Å; G33-M35 PolarHBondContact O-N 3.38Å; M35-Q37 VanDerWaalsContact C-N 3.31Å; M35-Q37 PolarHBondContact O-N 3.36Å; M35-L38 PolarHBondContact O-N 2.76Å; M35-F39 HydrophobicContact CB-CD2 4.36Å; M35-F39 HydrophobicContact CB-CE2 4.45Å; M35-F39 WeakPolarHBondContact O-CB 3.39Å; M35-F39 WeakPolarHBondContact O-CD2 3.45Å; M35-F39 PolarHBondContact O-N 2.91Å; M35-L104 HydrophobicContact CB-CD1 4.07Å; M35-F189 HydrophobicContact SD-CE1 3.97Å; M35-F189 HydrophobicContact SD-CZ 3.76Å
36	C	98.7	Very high	98.5	Very high	18 Å²	18	68.7 Å²	68.7	12%	0.122	34%	0.336	C	S	.	.	H	α-helix	trans	-59.8	-43.2	177.3	-173.9	0	0	0	0	111.5	F32 G33 D34 A40 L104	F32-C36 WeakPolarHBondContact O-CB 3.49Å; F32-C36 PolarHBondContact O-N 3.49Å; G33-C36 WeakPolarHBondContact O-CB 3.36Å; G33-C36 PolarHBondContact O-N 2.95Å; G33-C36 VanDerWaalsContact O-N 3.16Å; D34-C36 VanDerWaalsContact C-N 3.33Å; D34-C36 PolarHBondContact O-N 3.15Å; C36-A40 VanDerWaalsContact O-CB 3.26Å; C36-A40 WeakPolarHBondContact O-CB 3.33Å; C36-A40 PolarHBondContact O-N 3.34Å; C36-L104 HydrophobicContact CB-CB 3.85Å
37	Q	98.7	Very high	98.6	Very high	137 Å²	137	66.5 Å²	66.5	64%	0.64	32%	0.324	S	S	*	.	H	α-helix	trans	-67.1	-44.7	178.2	-70.1	178.1	-6	0	0	111.6	G33 D34 M35 A40 A41	G33-Q37 WeakPolarHBondContact O-CG 3.28Å; G33-Q37 PolarHBondContact O-N 2.93Å; D34-Q37 PolarHBondContact O-N 3.47Å; M35-Q37 VanDerWaalsContact C-N 3.31Å; M35-Q37 PolarHBondContact O-N 3.36Å; Q37-A40 PolarHBondContact O-N 3.41Å; Q37-A41 WeakPolarHBondContact O-CB 3.31Å; Q37-A41 PolarHBondContact O-N 3.3Å
38	L	98.9	Very high	98.6	Very high	123 Å²	123	67.9 Å²	67.9	64%	0.644	33%	0.326	S	S	*	.	H	α-helix	trans	-62.6	-46.6	178	-71.5	171.2	0	0	0	111.9	D34 M35 A40 A41 Y42	D34-L38 WeakPolarHBondContact O-CG 3.47Å; D34-L38 PolarHBondContact O-N 3.05Å; M35-L38 PolarHBondContact O-N 2.76Å; L38-A40 VanDerWaalsContact C-N 3.33Å; L38-A40 PolarHBondContact O-N 3.02Å; L38-A41 PolarHBondContact O-N 3.11Å; L38-Y42 WeakPolarHBondContact O-CB 3.24Å; L38-Y42 PolarHBondContact O-N 3.47Å
39	F	98.8	Very high	98.6	Very high	37 Å²	37	72 Å²	72	16%	0.162	35%	0.347	C	S	.	.	H	α-helix	trans	-65.3	-36.1	176	-79.7	-63.9	0	0	0	112.4	M35 Y42 A43 V100 I101 L104 F189 F192	M35-F39 HydrophobicContact CB-CD2 4.36Å; M35-F39 HydrophobicContact CB-CE2 4.45Å; M35-F39 WeakPolarHBondContact O-CB 3.39Å; M35-F39 WeakPolarHBondContact O-CD2 3.45Å; M35-F39 PolarHBondContact O-N 2.91Å; F39-Y42 WeakPolarHBondContact O-CB 3.35Å; F39-Y42 PolarHBondContact O-N 2.7Å; F39-A43 PolarHBondContact O-N 2.8Å; F39-V100 HydrophobicContact CB-CG1 4.22Å; F39-V100 HydrophobicContact CD1-CG1 3.84Å; F39-V100 HydrophobicContact CD2-CG1 3.77Å; F39-V100 HydrophobicContact CE1-CG1 4.1Å; F39-V100 HydrophobicContact CE2-CG1 4.05Å; F39-V100 HydrophobicContact CG-CG1 3.68Å; F39-V100 HydrophobicContact CZ-CG1 4.2Å; F39-I101 HydrophobicContact CB-CG1 3.86Å; F39-L104 HydrophobicContact CD2-CD1 3.71Å; F39-L104 HydrophobicContact CE2-CD1 4.23Å; F39-F189 HydrophobicContact CE2-CE1 4.46Å; F39-F192 HydrophobicContact CD1-CD2 4.23Å; F39-F192 HydrophobicContact CD1-CE2 4.31Å; F39-F192 HydrophobicContact CE1-CD1 4.25Å; F39-F192 AromaticContact CE1-CD2 3.66Å; F39-F192 HydrophobicContact CE1-CD2 3.66Å; F39-F192 HydrophobicContact CE1-CE1 4.36Å; F39-F192 AromaticContact CE1-CE2 3.8Å; F39-F192 HydrophobicContact CE1-CE2 3.8Å; F39-F192 AromaticContact CE1-CG 3.91Å; F39-F192 HydrophobicContact CE1-CG 3.91Å; F39-F192 HydrophobicContact CE1-CZ 4.15Å; F39-F192 HydrophobicContact CZ-CG 4.4Å
40	A	98.8	Very high	98.7	Very high	26 Å²	26	70.1 Å²	70.1	22%	0.215	34%	0.337	C	S	.	.	H	α-helix	trans	-66.4	-38.9	173.9	0	0	0	0	0	112.4	C36 Q37 L38 R44 I101	C36-A40 VanDerWaalsContact O-CB 3.26Å; C36-A40 WeakPolarHBondContact O-CB 3.33Å; C36-A40 PolarHBondContact O-N 3.34Å; Q37-A40 PolarHBondContact O-N 3.41Å; L38-A40 VanDerWaalsContact C-N 3.33Å; L38-A40 PolarHBondContact O-N 3.02Å; A40-R44 WeakPolarHBondContact O-CG 3.47Å; A40-R44 PolarHBondContact O-N 2.86Å; A40-R44 VanDerWaalsContact O-N 3.11Å; A40-R44 PolarHBondContact O-NE 2.92Å; A40-I101 HydrophobicContact CB-CD1 4.23Å; A40-I101 HydrophobicContact CB-CG2 4.28Å
41	A	98.8	Very high	98.7	Very high	32 Å²	32	67.5 Å²	67.5	26%	0.264	33%	0.329	S	S	.	.	H	α-helix	trans	-64.8	-43.4	172.3	0	0	0	0	0	111.4	Q37 L38 R44 K45	Q37-A41 WeakPolarHBondContact O-CB 3.31Å; Q37-A41 PolarHBondContact O-N 3.3Å; L38-A41 PolarHBondContact O-N 3.11Å; A41-R44 PolarHBondContact O-N 3.25Å; A41-K45 WeakPolarHBondContact O-CG 3.42Å; A41-K45 PolarHBondContact O-N 3.26Å
42	Y	98.8	Very high	98.7	Very high	93 Å²	93	69.6 Å²	69.6	37%	0.365	34%	0.337	S	S	.	.	H	α-helix	trans	-55.9	-53.2	174.9	-178.2	-85.9	0	0	0	111.4	L38 F39 R44 K45 T46 L96 F192 E196	L38-Y42 WeakPolarHBondContact O-CB 3.24Å; L38-Y42 PolarHBondContact O-N 3.47Å; F39-Y42 WeakPolarHBondContact O-CB 3.35Å; F39-Y42 PolarHBondContact O-N 2.7Å; Y42-R44 VanDerWaalsContact C-N 3.32Å; Y42-R44 PolarHBondContact O-N 3.22Å; Y42-K45 PolarHBondContact O-N 3.08Å; Y42-K45 VanDerWaalsContact O-N 3.12Å; Y42-T46 PolarHBondContact O-N 3.31Å; Y42-T46 PolarHBondContact O-OG1 3.44Å; Y42-L96 HydrophobicContact CD1-CD1 3.98Å; Y42-L96 HydrophobicContact CE1-CD1 3.86Å; Y42-F192 HydrophobicContact CE1-CE2 4.15Å; Y42-E196 WeakPolarHBondContact CE1-OE1 3.49Å; Y42-E196 PolarHBondContact OH-OE1 3.22Å; Y42-E196 PolarHBondContact OH-OE2 2.71Å
43	A	98.8	Very high	98.7	Very high	1 Å²	1	69.5 Å²	69.5	1%	0.008	34%	0.338	C	S	.	.	H	α-helix	trans	-59.8	-39.8	178.9	0	0	0	0	0	112.7	F39 T46 A47 L96 I101	F39-A43 PolarHBondContact O-N 2.8Å; A43-T46 PolarHBondContact O-N 3.45Å; A43-A47 PolarHBondContact O-N 2.96Å; A43-L96 HydrophobicContact CB-CB 4.31Å; A43-L96 HydrophobicContact CB-CD1 4.41Å; A43-I101 HydrophobicContact CB-CD1 3.81Å
44	R	98.8	Very high	98.7	Very high	158 Å²	158	70.9 Å²	70.9	60%	0.596	34%	0.338	S	S	*	.	H	α-helix	trans	-64	-42.2	174.2	-74.9	-176.6	-67.6	179.4	3.3	112.5	A40 A41 Y42 T46 A47 R48	A40-R44 WeakPolarHBondContact O-CG 3.47Å; A40-R44 PolarHBondContact O-N 2.86Å; A40-R44 VanDerWaalsContact O-N 3.11Å; A40-R44 PolarHBondContact O-NE 2.92Å; A41-R44 PolarHBondContact O-N 3.25Å; Y42-R44 VanDerWaalsContact C-N 3.32Å; Y42-R44 PolarHBondContact O-N 3.22Å; R44-T46 VanDerWaalsContact C-N 3.31Å; R44-T46 PolarHBondContact O-N 2.99Å; R44-A47 PolarHBondContact O-N 3.37Å; R44-R48 WeakPolarHBondContact O-CG 3.24Å; R44-R48 PolarHBondContact O-N 3.29Å
45	K	98.8	Very high	98.7	Very high	154 Å²	154	72 Å²	72	67%	0.67	34%	0.344	S	S	*	.	H	α-helix	trans	-63	-38.9	174.7	-73.5	-171.6	177.8	-169.9	0	111.2	A41 Y42 R48 L49	A41-K45 WeakPolarHBondContact O-CG 3.42Å; A41-K45 PolarHBondContact O-N 3.26Å; Y42-K45 PolarHBondContact O-N 3.08Å; Y42-K45 VanDerWaalsContact O-N 3.12Å; K45-R48 PolarHBondContact O-N 3.09Å; K45-L49 PolarHBondContact O-N 3.45Å
46	T	98.8	Very high	98.7	Very high	16 Å²	16	74.8 Å²	74.8	10%	0.098	36%	0.359	C	S	.	.	H	α-helix	trans	-63.5	-41.1	173.8	-57.2	0	0	0	0	112.3	Y42 A43 R44 L49 R50 R89 V93	Y42-T46 PolarHBondContact O-N 3.31Å; Y42-T46 PolarHBondContact O-OG1 3.44Å; A43-T46 PolarHBondContact O-N 3.45Å; R44-T46 VanDerWaalsContact C-N 3.31Å; R44-T46 PolarHBondContact O-N 2.99Å; T46-L49 PolarHBondContact O-N 3.33Å; T46-R50 PolarHBondContact O-N 3.45Å; T46-R50 VanDerWaalsContact O-N 3.13Å; T46-R89 HydrophobicContact CG2-CG 3.71Å; T46-V93 HydrophobicContact CG2-CG2 3.79Å
47	A	98.8	Very high	98.7	Very high	18 Å²	18	75.1 Å²	75.1	15%	0.149	36%	0.361	C	S	.	.	H	α-helix	trans	-62.9	-44.4	173.6	0	0	0	0	0	112.1	A43 R44 L49 R50 D51 V93	A43-A47 PolarHBondContact O-N 2.96Å; R44-A47 PolarHBondContact O-N 3.37Å; A47-L49 VanDerWaalsContact C-N 3.3Å; A47-L49 PolarHBondContact O-N 3.09Å; A47-R50 WeakPolarHBondContact O-CA 3.4Å; A47-R50 VanDerWaalsContact O-CB 3.25Å; A47-R50 WeakPolarHBondContact O-CB 3.39Å; A47-R50 PolarHBondContact O-N 3.01Å; A47-D51 VanDerWaalsContact O-CG 3.32Å; A47-D51 PolarHBondContact O-N 2.98Å; A47-V93 HydrophobicContact CB-CG1 4.37Å; A47-V93 HydrophobicContact CB-CG2 4.15Å
48	R	98.8	Very high	98.7	Very high	149 Å²	149	76.5 Å²	76.5	56%	0.562	36%	0.36	S	S	*	.	H	α-helix	trans	-60.7	-38.1	175.7	-71.5	177.9	177.8	-175.7	-3.3	112.6	R44 K45 R50 D51 K52	R44-R48 WeakPolarHBondContact O-CG 3.24Å; R44-R48 PolarHBondContact O-N 3.29Å; K45-R48 PolarHBondContact O-N 3.09Å; R48-R50 VanDerWaalsContact C-N 3.31Å; R48-R50 PolarHBondContact O-N 3.46Å; R48-D51 PolarHBondContact O-N 3.5Å; R48-K52 PolarHBondContact O-N 3.32Å
49	L	98.7	Very high	98.7	Very high	96 Å²	96	76 Å²	76	50%	0.503	35%	0.354	S	S	.	.	H	α-helix	trans	-61.9	-40.6	174.2	177.7	63	0	0	0	111.6	K45 T46 A47 A53	K45-L49 PolarHBondContact O-N 3.45Å; T46-L49 PolarHBondContact O-N 3.33Å; A47-L49 VanDerWaalsContact C-N 3.3Å; A47-L49 PolarHBondContact O-N 3.09Å; L49-A53 WeakPolarHBondContact O-CB 3.44Å; L49-A53 PolarHBondContact O-N 2.94Å
50	R	98.6	Very high	98.7	Very high	37 Å²	37	76.2 Å²	76.2	14%	0.14	36%	0.357	C	S	.	.	H	α-helix	trans	-59.7	-49.5	173.5	-177.2	-152.5	59.4	-130.4	7.1	110.8	T46 A47 R48 K52 A53 D54 Q86 R89	T46-R50 PolarHBondContact O-N 3.45Å; T46-R50 VanDerWaalsContact O-N 3.13Å; A47-R50 WeakPolarHBondContact O-CA 3.4Å; A47-R50 VanDerWaalsContact O-CB 3.25Å; A47-R50 WeakPolarHBondContact O-CB 3.39Å; A47-R50 PolarHBondContact O-N 3.01Å; R48-R50 VanDerWaalsContact C-N 3.31Å; R48-R50 PolarHBondContact O-N 3.46Å; R50-K52 VanDerWaalsContact C-N 3.31Å; R50-K52 PolarHBondContact O-N 3.42Å; R50-A53 CarbonylContact O-C 3.57Å; R50-A53 WeakPolarHBondContact O-CA 3.2Å; R50-A53 WeakPolarHBondContact O-CB 3.43Å; R50-A53 PolarHBondContact O-N 3.44Å; R50-D54 PolarHBondContact O-N 2.9Å; R50-Q86 HydrophobicContact CG-CB 3.64Å; R50-Q86 HydrophobicContact CG-CG 4.16Å; R50-R89 HydrophobicContact CB-CB 4.47Å; R50-R89 HydrophobicContact CB-CG 4.07Å; R50-R89 HydrophobicContact CG-CB 4.49Å
51	D	98.7	Very high	98.7	Very high	72 Å²	72	75.5 Å²	75.5	39%	0.385	35%	0.352	S	S	.	.	H	α-helix	trans	-59.1	-42.7	-178.4	-59.4	-28.9	0	0	0	111.6	A47 R48 A53 D54 L55	A47-D51 VanDerWaalsContact O-CG 3.32Å; A47-D51 PolarHBondContact O-N 2.98Å; R48-D51 PolarHBondContact O-N 3.5Å; D51-A53 VanDerWaalsContact C-N 3.34Å; D51-A53 PolarHBondContact O-N 3.34Å; D51-D54 PolarHBondContact O-N 3.11Å; D51-L55 PolarHBondContact O-N 3.01Å
52	K	98.8	Very high	98.7	Very high	144 Å²	144	78.5 Å²	78.5	63%	0.626	36%	0.363	S	S	*	.	H	α-helix	trans	-64.8	-37.2	174.3	-68.2	-63.9	-178.6	-176.7	0	112.5	R48 R50 D54 L55 L56	R48-K52 PolarHBondContact O-N 3.32Å; R50-K52 VanDerWaalsContact C-N 3.31Å; R50-K52 PolarHBondContact O-N 3.42Å; K52-D54 VanDerWaalsContact C-N 3.34Å; K52-L55 HydrophobicContact CD-CD1 4.28Å; K52-L55 PolarHBondContact O-N 3.26Å; K52-L56 PolarHBondContact O-N 3.02Å
53	A	98.4	Very high	98.7	Very high	10 Å²	10	79.5 Å²	79.5	8%	0.083	37%	0.367	C	S	.	.	H	α-helix	trans	-67.8	-33.2	175.5	0	0	0	0	0	112.6	L49 R50 D51 L55 L56 V57 Q86	L49-A53 WeakPolarHBondContact O-CB 3.44Å; L49-A53 PolarHBondContact O-N 2.94Å; R50-A53 CarbonylContact O-C 3.57Å; R50-A53 WeakPolarHBondContact O-CA 3.2Å; R50-A53 WeakPolarHBondContact O-CB 3.43Å; R50-A53 PolarHBondContact O-N 3.44Å; D51-A53 VanDerWaalsContact C-N 3.34Å; D51-A53 PolarHBondContact O-N 3.34Å; A53-L55 VanDerWaalsContact C-N 3.31Å; A53-L55 PolarHBondContact O-N 2.72Å; A53-L56 WeakPolarHBondContact O-CB 3.43Å; A53-L56 PolarHBondContact O-N 3.02Å; A53-V57 WeakPolarHBondContact O-CG2 3.37Å; A53-V57 PolarHBondContact O-N 2.68Å; A53-Q86 HydrophobicContact CB-CG 3.8Å
54	D	98.6	Very high	98.7	Very high	59 Å²	59	79.5 Å²	79.5	32%	0.316	37%	0.367	S	S	.	.	H	α-helix	trans	-65.2	-35.3	174.2	-69.5	-29.2	0	0	0	112	R50 D51 K52 V57 R58 Q86	R50-D54 PolarHBondContact O-N 2.9Å; D51-D54 PolarHBondContact O-N 3.11Å; K52-D54 VanDerWaalsContact C-N 3.34Å; D54-V57 PolarHBondContact O-N 2.91Å; D54-R58 PolarHBondContact O-N 3.44Å; D54-R58 VanDerWaalsContact O-N 3.09Å; D54-Q86 WeakPolarHBondContact OD1-CB 3.32Å; D54-Q86 VanDerWaalsContact OD1-CG 3.29Å; D54-Q86 WeakPolarHBondContact OD1-CG 3.47Å
55	L	98.8	Very high	98.6	Very high	86 Å²	86	75.8 Å²	75.8	45%	0.45	36%	0.359	S	S	.	.	H	α-helix	trans	-64	-42.5	170.9	-60.3	179.6	0	0	0	111.6	D51 K52 A53 R58 E59	D51-L55 PolarHBondContact O-N 3.01Å; K52-L55 HydrophobicContact CD-CD1 4.28Å; K52-L55 PolarHBondContact O-N 3.26Å; A53-L55 VanDerWaalsContact C-N 3.31Å; A53-L55 PolarHBondContact O-N 2.72Å; L55-R58 WeakPolarHBondContact O-CB 3.45Å; L55-R58 PolarHBondContact O-N 3.1Å; L55-E59 PolarHBondContact O-N 3.01Å
56	L	98.6	Very high	98.6	Very high	104 Å²	104	75.1 Å²	75.1	55%	0.545	36%	0.36	S	S	.	.	H	α-helix	trans	-61.8	-45	175.6	-69.1	175.1	0	0	0	111.8	K52 A53 R58 E59 I60	K52-L56 PolarHBondContact O-N 3.02Å; A53-L56 WeakPolarHBondContact O-CB 3.43Å; A53-L56 PolarHBondContact O-N 3.02Å; L56-R58 VanDerWaalsContact C-N 3.25Å; L56-R58 PolarHBondContact O-N 2.99Å; L56-E59 PolarHBondContact O-N 3.44Å; L56-I60 WeakPolarHBondContact O-CB 3.45Å; L56-I60 WeakPolarHBondContact O-CD1 3.18Å; L56-I60 WeakPolarHBondContact O-CG1 3.39Å; L56-I60 PolarHBondContact O-N 2.94Å
57	V	98.8	Very high	98.5	Very high	26 Å²	26	76.8 Å²	76.8	16%	0.158	37%	0.366	C	S	.	.	H	α-helix	trans	-54.7	-45.7	175.5	166.6	0	0	0	0	110.5	A53 D54 G61 A79 L82 A83	A53-V57 WeakPolarHBondContact O-CG2 3.37Å; A53-V57 PolarHBondContact O-N 2.68Å; D54-V57 PolarHBondContact O-N 2.91Å; V57-G61 PolarHBondContact O-N 3.26Å; V57-A79 HydrophobicContact CG1-CB 4.39Å; V57-L82 HydrophobicContact CG2-CB 3.91Å; V57-L82 HydrophobicContact CG2-CD2 3.85Å; V57-L82 HydrophobicContact CG2-CG 3.72Å; V57-A83 HydrophobicContact CG1-CB 3.86Å; V57-A83 HydrophobicContact CG2-CB 4.13Å
58	R	98.6	Very high	98.4	Very high	165 Å²	165	77.6 Å²	77.6	62%	0.623	37%	0.37	S	S	*	.	H	α-helix	trans	-62	-51	178.9	-171.4	-174.5	-57.8	173.8	3.4	111.4	D54 L55 L56 G61 L62	D54-R58 PolarHBondContact O-N 3.44Å; D54-R58 VanDerWaalsContact O-N 3.09Å; L55-R58 WeakPolarHBondContact O-CB 3.45Å; L55-R58 PolarHBondContact O-N 3.1Å; L56-R58 VanDerWaalsContact C-N 3.25Å; L56-R58 PolarHBondContact O-N 2.99Å; R58-G61 CarbonylContact O-C 3.58Å; R58-G61 WeakPolarHBondContact O-CA 3.16Å; R58-G61 PolarHBondContact O-N 3.45Å; R58-G61 VanDerWaalsContact O-N 3.13Å; R58-L62 HydrophobicContact CG-CD1 4.39Å; R58-L62 WeakPolarHBondContact O-CG 3.35Å; R58-L62 PolarHBondContact O-N 2.92Å
59	E	98.8	Very high	98.2	Very high	113 Å²	113	74.4 Å²	74.4	53%	0.528	37%	0.368	S	S	.	.	H	α-helix	trans	-64.2	-44	-177.5	-174.2	55.8	-150.1	0	0	112.2	L55 L56 G61 L62 Y63	L55-E59 PolarHBondContact O-N 3.01Å; L56-E59 PolarHBondContact O-N 3.44Å; E59-G61 PolarHBondContact O-N 2.79Å; E59-L62 PolarHBondContact O-N 2.86Å; E59-L62 VanDerWaalsContact O-N 3.12Å; E59-Y63 PolarHBondContact O-N 2.87Å
60	I	98.8	Very high	98.2	Very high	41 Å²	41	71.4 Å²	71.4	21%	0.21	35%	0.353	C	S	.	.	H	α-helix	trans	-57.6	-42.8	173.5	-66.2	164.1	0	0	0	109.9	L56 A64 M75 F78 A79 L82	L56-I60 WeakPolarHBondContact O-CB 3.45Å; L56-I60 WeakPolarHBondContact O-CD1 3.18Å; L56-I60 WeakPolarHBondContact O-CG1 3.39Å; L56-I60 PolarHBondContact O-N 2.94Å; I60-A64 WeakPolarHBondContact O-CB 3.32Å; I60-A64 PolarHBondContact O-N 3Å; I60-M75 HydrophobicContact CG2-CB 4.4Å; I60-M75 HydrophobicContact CG2-CE 4.16Å; I60-F78 HydrophobicContact CD1-CD1 4.18Å; I60-F78 HydrophobicContact CD1-CE1 3.9Å; I60-F78 HydrophobicContact CG2-CD1 4.45Å; I60-A79 HydrophobicContact CB-CB 4.28Å; I60-A79 HydrophobicContact CG2-CB 3.88Å; I60-L82 HydrophobicContact CD1-CD2 4.2Å
61	G	98.4	Very high	98.1	Very high	11 Å²	11	71.9 Å²	71.9	11%	0.113	36%	0.358	C	S	.	.	H	α-helix	trans	-60.5	-45.3	175.6	0	0	0	0	0	112.8	V57 R58 E59 D65 K76	V57-G61 PolarHBondContact O-N 3.26Å; R58-G61 CarbonylContact O-C 3.58Å; R58-G61 WeakPolarHBondContact O-CA 3.16Å; R58-G61 PolarHBondContact O-N 3.45Å; R58-G61 VanDerWaalsContact O-N 3.13Å; E59-G61 PolarHBondContact O-N 2.79Å; G61-D65 PolarHBondContact O-N 3.03Å; G61-K76 VanDerWaalsContact O-CE 3.28Å; G61-K76 WeakPolarHBondContact O-CE 3.33Å; G61-K76 PolarHBondContact O-NZ 2.96Å
62	L	98.6	Very high	98.1	Very high	95 Å²	95	71.7 Å²	71.7	50%	0.497	35%	0.354	S	S	.	.	H	α-helix	trans	-64.6	-48.2	179.1	-70	173.7	0	0	0	111.4	R58 E59 A64 D65	R58-L62 HydrophobicContact CG-CD1 4.39Å; R58-L62 WeakPolarHBondContact O-CG 3.35Å; R58-L62 PolarHBondContact O-N 2.92Å; E59-L62 PolarHBondContact O-N 2.86Å; E59-L62 VanDerWaalsContact O-N 3.12Å; L62-A64 VanDerWaalsContact C-N 3.34Å; L62-A64 PolarHBondContact O-N 2.78Å; L62-D65 PolarHBondContact O-N 2.83Å; L62-D65 VanDerWaalsContact O-N 3.15Å
63	Y	98.7	Very high	98.1	Very high	115 Å²	115	70.2 Å²	70.2	45%	0.451	34%	0.344	S	S	.	.	H	α-helix	trans	-62.5	-41.9	178.5	-171.8	-124.2	0	0	0	111.7	E59 D65 M66 E67 M75	E59-Y63 PolarHBondContact O-N 2.87Å; Y63-D65 PolarHBondContact O-N 3.36Å; Y63-D65 VanDerWaalsContact O-N 3.12Å; Y63-M66 HydrophobicContact CD2-CE 3.56Å; Y63-M66 HydrophobicContact CE2-CE 4.26Å; Y63-M66 HydrophobicContact CG-CE 4.49Å; Y63-M66 WeakPolarHBondContact O-CB 3.21Å; Y63-M66 PolarHBondContact O-N 2.87Å; Y63-E67 HydrophobicContact CE1-CG 4.18Å; Y63-E67 WeakPolarHBondContact CE2-OE1 3.47Å; Y63-E67 PolarHBondContact OH-OE1 3.09Å; Y63-M75 HydrophobicContact CD1-CE 3.48Å; Y63-M75 VanDerWaalsContact CD1-CE 3.48Å; Y63-M75 HydrophobicContact CD1-SD 4.36Å; Y63-M75 HydrophobicContact CE1-CE 4.29Å; Y63-M75 HydrophobicContact CG-CE 4.26Å
64	A	98.5	Very high	98.1	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-56.4	-31.6	176.3	0	0	0	0	0	113	I60 L62 M66 E67 K72 M75 K76	I60-A64 WeakPolarHBondContact O-CB 3.32Å; I60-A64 PolarHBondContact O-N 3Å; L62-A64 VanDerWaalsContact C-N 3.34Å; L62-A64 PolarHBondContact O-N 2.78Å; A64-M66 PolarHBondContact O-N 3.48Å; A64-E67 PolarHBondContact O-N 3.22Å; A64-K72 WeakPolarHBondContact O-CB 3.37Å; A64-K72 WeakPolarHBondContact O-CD 3.36Å; A64-K72 WeakPolarHBondContact O-CG 3.25Å; A64-M75 HydrophobicContact CB-CB 3.53Å; A64-M75 HydrophobicContact CB-CE 4.08Å; A64-M75 HydrophobicContact CB-CG 4.48Å; A64-M75 HydrophobicContact CB-SD 4.16Å; A64-K76 HydrophobicContact CB-CD 4.06Å; A64-K76 HydrophobicContact CB-CG 3.97Å
65	D	98.3	Very high	98.1	Very high	80 Å²	80	68.1 Å²	68.1	43%	0.428	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-18.6	178.9	-79.7	-39	0	0	0	114.1	G61 L62 Y63 K72 K76	G61-D65 PolarHBondContact O-N 3.03Å; L62-D65 PolarHBondContact O-N 2.83Å; L62-D65 VanDerWaalsContact O-N 3.15Å; Y63-D65 PolarHBondContact O-N 3.36Å; Y63-D65 VanDerWaalsContact O-N 3.12Å; D65-K72 WeakPolarHBondContact OD1-CE 3.46Å; D65-K72 IonicContact OD1-NZ 2.89Å; D65-K72 PolarHBondContact OD1-NZ 3.08Å; D65-K76 VanDerWaalsContact CG-CE 3.46Å; D65-K76 WeakPolarHBondContact OD1-CE 3.44Å; D65-K76 IonicContact OD1-NZ 3.87Å; D65-K76 PolarHBondContact OD1-NZ 2.99Å; D65-K76 IonicContact OD2-NZ 3.22Å; D65-K76 PolarHBondContact OD2-NZ 3.43Å
66	M	97.4	Very high	98	Very high	140 Å²	140	66.8 Å²	66.8	69%	0.69	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-8.1	178.3	-58.1	-172.3	-73.3	0	0	113.3	Y63 A64	Y63-M66 HydrophobicContact CD2-CE 3.56Å; Y63-M66 HydrophobicContact CE2-CE 4.26Å; Y63-M66 HydrophobicContact CG-CE 4.49Å; Y63-M66 WeakPolarHBondContact O-CB 3.21Å; Y63-M66 PolarHBondContact O-N 2.87Å; A64-M66 PolarHBondContact O-N 3.48Å
67	E	97	Very high	98	Very high	51 Å²	51	65.1 Å²	65.1	24%	0.238	31%	0.311	C	S	.	.	S	Bend	trans	-90.3	166.7	-176.5	-72.7	-57.7	150.6	0	0	113.6	Y63 A64 L71 K72 M75	Y63-E67 HydrophobicContact CE1-CG 4.18Å; Y63-E67 WeakPolarHBondContact CE2-OE1 3.47Å; Y63-E67 PolarHBondContact OH-OE1 3.09Å; A64-E67 PolarHBondContact O-N 3.22Å; E67-L71 HydrophobicContact CB-CB 4.36Å; E67-L71 HydrophobicContact CB-CD2 4.08Å; E67-L71 HydrophobicContact CB-CG 4.09Å; E67-L71 HydrophobicContact CG-CD2 3.89Å; E67-L71 HydrophobicContact CG-CG 4.23Å; E67-L71 WeakPolarHBondContact OE2-CD2 3.47Å; E67-K72 HydrophobicContact CB-CB 4.46Å; E67-M75 HydrophobicContact CG-SD 4.1Å
68	T	96.3	Very high	98	Very high	36 Å²	36	66.7 Å²	66.7	22%	0.221	32%	0.316	C	S	.	.			trans	-60.9	154.9	175.8	43	0	0	0	0	112.2	D70 L71 K72 D222 V225	T68-D70 VanDerWaalsContact C-N 3.35Å; T68-D70 PolarHBondContact O-N 3.07Å; T68-L71 PolarHBondContact O-N 3.27Å; T68-K72 WeakPolarHBondContact O-CB 3.47Å; T68-K72 PolarHBondContact O-N 3.24Å; T68-D222 WeakPolarHBondContact CB-OD1 3.43Å; T68-D222 WeakPolarHBondContact CB-OD2 3.48Å; T68-D222 HydrophobicContact CG2-CB 4.43Å; T68-D222 WeakPolarHBondContact OG1-CB 3.34Å; T68-D222 PolarHBondContact OG1-OD1 3.41Å; T68-D222 PolarHBondContact OG1-OD2 3.45Å; T68-V225 HydrophobicContact CG2-CB 4.35Å; T68-V225 HydrophobicContact CG2-CG1 4.14Å
69	P	96	Very high	98	Very high	82 Å²	82	59.1 Å²	59.1	53%	0.532	29%	0.289	S	S	.	.	H	α-helix	trans	-56.1	-39.2	-165.5	-28	36.5	0	0	0	115.8	R73	P69-R73 WeakPolarHBondContact O-CB 3.47Å; P69-R73 PolarHBondContact O-N 2.99Å
70	D	96.6	Very high	98	Very high	32 Å²	32	60 Å²	60	17%	0.171	29%	0.293	C	S	.	.	H	α-helix	trans	-75.9	-44.9	-178.4	-77.5	-79.3	0	0	0	111.6	T68 R73 G74 D222	T68-D70 VanDerWaalsContact C-N 3.35Å; T68-D70 PolarHBondContact O-N 3.07Å; D70-R73 PolarHBondContact O-N 3.01Å; D70-R73 IonicContact OD1-CZ 3.7Å; D70-R73 IonicContact OD1-NH1 3.56Å; D70-R73 PolarHBondContact OD1-NH1 3.04Å; D70-R73 IonicContact OD1-NH2 2.76Å; D70-R73 PolarHBondContact OD1-NH2 3.28Å; D70-G74 PolarHBondContact O-N 3.14Å; D70-D222 WeakPolarHBondContact CB-OD1 3.43Å; D70-D222 PolarHBondContact N-OD1 3.06Å
71	L	97.8	Very high	98	Very high	47 Å²	47	60.3 Å²	60.3	25%	0.246	29%	0.293	C	S	.	.	H	α-helix	trans	-63.7	-45	175.6	179.7	57.9	0	0	0	111.5	E67 T68 R73 G74 M75 V217 D222	E67-L71 HydrophobicContact CB-CB 4.36Å; E67-L71 HydrophobicContact CB-CD2 4.08Å; E67-L71 HydrophobicContact CB-CG 4.09Å; E67-L71 HydrophobicContact CG-CD2 3.89Å; E67-L71 HydrophobicContact CG-CG 4.23Å; E67-L71 WeakPolarHBondContact OE2-CD2 3.47Å; T68-L71 PolarHBondContact O-N 3.27Å; L71-R73 VanDerWaalsContact C-N 3.29Å; L71-R73 PolarHBondContact O-N 3.35Å; L71-G74 PolarHBondContact O-N 3.39Å; L71-M75 HydrophobicContact CD1-CG 3.92Å; L71-M75 HydrophobicContact CD1-SD 4Å; L71-M75 HydrophobicContact CG-CG 4.32Å; L71-M75 HydrophobicContact CG-SD 3.91Å; L71-M75 WeakPolarHBondContact O-CB 3.28Å; L71-M75 WeakPolarHBondContact O-CG 3.36Å; L71-M75 PolarHBondContact O-N 3.06Å; L71-V217 HydrophobicContact CB-CG1 4.18Å; L71-V217 HydrophobicContact CD1-CG1 4.27Å; L71-V217 HydrophobicContact CD1-CG2 4.43Å; L71-D222 WeakPolarHBondContact CA-OD2 3.34Å; L71-D222 WeakPolarHBondContact CB-OD2 3.42Å; L71-D222 PolarHBondContact N-OD2 3.45Å
72	K	98.1	Very high	98	Very high	69 Å²	69	60.7 Å²	60.7	30%	0.3	29%	0.293	S	S	.	.	H	α-helix	trans	-51.1	-50.1	172	170.1	164.3	-173.6	158.1	0	111.1	A64 D65 E67 T68 K76	A64-K72 WeakPolarHBondContact O-CB 3.37Å; A64-K72 WeakPolarHBondContact O-CD 3.36Å; A64-K72 WeakPolarHBondContact O-CG 3.25Å; D65-K72 WeakPolarHBondContact OD1-CE 3.46Å; D65-K72 IonicContact OD1-NZ 2.89Å; D65-K72 PolarHBondContact OD1-NZ 3.08Å; E67-K72 HydrophobicContact CB-CB 4.46Å; T68-K72 WeakPolarHBondContact O-CB 3.47Å; T68-K72 PolarHBondContact O-N 3.24Å; K72-K76 HydrophobicContact CG-CG 4.44Å; K72-K76 WeakPolarHBondContact O-CB 3.39Å; K72-K76 VanDerWaalsContact O-CG 3.23Å; K72-K76 WeakPolarHBondContact O-CG 3.48Å; K72-K76 PolarHBondContact O-N 3.42Å
73	R	98.2	Very high	98	Very high	112 Å²	112	57.6 Å²	57.6	42%	0.423	28%	0.281	S	S	.	.	H	α-helix	trans	-61.9	-48.9	-179.8	-176	-177.2	67.3	-116.1	1.4	111.3	P69 D70 L71 M75 K76 Q77	P69-R73 WeakPolarHBondContact O-CB 3.47Å; P69-R73 PolarHBondContact O-N 2.99Å; D70-R73 PolarHBondContact O-N 3.01Å; D70-R73 IonicContact OD1-CZ 3.7Å; D70-R73 IonicContact OD1-NH1 3.56Å; D70-R73 PolarHBondContact OD1-NH1 3.04Å; D70-R73 IonicContact OD1-NH2 2.76Å; D70-R73 PolarHBondContact OD1-NH2 3.28Å; L71-R73 VanDerWaalsContact C-N 3.29Å; L71-R73 PolarHBondContact O-N 3.35Å; R73-M75 PolarHBondContact O-N 3.2Å; R73-K76 PolarHBondContact O-N 3.5Å; R73-Q77 WeakPolarHBondContact O-CG 3.5Å; R73-Q77 PolarHBondContact O-N 3.47Å
74	G	98.4	Very high	98	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-62	-42.4	-179.9	0	0	0	0	0	112.9	D70 L71 Q77 F78	D70-G74 PolarHBondContact O-N 3.14Å; L71-G74 PolarHBondContact O-N 3.39Å; G74-Q77 PolarHBondContact O-N 3Å; G74-F78 WeakPolarHBondContact O-CB 3.49Å; G74-F78 PolarHBondContact O-N 3.27Å
75	M	98.6	Very high	98.1	Very high	24 Å²	24	56.6 Å²	56.6	12%	0.118	28%	0.279	C	S	.	.	H	α-helix	trans	-66.8	-42.2	176.6	-72.4	179.6	70.3	0	0	112.9	I60 Y63 A64 E67 L71 R73 F78 A79 I214	I60-M75 HydrophobicContact CG2-CB 4.4Å; I60-M75 HydrophobicContact CG2-CE 4.16Å; Y63-M75 HydrophobicContact CD1-CE 3.48Å; Y63-M75 VanDerWaalsContact CD1-CE 3.48Å; Y63-M75 HydrophobicContact CD1-SD 4.36Å; Y63-M75 HydrophobicContact CE1-CE 4.29Å; Y63-M75 HydrophobicContact CG-CE 4.26Å; A64-M75 HydrophobicContact CB-CB 3.53Å; A64-M75 HydrophobicContact CB-CE 4.08Å; A64-M75 HydrophobicContact CB-CG 4.48Å; A64-M75 HydrophobicContact CB-SD 4.16Å; E67-M75 HydrophobicContact CG-SD 4.1Å; L71-M75 HydrophobicContact CD1-CG 3.92Å; L71-M75 HydrophobicContact CD1-SD 4Å; L71-M75 HydrophobicContact CG-CG 4.32Å; L71-M75 HydrophobicContact CG-SD 3.91Å; L71-M75 WeakPolarHBondContact O-CB 3.28Å; L71-M75 WeakPolarHBondContact O-CG 3.36Å; L71-M75 PolarHBondContact O-N 3.06Å; R73-M75 PolarHBondContact O-N 3.2Å; M75-F78 PolarHBondContact O-N 2.96Å; M75-A79 WeakPolarHBondContact O-CB 3.4Å; M75-A79 PolarHBondContact O-N 3.4Å; M75-I214 HydrophobicContact CG-CD1 4.21Å
76	K	98.5	Very high	98.1	Very high	58 Å²	58	52.9 Å²	52.9	25%	0.252	26%	0.259	S	S	.	.	H	α-helix	trans	-61.8	-45.3	175.7	-73	-68.3	-169.3	179.4	0	111.2	G61 A64 D65 K72 R73 A79 E80	G61-K76 VanDerWaalsContact O-CE 3.28Å; G61-K76 WeakPolarHBondContact O-CE 3.33Å; G61-K76 PolarHBondContact O-NZ 2.96Å; A64-K76 HydrophobicContact CB-CD 4.06Å; A64-K76 HydrophobicContact CB-CG 3.97Å; D65-K76 VanDerWaalsContact CG-CE 3.46Å; D65-K76 WeakPolarHBondContact OD1-CE 3.44Å; D65-K76 IonicContact OD1-NZ 3.87Å; D65-K76 PolarHBondContact OD1-NZ 2.99Å; D65-K76 IonicContact OD2-NZ 3.22Å; D65-K76 PolarHBondContact OD2-NZ 3.43Å; K72-K76 HydrophobicContact CG-CG 4.44Å; K72-K76 WeakPolarHBondContact O-CB 3.39Å; K72-K76 VanDerWaalsContact O-CG 3.23Å; K72-K76 WeakPolarHBondContact O-CG 3.48Å; K72-K76 PolarHBondContact O-N 3.42Å; R73-K76 PolarHBondContact O-N 3.5Å; K76-A79 PolarHBondContact O-N 3.28Å; K76-E80 WeakPolarHBondContact O-CG 3.32Å; K76-E80 PolarHBondContact O-N 3.1Å
77	Q	98.6	Very high	98.1	Very high	69 Å²	69	51.8 Å²	51.8	32%	0.322	26%	0.256	S	S	.	.	H	α-helix	trans	-61	-46.1	175.5	-72.7	174.8	-21.1	0	0	111.4	R73 G74 A79 E80 H81	R73-Q77 WeakPolarHBondContact O-CG 3.5Å; R73-Q77 PolarHBondContact O-N 3.47Å; G74-Q77 PolarHBondContact O-N 3Å; Q77-A79 VanDerWaalsContact C-N 3.33Å; Q77-A79 PolarHBondContact O-N 3.22Å; Q77-E80 WeakPolarHBondContact O-CB 3.38Å; Q77-E80 PolarHBondContact O-N 3.46Å; Q77-H81 PolarHBondContact O-CD2 3.04Å; Q77-H81 PolarHBondContact O-N 3.48Å
78	F	98.7	Very high	98.2	Very high	59 Å²	59	53.1 Å²	53.1	26%	0.259	26%	0.259	S	S	.	.	H	α-helix	trans	-55.6	-47.2	174.7	178.2	-88.7	0	0	0	112	I60 G74 M75 E80 H81 L82 A210 I214	I60-F78 HydrophobicContact CD1-CD1 4.18Å; I60-F78 HydrophobicContact CD1-CE1 3.9Å; I60-F78 HydrophobicContact CG2-CD1 4.45Å; G74-F78 WeakPolarHBondContact O-CB 3.49Å; G74-F78 PolarHBondContact O-N 3.27Å; M75-F78 PolarHBondContact O-N 2.96Å; F78-E80 PolarHBondContact O-N 3.48Å; F78-H81 PolarHBondContact O-N 2.93Å; F78-L82 HydrophobicContact CE1-CD2 4.25Å; F78-L82 PolarHBondContact O-N 3.31Å; F78-A210 HydrophobicContact CD2-CB 3.88Å; F78-A210 WeakPolarHBondContact CD2-O 3.45Å; F78-A210 HydrophobicContact CE2-CB 4.04Å; F78-I214 HydrophobicContact CD2-CB 4.36Å; F78-I214 HydrophobicContact CD2-CG2 4.34Å
79	A	98.7	Very high	98.3	Very high	6 Å²	6	52.6 Å²	52.6	5%	0.05	25%	0.253	C	S	.	.	H	α-helix	trans	-62	-42.1	177.9	0	0	0	0	0	112.2	V57 I60 M75 K76 Q77 H81 L82 A83	V57-A79 HydrophobicContact CG1-CB 4.39Å; I60-A79 HydrophobicContact CB-CB 4.28Å; I60-A79 HydrophobicContact CG2-CB 3.88Å; M75-A79 WeakPolarHBondContact O-CB 3.4Å; M75-A79 PolarHBondContact O-N 3.4Å; K76-A79 PolarHBondContact O-N 3.28Å; Q77-A79 VanDerWaalsContact C-N 3.33Å; Q77-A79 PolarHBondContact O-N 3.22Å; A79-H81 PolarHBondContact O-N 3.31Å; A79-L82 PolarHBondContact O-N 2.86Å; A79-A83 WeakPolarHBondContact O-CB 3.42Å; A79-A83 PolarHBondContact O-N 2.63Å
80	E	98.6	Very high	98.5	Very high	131 Å²	131	51.7 Å²	51.7	61%	0.612	24%	0.242	S	C	*	.	H	α-helix	trans	-60.1	-43.2	175.1	-73.2	172.1	-174.3	0	0	112	K76 Q77 F78 A83 K84	K76-E80 WeakPolarHBondContact O-CG 3.32Å; K76-E80 PolarHBondContact O-N 3.1Å; Q77-E80 WeakPolarHBondContact O-CB 3.38Å; Q77-E80 PolarHBondContact O-N 3.46Å; F78-E80 PolarHBondContact O-N 3.48Å; E80-A83 PolarHBondContact O-N 3.26Å; E80-K84 PolarHBondContact O-N 3.38Å
81	H	98.7	Very high	98.6	Very high	48 Å²	48	51.3 Å²	51.3	22%	0.222	24%	0.243	C	C	.	.	H	α-helix	trans	-65.2	-40.9	175.4	-70.8	-65.4	0	0	0	112	Q77 F78 A79 K84 I85 I206 V209 A210 S213	Q77-H81 PolarHBondContact O-CD2 3.04Å; Q77-H81 PolarHBondContact O-N 3.48Å; F78-H81 PolarHBondContact O-N 2.93Å; A79-H81 PolarHBondContact O-N 3.31Å; H81-K84 WeakPolarHBondContact O-CB 3.49Å; H81-K84 PolarHBondContact O-N 3.44Å; H81-I85 WeakPolarHBondContact O-CG1 3.35Å; H81-I85 PolarHBondContact O-N 2.69Å; H81-I206 HydrophobicContact CB-CG2 3.94Å; H81-I206 WeakPolarHBondContact O-CG2 3.39Å; H81-V209 WeakPolarHBondContact CE1-CG1 3.31Å; H81-A210 HydrophobicContact CB-CB 3.67Å; H81-S213 PolarHBondContact CD2-OG 2.79Å; H81-S213 PolarHBondContact NE2-OG 3.07Å
82	L	98.4	Very high	98.6	Very high	19 Å²	19	49.4 Å²	49.4	10%	0.099	23%	0.233	C	C	.	.	H	α-helix	trans	-66.1	-37.4	177.5	-176.6	63.6	0	0	0	112.2	V57 I60 F78 A79 I85 Q86 Y207	V57-L82 HydrophobicContact CG2-CB 3.91Å; V57-L82 HydrophobicContact CG2-CD2 3.85Å; V57-L82 HydrophobicContact CG2-CG 3.72Å; I60-L82 HydrophobicContact CD1-CD2 4.2Å; F78-L82 HydrophobicContact CE1-CD2 4.25Å; F78-L82 PolarHBondContact O-N 3.31Å; A79-L82 PolarHBondContact O-N 2.86Å; L82-I85 WeakPolarHBondContact O-CB 3.28Å; L82-I85 PolarHBondContact O-N 3.15Å; L82-Q86 PolarHBondContact O-N 3.21Å; L82-Q86 PolarHBondContact O-NE2 2.92Å; L82-Y207 HydrophobicContact CD1-CE1 4Å
83	A	98.8	Very high	98.6	Very high	30 Å²	30	46.5 Å²	46.5	25%	0.248	22%	0.221	C	C	.	.	H	α-helix	trans	-60.9	-45.5	172.7	0	0	0	0	0	111.1	V57 A79 E80 I85 Q86 D87	V57-A83 HydrophobicContact CG1-CB 3.86Å; V57-A83 HydrophobicContact CG2-CB 4.13Å; A79-A83 WeakPolarHBondContact O-CB 3.42Å; A79-A83 PolarHBondContact O-N 2.63Å; E80-A83 PolarHBondContact O-N 3.26Å; A83-I85 PolarHBondContact O-N 3.43Å; A83-Q86 WeakPolarHBondContact O-CA 3.49Å; A83-Q86 VanDerWaalsContact O-CB 3.27Å; A83-Q86 WeakPolarHBondContact O-CB 3.33Å; A83-Q86 PolarHBondContact O-N 2.86Å; A83-D87 PolarHBondContact O-N 3.34Å
84	K	98.8	Very high	98.7	Very high	95 Å²	95	46.1 Å²	46.1	41%	0.413	22%	0.224	S	C	.	.	H	α-helix	trans	-59.5	-34	177.5	-170.3	179.4	-179	176.8	0	112.6	E80 H81 Q86 D87 Y88 I206	E80-K84 PolarHBondContact O-N 3.38Å; H81-K84 WeakPolarHBondContact O-CB 3.49Å; H81-K84 PolarHBondContact O-N 3.44Å; K84-Q86 VanDerWaalsContact C-N 3.26Å; K84-Q86 PolarHBondContact O-N 3.43Å; K84-D87 WeakPolarHBondContact O-CB 3.38Å; K84-D87 PolarHBondContact O-N 2.96Å; K84-Y88 HydrophobicContact CD-CE2 4.45Å; K84-Y88 HydrophobicContact CG-CD2 4.37Å; K84-Y88 HydrophobicContact CG-CE2 3.94Å; K84-Y88 WeakPolarHBondContact O-CD2 3.44Å; K84-Y88 PolarHBondContact O-N 3Å; K84-I206 HydrophobicContact CD-CD1 4.08Å; K84-I206 HydrophobicContact CG-CD1 4.07Å
85	I	98.8	Very high	98.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.3	-35.3	174.4	-65.3	169.7	0	0	0	110.6	H81 L82 A83 Y88 R89 F199 I206 Y207	H81-I85 WeakPolarHBondContact O-CG1 3.35Å; H81-I85 PolarHBondContact O-N 2.69Å; L82-I85 WeakPolarHBondContact O-CB 3.28Å; L82-I85 PolarHBondContact O-N 3.15Å; A83-I85 PolarHBondContact O-N 3.43Å; I85-Y88 PolarHBondContact O-N 3.32Å; I85-R89 PolarHBondContact O-N 3.19Å; I85-F199 HydrophobicContact CG2-CE2 4.3Å; I85-F199 HydrophobicContact CG2-CZ 4.21Å; I85-I206 HydrophobicContact CD1-CB 4.1Å; I85-I206 HydrophobicContact CD1-CG2 3.86Å; I85-I206 HydrophobicContact CG1-CB 3.8Å; I85-I206 HydrophobicContact CG1-CD1 4.21Å; I85-I206 HydrophobicContact CG1-CG2 3.58Å; I85-Y207 HydrophobicContact CD1-CD1 3.36Å; I85-Y207 HydrophobicContact CD1-CD2 3.79Å; I85-Y207 HydrophobicContact CD1-CE1 3.26Å; I85-Y207 HydrophobicContact CD1-CE2 3.7Å; I85-Y207 HydrophobicContact CD1-CG 3.61Å; I85-Y207 VanDerWaalsContact CD1-CZ 3.43Å; I85-Y207 HydrophobicContact CG2-CE2 4.25Å
86	Q	98.7	Very high	98.7	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.009	24%	0.238	C	C	.	.	H	α-helix	trans	-68.1	-35.5	177.4	-58.3	-26.2	-58.2	0	0	112.3	R50 A53 D54 L82 A83 K84 Y88 R89 Q90	R50-Q86 HydrophobicContact CG-CB 3.64Å; R50-Q86 HydrophobicContact CG-CG 4.16Å; A53-Q86 HydrophobicContact CB-CG 3.8Å; D54-Q86 WeakPolarHBondContact OD1-CB 3.32Å; D54-Q86 VanDerWaalsContact OD1-CG 3.29Å; D54-Q86 WeakPolarHBondContact OD1-CG 3.47Å; L82-Q86 PolarHBondContact O-N 3.21Å; L82-Q86 PolarHBondContact O-NE2 2.92Å; A83-Q86 WeakPolarHBondContact O-CA 3.49Å; A83-Q86 VanDerWaalsContact O-CB 3.27Å; A83-Q86 WeakPolarHBondContact O-CB 3.33Å; A83-Q86 PolarHBondContact O-N 2.86Å; K84-Q86 VanDerWaalsContact C-N 3.26Å; K84-Q86 PolarHBondContact O-N 3.43Å; Q86-Y88 VanDerWaalsContact C-N 3.31Å; Q86-Y88 PolarHBondContact O-N 3.47Å; Q86-R89 CarbonylContact O-C 3.58Å; Q86-R89 WeakPolarHBondContact O-CB 3.45Å; Q86-R89 PolarHBondContact O-N 3.15Å; Q86-R89 VanDerWaalsContact O-N 3.11Å; Q86-Q90 PolarHBondContact O-N 2.96Å
87	D	98.6	Very high	98.7	Very high	116 Å²	116	52.4 Å²	52.4	62%	0.62	25%	0.249	S	C	*	.	H	α-helix	trans	-59.2	-42.8	171	-63	-32.2	0	0	0	111.7	A83 K84 R89 Q90 A91	A83-D87 PolarHBondContact O-N 3.34Å; K84-D87 WeakPolarHBondContact O-CB 3.38Å; K84-D87 PolarHBondContact O-N 2.96Å; D87-R89 VanDerWaalsContact C-N 3.33Å; D87-Q90 PolarHBondContact O-N 3.22Å; D87-A91 PolarHBondContact O-N 3.34Å; D87-A91 VanDerWaalsContact O-N 3.1Å
88	Y	98.7	Very high	98.7	Very high	80 Å²	80	52.3 Å²	52.3	31%	0.314	26%	0.26	S	S	.	.	H	α-helix	trans	-68.5	-32.7	175.5	-73.6	-71.5	0	0	0	112.5	K84 I85 Q86 A91 E92 K202 I206	K84-Y88 HydrophobicContact CD-CE2 4.45Å; K84-Y88 HydrophobicContact CG-CD2 4.37Å; K84-Y88 HydrophobicContact CG-CE2 3.94Å; K84-Y88 WeakPolarHBondContact O-CD2 3.44Å; K84-Y88 PolarHBondContact O-N 3Å; I85-Y88 PolarHBondContact O-N 3.32Å; Q86-Y88 VanDerWaalsContact C-N 3.31Å; Q86-Y88 PolarHBondContact O-N 3.47Å; Y88-A91 PolarHBondContact O-N 2.96Å; Y88-E92 PolarHBondContact O-N 3.36Å; Y88-K202 HydrophobicContact CD1-CB 4.24Å; Y88-K202 HydrophobicContact CD1-CG 4.23Å; Y88-K202 HydrophobicContact CD2-CB 4.44Å; Y88-K202 HydrophobicContact CE1-CB 4.45Å; Y88-K202 HydrophobicContact CE1-CG 4.08Å; Y88-K202 HydrophobicContact CG-CB 4.25Å; Y88-I206 HydrophobicContact CD2-CD1 3.52Å; Y88-I206 HydrophobicContact CE2-CD1 3.38Å
89	R	98.8	Very high	98.7	Very high	25 Å²	25	55.4 Å²	55.4	9%	0.094	27%	0.27	C	S	.	.	H	α-helix	trans	-69.3	-37.6	174.3	-173.3	167.5	-76.9	131.2	-9.1	112	T46 R50 I85 Q86 D87 A91 E92 V93 F199	T46-R89 HydrophobicContact CG2-CG 3.71Å; R50-R89 HydrophobicContact CB-CB 4.47Å; R50-R89 HydrophobicContact CB-CG 4.07Å; R50-R89 HydrophobicContact CG-CB 4.49Å; I85-R89 PolarHBondContact O-N 3.19Å; Q86-R89 CarbonylContact O-C 3.58Å; Q86-R89 WeakPolarHBondContact O-CB 3.45Å; Q86-R89 PolarHBondContact O-N 3.15Å; Q86-R89 VanDerWaalsContact O-N 3.11Å; D87-R89 VanDerWaalsContact C-N 3.33Å; R89-A91 VanDerWaalsContact C-N 3.34Å; R89-E92 WeakPolarHBondContact O-CB 3.35Å; R89-E92 PolarHBondContact O-N 3.17Å; R89-V93 WeakPolarHBondContact O-CG2 3.44Å; R89-V93 PolarHBondContact O-N 2.7Å; R89-F199 HydrophobicContact CB-CD2 4.5Å; R89-F199 HydrophobicContact CB-CE2 3.79Å; R89-F199 HydrophobicContact CB-CZ 4.31Å; R89-F199 HydrophobicContact CG-CE2 4.5Å; R89-F199 VanDerWaalsContact NH2-CZ 3.31Å
90	Q	98.7	Very high	98.7	Very high	62 Å²	62	55.1 Å²	55.1	29%	0.29	27%	0.268	S	S	.	.	H	α-helix	trans	-59.3	-46	169.6	173.7	61.3	56	0	0	110.7	Q86 D87 E92 V93 E94	Q86-Q90 PolarHBondContact O-N 2.96Å; D87-Q90 PolarHBondContact O-N 3.22Å; Q90-E92 VanDerWaalsContact C-N 3.3Å; Q90-E92 PolarHBondContact O-N 3.24Å; Q90-V93 PolarHBondContact O-N 3.25Å; Q90-E94 PolarHBondContact NE2-OE1 2.91Å; Q90-E94 WeakPolarHBondContact O-CG 3.5Å; Q90-E94 PolarHBondContact O-N 2.87Å
91	A	98.7	Very high	98.7	Very high	25 Å²	25	49.7 Å²	49.7	21%	0.207	24%	0.243	C	C	.	.	H	α-helix	trans	-64.8	-31.7	176.6	0	0	0	0	0	113.2	D87 Y88 R89 R95	D87-A91 PolarHBondContact O-N 3.34Å; D87-A91 VanDerWaalsContact O-N 3.1Å; Y88-A91 PolarHBondContact O-N 2.96Å; R89-A91 VanDerWaalsContact C-N 3.34Å; A91-R95 WeakPolarHBondContact O-CB 3.5Å; A91-R95 WeakPolarHBondContact O-CD 3.33Å; A91-R95 WeakPolarHBondContact O-CG 3.5Å; A91-R95 PolarHBondContact O-N 3.3Å
92	E	98.8	Very high	98.7	Very high	7 Å²	7	52.1 Å²	52.1	3%	0.033	25%	0.254	C	S	.	.	H	α-helix	trans	-62.8	-51.3	171	169.7	178.5	-119.6	0	0	111.1	Y88 R89 Q90 E94 R95 L96 V195 F199	Y88-E92 PolarHBondContact O-N 3.36Å; R89-E92 WeakPolarHBondContact O-CB 3.35Å; R89-E92 PolarHBondContact O-N 3.17Å; Q90-E92 VanDerWaalsContact C-N 3.3Å; Q90-E92 PolarHBondContact O-N 3.24Å; E92-E94 PolarHBondContact O-N 3.24Å; E92-R95 PolarHBondContact O-N 3.5Å; E92-R95 VanDerWaalsContact O-N 3.1Å; E92-L96 HydrophobicContact CG-CD1 4.07Å; E92-L96 HydrophobicContact CG-CG 4.44Å; E92-L96 WeakPolarHBondContact O-CG 3.37Å; E92-L96 PolarHBondContact O-N 2.96Å; E92-V195 HydrophobicContact CG-CG1 4.06Å; E92-F199 HydrophobicContact CB-CB 4.16Å; E92-F199 HydrophobicContact CB-CD2 4.26Å; E92-F199 HydrophobicContact CB-CG 4.29Å; E92-F199 VanDerWaalsContact CD-CG 3.44Å; E92-F199 HydrophobicContact CG-CB 4.24Å; E92-F199 HydrophobicContact CG-CG 4.41Å; E92-F199 WeakPolarHBondContact OE1-CB 3.17Å; E92-F199 WeakPolarHBondContact OE1-CD1 3.43Å; E92-F199 VanDerWaalsContact OE1-CG 3.23Å; E92-F199 WeakPolarHBondContact OE1-CG 3.38Å; E92-F199 WeakPolarHBondContact OE2-CD1 3.4Å; E92-F199 WeakPolarHBondContact OE2-CG 3.35Å
93	V	98.9	Very high	98.7	Very high	7 Å²	7	53 Å²	53	4%	0.042	26%	0.261	C	S	.	.	H	α-helix	trans	-55.1	-49.8	177.7	172.5	0	0	0	0	111.3	T46 A47 R89 Q90 R95 L96 E97	T46-V93 HydrophobicContact CG2-CG2 3.79Å; A47-V93 HydrophobicContact CB-CG1 4.37Å; A47-V93 HydrophobicContact CB-CG2 4.15Å; R89-V93 WeakPolarHBondContact O-CG2 3.44Å; R89-V93 PolarHBondContact O-N 2.7Å; Q90-V93 PolarHBondContact O-N 3.25Å; V93-R95 VanDerWaalsContact C-N 3.27Å; V93-R95 PolarHBondContact O-N 3.48Å; V93-L96 PolarHBondContact O-N 3.37Å; V93-E97 WeakPolarHBondContact O-CG 3.29Å; V93-E97 PolarHBondContact O-N 2.97Å
94	E	98.8	Very high	98.7	Very high	104 Å²	104	52 Å²	52	49%	0.486	25%	0.251	S	S	.	.	H	α-helix	trans	-59.6	-37.3	178.6	-72.7	170	-166.2	0	0	112.8	Q90 E92 A98	Q90-E94 PolarHBondContact NE2-OE1 2.91Å; Q90-E94 WeakPolarHBondContact O-CG 3.5Å; Q90-E94 PolarHBondContact O-N 2.87Å; E92-E94 PolarHBondContact O-N 3.24Å; E94-A98 WeakPolarHBondContact O-CB 3.2Å; E94-A98 PolarHBondContact O-N 3.46Å
95	R	98.8	Very high	98.7	Very high	110 Å²	110	53.7 Å²	53.7	42%	0.415	26%	0.259	S	S	.	.	H	α-helix	trans	-73.8	-38.3	178.5	-72	169.4	-172	177.5	4.6	111.8	A91 E92 V93 E97 A98 R99 V195	A91-R95 WeakPolarHBondContact O-CB 3.5Å; A91-R95 WeakPolarHBondContact O-CD 3.33Å; A91-R95 WeakPolarHBondContact O-CG 3.5Å; A91-R95 PolarHBondContact O-N 3.3Å; E92-R95 PolarHBondContact O-N 3.5Å; E92-R95 VanDerWaalsContact O-N 3.1Å; V93-R95 VanDerWaalsContact C-N 3.27Å; V93-R95 PolarHBondContact O-N 3.48Å; R95-E97 VanDerWaalsContact C-N 3.32Å; R95-A98 PolarHBondContact O-N 3.22Å; R95-R99 WeakPolarHBondContact O-CB 3.22Å; R95-R99 WeakPolarHBondContact O-CG 3.35Å; R95-R99 PolarHBondContact O-N 3.06Å; R95-V195 HydrophobicContact CB-CG1 3.9Å; R95-V195 HydrophobicContact CB-CG2 3.72Å
96	L	98.9	Very high	98.6	Very high	2 Å²	2	56.4 Å²	56.4	1%	0.01	28%	0.278	C	S	.	.	H	α-helix	trans	-59.5	-45.7	173.1	-69.9	172.9	0	0	0	110.3	Y42 A43 E92 V93 V100 I101 F192 V195	Y42-L96 HydrophobicContact CD1-CD1 3.98Å; Y42-L96 HydrophobicContact CE1-CD1 3.86Å; A43-L96 HydrophobicContact CB-CB 4.31Å; A43-L96 HydrophobicContact CB-CD1 4.41Å; E92-L96 HydrophobicContact CG-CD1 4.07Å; E92-L96 HydrophobicContact CG-CG 4.44Å; E92-L96 WeakPolarHBondContact O-CG 3.37Å; E92-L96 PolarHBondContact O-N 2.96Å; V93-L96 PolarHBondContact O-N 3.37Å; L96-V100 HydrophobicContact CD2-CG2 4.25Å; L96-V100 WeakPolarHBondContact O-CA 3.29Å; L96-V100 VanDerWaalsContact O-CB 3.28Å; L96-V100 WeakPolarHBondContact O-CB 3.35Å; L96-V100 PolarHBondContact O-N 3.43Å; L96-I101 PolarHBondContact O-N 3.27Å; L96-F192 HydrophobicContact CD2-CD2 3.58Å; L96-F192 HydrophobicContact CD2-CE2 3.92Å; L96-V195 HydrophobicContact CD2-CB 4.39Å; L96-V195 HydrophobicContact CD2-CG1 3.94Å; L96-V195 HydrophobicContact CG-CG1 3.98Å
97	E	98.7	Very high	98.6	Very high	104 Å²	104	56.8 Å²	56.8	49%	0.486	28%	0.279	S	S	.	.	I	π-helix	trans	-57.9	-54.5	174.9	-72.2	-175.7	169.1	0	0	112.2	V93 R95 I101 E102	V93-E97 WeakPolarHBondContact O-CG 3.29Å; V93-E97 PolarHBondContact O-N 2.97Å; R95-E97 VanDerWaalsContact C-N 3.32Å; E97-I101 HydrophobicContact CG-CD1 4.05Å; E97-I101 PolarHBondContact O-N 2.98Å; E97-E102 WeakPolarHBondContact O-CB 3.48Å; E97-E102 PolarHBondContact O-N 3.45Å
98	A	98.7	Very high	98.5	Very high	67 Å²	67	53.3 Å²	53.3	55%	0.554	27%	0.271	S	S	*	.	I	π-helix	trans	-72.1	-34.6	-173.3	0	0	0	0	0	114	E94 R95	E94-A98 WeakPolarHBondContact O-CB 3.2Å; E94-A98 PolarHBondContact O-N 3.46Å; R95-A98 PolarHBondContact O-N 3.22Å
99	R	98.6	Very high	98.4	Very high	123 Å²	123	52.1 Å²	52.1	46%	0.464	28%	0.278	S	S	.	.	I	π-helix	trans	-106.9	-17.3	-168.1	-55.8	-165.7	175.7	-153.5	-1.8	114.7	R95 E191	R95-R99 WeakPolarHBondContact O-CB 3.22Å; R95-R99 WeakPolarHBondContact O-CG 3.35Å; R95-R99 PolarHBondContact O-N 3.06Å; R99-E191 HydrophobicContact CB-CB 4.04Å; R99-E191 HydrophobicContact CB-CG 4.34Å; R99-E191 WeakPolarHBondContact CD-OE2 3.26Å; R99-E191 IonicContact CZ-OE2 2.69Å; R99-E191 IonicContact NE-OE2 2.61Å; R99-E191 IonicContact NH1-OE1 3.82Å; R99-E191 IonicContact NH1-OE2 3.67Å; R99-E191 PolarHBondContact NH1-OE2 3.41Å
100	V	98.8	Very high	98.3	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.284	C	S	.	.	I	π-helix	trans	-117.6	-56.1	-178.3	-175	0	0	0	0	110	F39 L96 P103 L104 V188 F192	F39-V100 HydrophobicContact CB-CG1 4.22Å; F39-V100 HydrophobicContact CD1-CG1 3.84Å; F39-V100 HydrophobicContact CD2-CG1 3.77Å; F39-V100 HydrophobicContact CE1-CG1 4.1Å; F39-V100 HydrophobicContact CE2-CG1 4.05Å; F39-V100 HydrophobicContact CG-CG1 3.68Å; F39-V100 HydrophobicContact CZ-CG1 4.2Å; L96-V100 HydrophobicContact CD2-CG2 4.25Å; L96-V100 WeakPolarHBondContact O-CA 3.29Å; L96-V100 VanDerWaalsContact O-CB 3.28Å; L96-V100 WeakPolarHBondContact O-CB 3.35Å; L96-V100 PolarHBondContact O-N 3.43Å; V100-P103 WeakPolarHBondContact O-CD 3.34Å; V100-L104 HydrophobicContact CG1-CD1 4.45Å; V100-L104 WeakPolarHBondContact O-CG 3.48Å; V100-L104 PolarHBondContact O-N 3.01Å; V100-V188 HydrophobicContact CG1-CG1 3.83Å; V100-F192 HydrophobicContact CG2-CB 3.86Å; V100-F192 HydrophobicContact CG2-CD2 4.5Å
101	I	98.8	Very high	98.2	Very high	18 Å²	18	49.7 Å²	49.7	9%	0.092	27%	0.27	C	S	.	.	I	π-helix	trans	-72.4	-51.9	-171.9	-61.4	162	0	0	0	111.4	F39 A40 A43 L96 E97 L104 K105	F39-I101 HydrophobicContact CB-CG1 3.86Å; A40-I101 HydrophobicContact CB-CD1 4.23Å; A40-I101 HydrophobicContact CB-CG2 4.28Å; A43-I101 HydrophobicContact CB-CD1 3.81Å; L96-I101 PolarHBondContact O-N 3.27Å; E97-I101 HydrophobicContact CG-CD1 4.05Å; E97-I101 PolarHBondContact O-N 2.98Å; I101-L104 PolarHBondContact O-N 3.46Å; I101-L104 VanDerWaalsContact O-N 3.17Å; I101-K105 WeakPolarHBondContact O-CB 3.43Å; I101-K105 PolarHBondContact O-N 3.11Å
102	E	98.6	Very high	98.1	Very high	99 Å²	99	54.5 Å²	54.5	46%	0.463	29%	0.286	S	S	.	.	H	α-helix	trans	-61.9	-40.7	-176.4	-167.9	61.1	-153.8	0	0	113.2	E97 L104 K105 S106	E97-E102 WeakPolarHBondContact O-CB 3.48Å; E97-E102 PolarHBondContact O-N 3.45Å; E102-L104 PolarHBondContact O-N 3.34Å; E102-K105 PolarHBondContact O-N 3.37Å; E102-K105 WeakPolarHBondContact OE2-CD 3.49Å; E102-K105 IonicContact OE2-NZ 2.76Å; E102-S106 WeakPolarHBondContact O-CB 3.47Å; E102-S106 PolarHBondContact O-N 3.14Å
103	P	98.4	Very high	98	Very high	38 Å²	38	61.1 Å²	61.1	25%	0.247	31%	0.311	C	S	.	.	H	α-helix	trans	-57.7	-46.6	171.3	-28.5	37.6	0	0	0	113.5	V100 S106 Y107 V188	V100-P103 WeakPolarHBondContact O-CD 3.34Å; P103-S106 PolarHBondContact O-N 3.34Å; P103-S106 PolarHBondContact O-OG 2.9Å; P103-Y107 WeakPolarHBondContact O-CD2 3.45Å; P103-V188 HydrophobicContact CB-CG2 3.9Å
104	L	98.6	Very high	97.9	Very high	8 Å²	8	62.3 Å²	62.3	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-63.7	-42.8	177.7	-70.7	171.2	0	0	0	111.6	F32 M35 C36 F39 V100 I101 E102 S106 Y107 V188	F32-L104 HydrophobicContact CB-CD2 4.33Å; F32-L104 HydrophobicContact CD2-CD2 3.84Å; F32-L104 HydrophobicContact CE2-CD2 4.33Å; F32-L104 HydrophobicContact CG-CD2 4.08Å; M35-L104 HydrophobicContact CB-CD1 4.07Å; C36-L104 HydrophobicContact CB-CB 3.85Å; F39-L104 HydrophobicContact CD2-CD1 3.71Å; F39-L104 HydrophobicContact CE2-CD1 4.23Å; V100-L104 HydrophobicContact CG1-CD1 4.45Å; V100-L104 WeakPolarHBondContact O-CG 3.48Å; V100-L104 PolarHBondContact O-N 3.01Å; I101-L104 PolarHBondContact O-N 3.46Å; I101-L104 VanDerWaalsContact O-N 3.17Å; E102-L104 PolarHBondContact O-N 3.34Å; L104-S106 VanDerWaalsContact C-N 3.29Å; L104-S106 PolarHBondContact O-N 3.07Å; L104-Y107 WeakPolarHBondContact O-CB 3.15Å; L104-Y107 PolarHBondContact O-N 2.92Å; L104-V188 HydrophobicContact CD1-CG1 4.13Å; L104-V188 HydrophobicContact CD2-CG1 4.33Å; L104-V188 HydrophobicContact CG-CG1 4.1Å
105	K	98.1	Very high	97.8	Very high	130 Å²	130	61 Å²	61	57%	0.565	31%	0.306	S	S	*	.	H	α-helix	trans	-59.6	-39.9	176.8	-173	-179.4	175	-171.6	0	112.3	I101 E102 Y107 G108	I101-K105 WeakPolarHBondContact O-CB 3.43Å; I101-K105 PolarHBondContact O-N 3.11Å; E102-K105 PolarHBondContact O-N 3.37Å; E102-K105 WeakPolarHBondContact OE2-CD 3.49Å; E102-K105 IonicContact OE2-NZ 2.76Å; K105-Y107 PolarHBondContact O-N 2.85Å; K105-G108 PolarHBondContact O-N 2.96Å
106	S	97.4	Very high	97.7	Very high	58 Å²	58	60.7 Å²	60.7	41%	0.406	31%	0.309	S	S	.	.	H	α-helix	trans	-62.2	-23.7	-179.5	80.8	0	0	0	0	113.6	E102 P103 L104 G108 A109	E102-S106 WeakPolarHBondContact O-CB 3.47Å; E102-S106 PolarHBondContact O-N 3.14Å; P103-S106 PolarHBondContact O-N 3.34Å; P103-S106 PolarHBondContact O-OG 2.9Å; L104-S106 VanDerWaalsContact C-N 3.29Å; L104-S106 PolarHBondContact O-N 3.07Å; S106-G108 PolarHBondContact O-N 3.33Å; S106-A109 PolarHBondContact O-N 3Å
107	Y	97.5	Very high	97.6	Very high	10 Å²	10	63.8 Å²	63.8	4%	0.039	33%	0.326	C	S	.	.	H	α-helix	trans	-63.6	-23.8	179.1	-97.4	-104.7	0	0	0	113.3	V28 F32 P103 L104 K105 A109 V110 V111 F177 K181 D184	V28-Y107 HydrophobicContact CG1-CD1 3.92Å; V28-Y107 HydrophobicContact CG1-CE1 4.33Å; F32-Y107 AromaticContact CD2-CD1 3.59Å; F32-Y107 HydrophobicContact CD2-CD1 3.59Å; F32-Y107 AromaticContact CD2-CD2 3.85Å; F32-Y107 HydrophobicContact CD2-CD2 3.85Å; F32-Y107 HydrophobicContact CD2-CE1 4.06Å; F32-Y107 HydrophobicContact CD2-CE2 4.3Å; F32-Y107 AromaticContact CD2-CG 3.48Å; F32-Y107 HydrophobicContact CD2-CG 3.48Å; F32-Y107 VanDerWaalsContact CD2-CG 3.48Å; F32-Y107 AromaticContact CE2-CD1 3.65Å; F32-Y107 HydrophobicContact CE2-CD1 3.65Å; F32-Y107 AromaticContact CE2-CD2 3.92Å; F32-Y107 HydrophobicContact CE2-CD2 3.92Å; F32-Y107 AromaticContact CE2-CE1 3.6Å; F32-Y107 HydrophobicContact CE2-CE1 3.6Å; F32-Y107 AromaticContact CE2-CE2 3.89Å; F32-Y107 HydrophobicContact CE2-CE2 3.89Å; F32-Y107 AromaticContact CE2-CG 3.82Å; F32-Y107 HydrophobicContact CE2-CG 3.82Å; F32-Y107 AromaticContact CE2-CZ 3.74Å; F32-Y107 HydrophobicContact CZ-CE1 4.45Å; P103-Y107 WeakPolarHBondContact O-CD2 3.45Å; L104-Y107 WeakPolarHBondContact O-CB 3.15Å; L104-Y107 PolarHBondContact O-N 2.92Å; K105-Y107 PolarHBondContact O-N 2.85Å; Y107-A109 VanDerWaalsContact C-N 3.27Å; Y107-A109 PolarHBondContact O-N 3.46Å; Y107-V110 WeakPolarHBondContact O-CB 3.39Å; Y107-V110 PolarHBondContact O-N 2.86Å; Y107-V111 WeakPolarHBondContact O-CG2 3.25Å; Y107-V111 PolarHBondContact O-N 3.26Å; Y107-F177 HydrophobicContact CE1-CE2 4.19Å; Y107-K181 WeakPolarHBondContact OH-CA 3.45Å; Y107-D184 HydrophobicContact CE2-CB 4.04Å; Y107-D184 WeakPolarHBondContact CE2-OD2 3.4Å; Y107-D184 WeakPolarHBondContact OH-CB 3.43Å; Y107-D184 PolarHBondContact OH-OD2 3.48Å
108	G	96.5	Very high	97.5	Very high	43 Å²	43	59 Å²	59	44%	0.443	30%	0.304	S	S	.	.	H	α-helix	trans	-55.5	-42.4	175	0	0	0	0	0	112.5	K105 S106 K112	K105-G108 PolarHBondContact O-N 2.96Å; S106-G108 PolarHBondContact O-N 3.33Å; G108-K112 WeakPolarHBondContact O-CB 3.13Å; G108-K112 PolarHBondContact O-N 2.57Å; G108-K112 VanDerWaalsContact O-N 3.14Å
109	A	97.1	Very high	97.3	Very high	55 Å²	55	63.1 Å²	63.1	46%	0.455	31%	0.309	S	S	.	.	H	α-helix	trans	-73.9	-27.9	176.6	0	0	0	0	0	113.1	S106 Y107 R113	S106-A109 PolarHBondContact O-N 3Å; Y107-A109 VanDerWaalsContact C-N 3.27Å; Y107-A109 PolarHBondContact O-N 3.46Å; A109-R113 WeakPolarHBondContact O-CG 3.39Å; A109-R113 PolarHBondContact O-N 2.9Å; A109-R113 PolarHBondContact O-NE 3.44Å
110	V	96.1	Very high	97.2	Very high	36 Å²	36	59.8 Å²	59.8	22%	0.218	31%	0.308	C	S	.	.	H	α-helix	trans	-70.8	-52.2	176.9	179.7	0	0	0	0	110	Y107 K112 R113 K114 F177	Y107-V110 WeakPolarHBondContact O-CB 3.39Å; Y107-V110 PolarHBondContact O-N 2.86Å; V110-K112 VanDerWaalsContact C-N 3.33Å; V110-K112 PolarHBondContact O-N 3.13Å; V110-R113 PolarHBondContact O-N 3.35Å; V110-K114 WeakPolarHBondContact O-CG 3.22Å; V110-K114 PolarHBondContact O-N 3.42Å; V110-K114 VanDerWaalsContact O-N 3.08Å; V110-F177 HydrophobicContact CG1-CD2 3.87Å; V110-F177 HydrophobicContact CG1-CE2 3.84Å
111	V	97.4	Very high	97	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-58.4	-45.4	178.5	170.1	0	0	0	0	110.7	I25 V28 E29 Y107 R113 K114 R115	I25-V111 HydrophobicContact CG2-CB 4.41Å; I25-V111 HydrophobicContact CG2-CG1 3.42Å; I25-V111 VanDerWaalsContact CG2-CG1 3.42Å; V28-V111 HydrophobicContact CG1-CG2 4.05Å; E29-V111 HydrophobicContact CB-CB 4.48Å; E29-V111 HydrophobicContact CB-CG1 3.64Å; E29-V111 HydrophobicContact CB-CG2 4.34Å; E29-V111 HydrophobicContact CG-CG1 3.88Å; Y107-V111 WeakPolarHBondContact O-CG2 3.25Å; Y107-V111 PolarHBondContact O-N 3.26Å; V111-R113 VanDerWaalsContact C-N 3.35Å; V111-R113 PolarHBondContact O-N 2.98Å; V111-K114 PolarHBondContact O-N 3.01Å; V111-R115 PolarHBondContact O-N 3.48Å
112	K	97.4	Very high	96.8	Very high	125 Å²	125	61.4 Å²	61.4	54%	0.543	32%	0.315	S	S	.	.	H	α-helix	trans	-55.6	-48	177.7	-176.4	-179.3	176.6	-176.9	0	112.1	G108 V110 K114 R115 E116	G108-K112 WeakPolarHBondContact O-CB 3.13Å; G108-K112 PolarHBondContact O-N 2.57Å; G108-K112 VanDerWaalsContact O-N 3.14Å; V110-K112 VanDerWaalsContact C-N 3.33Å; V110-K112 PolarHBondContact O-N 3.13Å; K112-K114 PolarHBondContact O-N 3.49Å; K112-R115 WeakPolarHBondContact O-CB 3.43Å; K112-R115 PolarHBondContact O-N 3.16Å; K112-E116 VanDerWaalsContact CE-OE1 3.32Å; K112-E116 WeakPolarHBondContact CE-OE1 3.28Å; K112-E116 WeakPolarHBondContact O-CG 3.49Å; K112-E116 PolarHBondContact O-N 2.89Å; K112-E116 VanDerWaalsContact O-N 3.1Å
113	R	96.6	Very high	96.7	Very high	147 Å²	147	59.4 Å²	59.4	56%	0.555	31%	0.312	S	S	*	.	H	α-helix	trans	-60.8	-45	177.4	-77.5	-179	-81.8	177.5	-5.4	112	A109 V110 V111 R115 E116 D117	A109-R113 WeakPolarHBondContact O-CG 3.39Å; A109-R113 PolarHBondContact O-N 2.9Å; A109-R113 PolarHBondContact O-NE 3.44Å; V110-R113 PolarHBondContact O-N 3.35Å; V111-R113 VanDerWaalsContact C-N 3.35Å; V111-R113 PolarHBondContact O-N 2.98Å; R113-R115 VanDerWaalsContact C-N 3.29Å; R113-R115 PolarHBondContact O-N 3.19Å; R113-E116 WeakPolarHBondContact O-CB 3.3Å; R113-E116 PolarHBondContact O-N 3.32Å; R113-E116 VanDerWaalsContact O-N 3.11Å; R113-D117 PolarHBondContact O-N 2.92Å
114	K	97	Very high	96.5	Very high	32 Å²	32	57.9 Å²	57.9	14%	0.139	30%	0.303	C	S	.	.	H	α-helix	trans	-63.3	-34.5	178.2	-62.5	-64.1	169.4	177.9	0	113	I25 V110 V111 K112 D117 L118 T173 I174 F177	I25-K114 HydrophobicContact CD1-CB 3.8Å; I25-K114 HydrophobicContact CG1-CB 4.35Å; V110-K114 WeakPolarHBondContact O-CG 3.22Å; V110-K114 PolarHBondContact O-N 3.42Å; V110-K114 VanDerWaalsContact O-N 3.08Å; V111-K114 PolarHBondContact O-N 3.01Å; K112-K114 PolarHBondContact O-N 3.49Å; K114-D117 PolarHBondContact O-N 3.4Å; K114-L118 WeakPolarHBondContact O-CB 3.38Å; K114-L118 PolarHBondContact O-N 3.29Å; K114-T173 PolarHBondContact NZ-O 2.94Å; K114-I174 HydrophobicContact CD-CD1 4.39Å; K114-F177 HydrophobicContact CD-CB 4.26Å; K114-F177 HydrophobicContact CD-CG 4.45Å; K114-F177 HydrophobicContact CG-CD2 4.07Å; K114-F177 HydrophobicContact CG-CE2 4.48Å; K114-F177 HydrophobicContact CG-CG 4.27Å
115	R	96.8	Very high	96.2	Very high	77 Å²	77	58.5 Å²	58.5	29%	0.291	30%	0.304	S	S	.	.	H	α-helix	trans	-65.7	-40.1	173.4	-176	-179.6	-71.8	136.1	2.9	111.9	E29 V111 K112 R113 K119	E29-R115 VanDerWaalsContact CD-NH2 3.32Å; E29-R115 IonicContact OE1-CZ 3.51Å; E29-R115 IonicContact OE1-NH1 3.47Å; E29-R115 PolarHBondContact OE1-NH1 3.17Å; E29-R115 IonicContact OE1-NH2 3.52Å; E29-R115 PolarHBondContact OE1-NH2 3.35Å; E29-R115 IonicContact OE2-CZ 3.04Å; E29-R115 IonicContact OE2-NH1 3.67Å; E29-R115 IonicContact OE2-NH2 2.86Å; E29-R115 PolarHBondContact OE2-NH2 2.61Å; V111-R115 PolarHBondContact O-N 3.48Å; K112-R115 WeakPolarHBondContact O-CB 3.43Å; K112-R115 PolarHBondContact O-N 3.16Å; R113-R115 VanDerWaalsContact C-N 3.29Å; R113-R115 PolarHBondContact O-N 3.19Å; R115-K119 WeakPolarHBondContact O-CB 3.5Å; R115-K119 PolarHBondContact O-N 3.42Å
116	E	96.4	Very high	96	Very high	103 Å²	103	55.7 Å²	55.7	48%	0.481	30%	0.296	S	S	.	.	H	α-helix	trans	-64.1	-45.7	175.4	-70	168.9	-176.3	0	0	111.4	K112 R113 L118 K119 A120	K112-E116 VanDerWaalsContact CE-OE1 3.32Å; K112-E116 WeakPolarHBondContact CE-OE1 3.28Å; K112-E116 WeakPolarHBondContact O-CG 3.49Å; K112-E116 PolarHBondContact O-N 2.89Å; K112-E116 VanDerWaalsContact O-N 3.1Å; R113-E116 WeakPolarHBondContact O-CB 3.3Å; R113-E116 PolarHBondContact O-N 3.32Å; R113-E116 VanDerWaalsContact O-N 3.11Å; E116-L118 PolarHBondContact O-N 2.87Å; E116-K119 PolarHBondContact O-N 2.9Å; E116-A120 WeakPolarHBondContact O-CB 3.47Å; E116-A120 PolarHBondContact O-N 3.39Å
117	D	95.6	Very high	95.9	Very high	67 Å²	67	60 Å²	60	36%	0.358	30%	0.303	S	S	.	.	H	α-helix	trans	-59.8	-43.6	176.2	-66.9	-24.4	0	0	0	112.1	R113 K114 A120 T121 L170	R113-D117 PolarHBondContact O-N 2.92Å; K114-D117 PolarHBondContact O-N 3.4Å; D117-A120 PolarHBondContact O-N 2.99Å; D117-T121 PolarHBondContact O-N 3.43Å; D117-T121 PolarHBondContact O-OG1 3.49Å; D117-L170 HydrophobicContact CB-CD1 4.3Å
118	L	96.4	Very high	95.8	Very high	4 Å²	4	60.6 Å²	60.6	2%	0.021	31%	0.306	C	S	.	.	H	α-helix	trans	-63.6	-44.6	177	-175.3	63.3	0	0	0	111.5	T18 I21 Q22 I25 K114 E116 T121 Q122 L170	T18-L118 HydrophobicContact CG2-CD1 3.83Å; T18-L118 HydrophobicContact CG2-CG 4.32Å; I21-L118 HydrophobicContact CB-CD1 4.36Å; I21-L118 HydrophobicContact CG2-CD1 4.06Å; I21-L118 HydrophobicContact CG2-CD2 4.08Å; Q22-L118 HydrophobicContact CB-CD2 3.83Å; Q22-L118 HydrophobicContact CG-CD2 4.48Å; Q22-L118 VanDerWaalsContact OE1-CD2 3.32Å; I25-L118 HydrophobicContact CD1-CD2 4.28Å; K114-L118 WeakPolarHBondContact O-CB 3.38Å; K114-L118 PolarHBondContact O-N 3.29Å; E116-L118 PolarHBondContact O-N 2.87Å; L118-T121 PolarHBondContact O-N 3.21Å; L118-Q122 PolarHBondContact O-N 3.44Å; L118-L170 HydrophobicContact CB-CD1 4.34Å; L118-L170 HydrophobicContact CD1-CD1 4.26Å; L118-L170 HydrophobicContact CD1-CD2 3.52Å; L118-L170 HydrophobicContact CD1-CG 4.49Å
119	K	95.9	Very high	95.7	Very high	152 Å²	152	61.4 Å²	61.4	66%	0.661	31%	0.309	S	S	*	.	H	α-helix	trans	-64.2	-40.1	177.6	-175.1	178.5	-179.4	179.5	0	112.1	R115 E116 Q122 S123	R115-K119 WeakPolarHBondContact O-CB 3.5Å; R115-K119 PolarHBondContact O-N 3.42Å; E116-K119 PolarHBondContact O-N 2.9Å; K119-Q122 PolarHBondContact O-N 3.48Å; K119-S123 WeakPolarHBondContact O-CB 3.27Å; K119-S123 PolarHBondContact O-N 3.16Å; K119-S123 PolarHBondContact O-OG 3.32Å
120	A	95.9	Very high	95.5	Very high	54 Å²	54	66.2 Å²	66.2	45%	0.446	32%	0.319	S	S	.	.	H	α-helix	trans	-62.2	-45	175.6	0	0	0	0	0	111.1	E116 D117 S123 A124	E116-A120 WeakPolarHBondContact O-CB 3.47Å; E116-A120 PolarHBondContact O-N 3.39Å; D117-A120 PolarHBondContact O-N 2.99Å; A120-S123 PolarHBondContact O-N 3.49Å; A120-A124 PolarHBondContact O-N 2.99Å
121	T	95	Very high	95.5	Very high	6 Å²	6	66.5 Å²	66.5	4%	0.037	32%	0.318	C	S	.	.	H	α-helix	trans	-62.6	-44.5	176.9	-58.7	0	0	0	0	112	D117 L118 S123 A124 R125 T166 L170	D117-T121 PolarHBondContact O-N 3.43Å; D117-T121 PolarHBondContact O-OG1 3.49Å; L118-T121 PolarHBondContact O-N 3.21Å; T121-S123 VanDerWaalsContact C-N 3.32Å; T121-S123 PolarHBondContact O-N 3.1Å; T121-A124 PolarHBondContact O-N 3Å; T121-R125 WeakPolarHBondContact O-CG 3.44Å; T121-R125 PolarHBondContact O-N 2.89Å; T121-R125 VanDerWaalsContact O-N 3.08Å; T121-T166 PolarHBondContact OG1-O 3.13Å; T121-L170 HydrophobicContact CG2-CB 4.32Å; T121-L170 HydrophobicContact CG2-CD2 3.77Å
122	Q	94.4	Very high	95.3	Very high	46 Å²	46	70.9 Å²	70.9	22%	0.215	34%	0.34	C	S	.	.	H	α-helix	trans	-62.5	-41	176.4	-169.1	60.1	45	0	0	111.5	T18 L118 K119 A124 R125 D126	T18-Q122 PolarHBondContact OG1-OE1 2.86Å; L118-Q122 PolarHBondContact O-N 3.44Å; K119-Q122 PolarHBondContact O-N 3.48Å; Q122-A124 VanDerWaalsContact C-N 3.33Å; Q122-A124 PolarHBondContact O-N 3.18Å; Q122-R125 PolarHBondContact O-N 3.01Å; Q122-D126 PolarHBondContact NE2-OD1 2.76Å; Q122-D126 WeakPolarHBondContact O-CB 3.39Å; Q122-D126 PolarHBondContact O-N 3.01Å
123	S	95.7	Very high	95.1	Very high	57 Å²	57	67.1 Å²	67.1	40%	0.399	33%	0.332	S	S	.	.	H	α-helix	trans	-63.5	-37.3	177.7	-58.7	0	0	0	0	112.7	K119 A120 T121 R127	K119-S123 WeakPolarHBondContact O-CB 3.27Å; K119-S123 PolarHBondContact O-N 3.16Å; K119-S123 PolarHBondContact O-OG 3.32Å; A120-S123 PolarHBondContact O-N 3.49Å; T121-S123 VanDerWaalsContact C-N 3.32Å; T121-S123 PolarHBondContact O-N 3.1Å; S123-R127 WeakPolarHBondContact O-CB 3.32Å; S123-R127 PolarHBondContact O-N 3.02Å; S123-R127 VanDerWaalsContact O-N 3.11Å
124	A	95.6	Very high	95	Very high	5 Å²	5	64.6 Å²	64.6	4%	0.041	33%	0.327	C	S	.	.	H	α-helix	trans	-66.2	-43.5	175	0	0	0	0	0	111.6	A120 T121 Q122 R127 E128 A163 T166	A120-A124 PolarHBondContact O-N 2.99Å; T121-A124 PolarHBondContact O-N 3Å; Q122-A124 VanDerWaalsContact C-N 3.33Å; Q122-A124 PolarHBondContact O-N 3.18Å; A124-R127 PolarHBondContact O-N 2.77Å; A124-E128 PolarHBondContact O-N 2.96Å; A124-A163 HydrophobicContact CB-CB 4.37Å; A124-T166 HydrophobicContact CB-CG2 4.48Å
125	R	92.2	Very high	94.8	Very high	21 Å²	21	63.5 Å²	63.5	8%	0.079	32%	0.322	C	S	.	.	H	α-helix	trans	-64	-42.6	175.6	-70.3	177.2	179.1	177	-0.7	112.6	T18 T121 Q122 R127 E128 A129 A163 T167	T18-R125 PolarHBondContact OG1-NH1 3.4Å; T121-R125 WeakPolarHBondContact O-CG 3.44Å; T121-R125 PolarHBondContact O-N 2.89Å; T121-R125 VanDerWaalsContact O-N 3.08Å; Q122-R125 PolarHBondContact O-N 3.01Å; R125-R127 VanDerWaalsContact C-N 3.26Å; R125-R127 PolarHBondContact O-N 3.46Å; R125-E128 WeakPolarHBondContact O-CB 3.36Å; R125-E128 PolarHBondContact O-N 3.41Å; R125-A129 PolarHBondContact O-N 3.32Å; R125-A163 HydrophobicContact CG-CB 4.35Å; R125-T167 PolarHBondContact NE-OG1 3.12Å; R125-T167 PolarHBondContact NH2-OG1 3.17Å
126	D	93.8	Very high	94.6	Very high	71 Å²	71	65.2 Å²	65.2	38%	0.38	33%	0.334	S	S	.	.	H	α-helix	trans	-63.6	-35.6	176.9	-68.8	-10.2	0	0	0	111.4	Q122 K130	Q122-D126 PolarHBondContact NE2-OD1 2.76Å; Q122-D126 WeakPolarHBondContact O-CB 3.39Å; Q122-D126 PolarHBondContact O-N 3.01Å; D126-K130 WeakPolarHBondContact O-CB 3.19Å; D126-K130 VanDerWaalsContact O-CG 3.24Å; D126-K130 WeakPolarHBondContact O-CG 3.46Å; D126-K130 PolarHBondContact O-N 3.37Å
127	R	95.3	Very high	94.5	Very high	148 Å²	148	66.5 Å²	66.5	56%	0.558	34%	0.337	S	S	*	.	H	α-helix	trans	-67.6	-42.9	174.3	-178.5	176.8	-80.3	123	-4.1	111.5	S123 A124 R125 K130 Q131 A159	S123-R127 WeakPolarHBondContact O-CB 3.32Å; S123-R127 PolarHBondContact O-N 3.02Å; S123-R127 VanDerWaalsContact O-N 3.11Å; A124-R127 PolarHBondContact O-N 2.77Å; R125-R127 VanDerWaalsContact C-N 3.26Å; R125-R127 PolarHBondContact O-N 3.46Å; R127-K130 PolarHBondContact O-N 3.14Å; R127-Q131 WeakPolarHBondContact O-CG 3.3Å; R127-Q131 PolarHBondContact O-N 3.35Å; R127-A159 HydrophobicContact CG-CB 4.47Å
128	E	95.2	Very high	94.3	Very high	23 Å²	23	64 Å²	64	11%	0.107	33%	0.325	C	S	.	.	H	α-helix	trans	-57.6	-50.3	173.4	177.7	-177.4	-151.1	0	0	111.3	A124 R125 K130 Q131 M132 L156 A159 T160 A163	A124-E128 PolarHBondContact O-N 2.96Å; R125-E128 WeakPolarHBondContact O-CB 3.36Å; R125-E128 PolarHBondContact O-N 3.41Å; E128-K130 VanDerWaalsContact C-N 3.32Å; E128-K130 PolarHBondContact O-N 3.38Å; E128-Q131 PolarHBondContact O-N 3.24Å; E128-Q131 VanDerWaalsContact O-N 3.15Å; E128-M132 PolarHBondContact O-N 3.38Å; E128-L156 HydrophobicContact CG-CD1 4.38Å; E128-A159 HydrophobicContact CB-CB 4.36Å; E128-T160 WeakPolarHBondContact OE1-CA 3.42Å; E128-T160 VanDerWaalsContact OE1-CB 3.24Å; E128-T160 WeakPolarHBondContact OE1-CB 3.48Å; E128-T160 VanDerWaalsContact OE1-CG2 3.28Å; E128-T160 WeakPolarHBondContact OE1-CG2 3.37Å; E128-T160 PolarHBondContact OE1-OG1 3.33Å; E128-A163 HydrophobicContact CB-CB 4.1Å; E128-A163 WeakPolarHBondContact OE2-CB 3.39Å
129	A	93.1	Very high	94.1	Very high	60 Å²	60	69.5 Å²	69.5	50%	0.496	35%	0.345	S	S	.	.	H	α-helix	trans	-59.9	-40.9	179.5	0	0	0	0	0	112.4	R125 M132 A133	R125-A129 PolarHBondContact O-N 3.32Å; A129-M132 PolarHBondContact O-N 3.05Å; A129-A133 PolarHBondContact O-N 3.1Å
130	K	94.5	Very high	93.9	Very high	156 Å²	156	69.4 Å²	69.4	68%	0.678	35%	0.351	S	S	*	.	H	α-helix	trans	-63.6	-43.1	175.1	-75	171.5	-174.8	175.5	0	112.1	D126 R127 E128 M132 A133 Q134	D126-K130 WeakPolarHBondContact O-CB 3.19Å; D126-K130 VanDerWaalsContact O-CG 3.24Å; D126-K130 WeakPolarHBondContact O-CG 3.46Å; D126-K130 PolarHBondContact O-N 3.37Å; R127-K130 PolarHBondContact O-N 3.14Å; E128-K130 VanDerWaalsContact C-N 3.32Å; E128-K130 PolarHBondContact O-N 3.38Å; K130-M132 VanDerWaalsContact C-N 3.32Å; K130-A133 PolarHBondContact O-N 3.18Å; K130-Q134 WeakPolarHBondContact O-CB 3.5Å; K130-Q134 PolarHBondContact O-N 3.44Å
131	Q	95.1	Very high	93.7	Very high	43 Å²	43	76.1 Å²	76.1	20%	0.201	37%	0.365	C	S	.	.	H	α-helix	trans	-67.1	-34.9	178.1	-70.9	-66.4	9.4	0	0	112	R127 E128 Q134 L135 E155 L156 A159	R127-Q131 WeakPolarHBondContact O-CG 3.3Å; R127-Q131 PolarHBondContact O-N 3.35Å; E128-Q131 PolarHBondContact O-N 3.24Å; E128-Q131 VanDerWaalsContact O-N 3.15Å; Q131-Q134 PolarHBondContact O-N 2.82Å; Q131-L135 WeakPolarHBondContact O-CB 3.43Å; Q131-L135 PolarHBondContact O-N 3.2Å; Q131-E155 PolarHBondContact NE2-OE2 3.25Å; Q131-L156 HydrophobicContact CB-CB 4.3Å; Q131-L156 HydrophobicContact CB-CD1 3.96Å; Q131-A159 HydrophobicContact CB-CB 4.44Å; Q131-A159 HydrophobicContact CG-CB 4.18Å
132	M	94.1	Very high	93.4	Very high	91 Å²	91	79.1 Å²	79.1	45%	0.448	38%	0.381	S	S	.	.	H	α-helix	trans	-63.9	-49.7	175	-170.9	178.7	-69.1	0	0	111.3	E128 A129 K130 Q134 L135 E136 L156	E128-M132 PolarHBondContact O-N 3.38Å; A129-M132 PolarHBondContact O-N 3.05Å; K130-M132 VanDerWaalsContact C-N 3.32Å; M132-Q134 VanDerWaalsContact C-N 3.3Å; M132-Q134 PolarHBondContact O-N 3.29Å; M132-L135 PolarHBondContact O-N 2.86Å; M132-E136 PolarHBondContact O-N 2.88Å; M132-E136 VanDerWaalsContact O-N 3.1Å; M132-L156 HydrophobicContact CB-CD1 3.98Å; M132-L156 HydrophobicContact CB-CD2 4.47Å
133	A	93.5	Very high	93.1	Very high	46 Å²	46	81.3 Å²	81.3	38%	0.38	40%	0.399	S	S	.	.	H	α-helix	trans	-62.1	-37.1	176.5	0	0	0	0	0	112.5	A129 K130 E136 K137	A129-A133 PolarHBondContact O-N 3.1Å; K130-A133 PolarHBondContact O-N 3.18Å; A133-E136 PolarHBondContact O-N 2.96Å; A133-K137 WeakPolarHBondContact O-CB 3.37Å; A133-K137 PolarHBondContact O-N 3.36Å
134	Q	93.5	Very high	92.9	Very high	94 Å²	94	84.2 Å²	84.2	44%	0.439	42%	0.419	S	S	.	.	H	α-helix	trans	-67	-39.9	177	-178.7	59.6	19.8	0	0	112.1	K130 Q131 M132 K137 T138	K130-Q134 WeakPolarHBondContact O-CB 3.5Å; K130-Q134 PolarHBondContact O-N 3.44Å; Q131-Q134 PolarHBondContact O-N 2.82Å; M132-Q134 VanDerWaalsContact C-N 3.3Å; M132-Q134 PolarHBondContact O-N 3.29Å; Q134-K137 PolarHBondContact O-N 3.4Å; Q134-T138 WeakPolarHBondContact O-CB 3.46Å; Q134-T138 PolarHBondContact O-N 2.98Å; Q134-T138 PolarHBondContact O-OG1 3.27Å
135	L	93.3	Very high	92.8	Very high	10 Å²	10	86.8 Å²	86.8	5%	0.052	43%	0.432	C	S	.	.	H	α-helix	trans	-62.7	-46	174.8	176.4	61.7	0	0	0	111.5	Q131 M132 K137 T138 R139 I149 A152 E153 L156	Q131-L135 WeakPolarHBondContact O-CB 3.43Å; Q131-L135 PolarHBondContact O-N 3.2Å; M132-L135 PolarHBondContact O-N 2.86Å; L135-K137 PolarHBondContact O-N 3.03Å; L135-T138 PolarHBondContact O-N 3.02Å; L135-R139 HydrophobicContact CD1-CG 4.35Å; L135-R139 WeakPolarHBondContact O-CG 3.25Å; L135-R139 PolarHBondContact O-N 3.34Å; L135-I149 HydrophobicContact CD1-CG2 4.24Å; L135-A152 HydrophobicContact CB-CB 4.49Å; L135-A152 HydrophobicContact CD1-CB 3.77Å; L135-E153 HydrophobicContact CD1-CG 3.7Å; L135-E153 HydrophobicContact CD2-CG 3.86Å; L135-E153 HydrophobicContact CG-CG 4.46Å; L135-L156 HydrophobicContact CB-CD2 4.49Å; L135-L156 HydrophobicContact CD2-CD2 3.52Å
136	E	92.9	Very high	92.8	Very high	113 Å²	113	95.5 Å²	95.5	53%	0.528	47%	0.465	S	S	.	.	H	α-helix	trans	-59.3	-46.5	176.4	-73.1	-172.9	162.8	0	0	111.9	M132 A133 T138 R139 L140	M132-E136 PolarHBondContact O-N 2.88Å; M132-E136 VanDerWaalsContact O-N 3.1Å; A133-E136 PolarHBondContact O-N 2.96Å; E136-T138 VanDerWaalsContact C-N 3.29Å; E136-T138 PolarHBondContact O-N 2.91Å; E136-R139 PolarHBondContact O-N 3.3Å; E136-L140 WeakPolarHBondContact O-CG 3.36Å; E136-L140 PolarHBondContact O-N 3.11Å
137	K	93.6	Very high	92.7	Very high	129 Å²	129	99.7 Å²	99.7	56%	0.561	48%	0.482	S	S	*	.	H	α-helix	trans	-60.8	-39.6	177.2	-172.2	178.3	-177.8	178.7	0	112.3	A133 Q134 L135 L140 R141	A133-K137 WeakPolarHBondContact O-CB 3.37Å; A133-K137 PolarHBondContact O-N 3.36Å; Q134-K137 PolarHBondContact O-N 3.4Å; L135-K137 PolarHBondContact O-N 3.03Å; K137-L140 PolarHBondContact O-N 3.32Å; K137-R141 WeakPolarHBondContact O-CB 3.34Å; K137-R141 PolarHBondContact O-N 2.94Å
138	T	92	Very high	92.6	Very high	15 Å²	15	96.1 Å²	96.1	9%	0.092	47%	0.474	C	S	.	.	H	α-helix	trans	-65.8	-44.8	178.3	-58.4	0	0	0	0	111	Q134 L135 E136 L140 R141 N142 I148 I149	Q134-T138 WeakPolarHBondContact O-CB 3.46Å; Q134-T138 PolarHBondContact O-N 2.98Å; Q134-T138 PolarHBondContact O-OG1 3.27Å; L135-T138 PolarHBondContact O-N 3.02Å; E136-T138 VanDerWaalsContact C-N 3.29Å; E136-T138 PolarHBondContact O-N 2.91Å; T138-L140 VanDerWaalsContact C-N 3.33Å; T138-L140 PolarHBondContact O-N 3.37Å; T138-R141 PolarHBondContact O-N 3.49Å; T138-N142 PolarHBondContact O-N 2.95Å; T138-I148 HydrophobicContact CG2-CG2 3.64Å; T138-I149 HydrophobicContact CG2-CG1 4.14Å
139	R	92.3	Very high	92.4	Very high	119 Å²	119	96 Å²	96	45%	0.449	47%	0.474	S	S	.	.	H	α-helix	trans	-60	-40.2	176.1	-75.1	175.8	171	176.5	-2.1	112.6	L135 E136 P143 I149 E153	L135-R139 HydrophobicContact CD1-CG 4.35Å; L135-R139 WeakPolarHBondContact O-CG 3.25Å; L135-R139 PolarHBondContact O-N 3.34Å; E136-R139 PolarHBondContact O-N 3.3Å; R139-P143 WeakPolarHBondContact O-CA 3.27Å; R139-I149 HydrophobicContact CG-CD1 4.37Å; R139-I149 HydrophobicContact CG-CG1 4.37Å; R139-I149 HydrophobicContact CG-CG2 4.21Å; R139-E153 IonicContact CZ-OE1 3.66Å; R139-E153 IonicContact NE-OE1 2.7Å; R139-E153 IonicContact NH2-OE1 2.7Å; R139-E153 PolarHBondContact NH2-OE1 3.28Å
140	L	91.6	Very high	92.5	Very high	150 Å²	150	96.8 Å²	96.8	79%	0.785	47%	0.473	S	S	*	.	H	α-helix	trans	-71.8	-39.1	178.7	-70.6	171.4	0	0	0	112.9	E136 K137 T138	E136-L140 WeakPolarHBondContact O-CG 3.36Å; E136-L140 PolarHBondContact O-N 3.11Å; K137-L140 PolarHBondContact O-N 3.32Å; T138-L140 VanDerWaalsContact C-N 3.33Å; T138-L140 PolarHBondContact O-N 3.37Å
141	R	91.9	Very high	92.4	Very high	195 Å²	195	94.8 Å²	94.8	74%	0.736	47%	0.466	S	S	*	.	H	α-helix	trans	-79.6	-42.4	-174.1	-169.7	176.1	173.2	-173.9	-1.4	112.7	K137 T138	K137-R141 WeakPolarHBondContact O-CB 3.34Å; K137-R141 PolarHBondContact O-N 2.94Å; T138-R141 PolarHBondContact O-N 3.49Å
142	N	88.4	Confident	92.3	Very high	70 Å²	70	93.2 Å²	93.2	37%	0.374	46%	0.46	S	S	.	.			trans	-132.5	65.9	-173.6	-65.5	-23.8	0	0	0	111.4	T138 S144 D145	T138-N142 PolarHBondContact O-N 2.95Å; N142-S144 PolarHBondContact O-N 2.92Å; N142-S144 VanDerWaalsContact O-N 3.13Å; N142-D145 HydrophobicContact CB-CB 4.02Å; N142-D145 PolarHBondContact O-N 3.26Å; N142-D145 VanDerWaalsContact O-N 3.1Å
143	P	87.8	Confident	92.4	Very high	91 Å²	91	92.2 Å²	92.2	59%	0.591	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-23.8	-173.1	22.2	-32.3	0	0	0	114.3	R139	R139-P143 WeakPolarHBondContact O-CA 3.27Å
144	S	91.9	Very high	92.5	Very high	118 Å²	118	93.5 Å²	93.5	83%	0.825	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-14.9	179.5	-51.7	0	0	0	0	113.6	N142 R146	N142-S144 PolarHBondContact O-N 2.92Å; N142-S144 VanDerWaalsContact O-N 3.13Å; S144-R146 VanDerWaalsContact C-N 3.32Å; S144-R146 PolarHBondContact O-N 2.85Å
145	D	91.9	Very high	92.5	Very high	60 Å²	60	92.7 Å²	92.7	32%	0.321	45%	0.453	S	S	.	.			trans	-85.1	77.5	-177.6	-163.6	-26.8	0	0	0	110.6	N142 Q147 I148 I149	N142-D145 HydrophobicContact CB-CB 4.02Å; N142-D145 PolarHBondContact O-N 3.26Å; N142-D145 VanDerWaalsContact O-N 3.1Å; D145-Q147 PolarHBondContact O-N 3.45Å; D145-Q147 PolarHBondContact OD1-N 3.29Å; D145-I148 PolarHBondContact O-N 2.88Å; D145-I148 WeakPolarHBondContact OD1-CG1 3.38Å; D145-I148 PolarHBondContact OD1-N 2.83Å; D145-I148 WeakPolarHBondContact OD2-CD1 3.49Å; D145-I148 WeakPolarHBondContact OD2-CG1 3.35Å; D145-I149 WeakPolarHBondContact O-CG1 3.49Å; D145-I149 PolarHBondContact O-N 3.36Å
146	R	92.2	Very high	92.6	Very high	204 Å²	204	93.3 Å²	93.3	77%	0.77	46%	0.457	S	S	*	.	H	α-helix	trans	-57.9	-34.7	-179.7	-83.6	-172	168.2	179.4	-3.1	112.7	S144 I149 T150	S144-R146 VanDerWaalsContact C-N 3.32Å; S144-R146 PolarHBondContact O-N 2.85Å; R146-I149 PolarHBondContact O-N 2.93Å; R146-T150 WeakPolarHBondContact O-CB 3.47Å; R146-T150 PolarHBondContact O-N 3.38Å; R146-T150 PolarHBondContact O-OG1 3.29Å
147	Q	92.7	Very high	92.8	Very high	158 Å²	158	94 Å²	94	74%	0.738	46%	0.46	S	S	*	.	H	α-helix	trans	-66.8	-46.4	-175.8	-173.6	176.2	-13.9	0	0	111.2	D145 T150 Q151	D145-Q147 PolarHBondContact O-N 3.45Å; D145-Q147 PolarHBondContact OD1-N 3.29Å; Q147-T150 PolarHBondContact O-N 2.93Å; Q147-Q151 PolarHBondContact O-N 3.25Å; Q147-Q151 VanDerWaalsContact O-N 3.07Å
148	I	92.7	Very high	92.9	Very high	74 Å²	74	96.4 Å²	96.4	38%	0.379	47%	0.465	S	S	.	.	H	α-helix	trans	-66.2	-39.4	177.7	-61.4	-177.6	0	0	0	111	T138 D145 Q151 A152	T138-I148 HydrophobicContact CG2-CG2 3.64Å; D145-I148 PolarHBondContact O-N 2.88Å; D145-I148 WeakPolarHBondContact OD1-CG1 3.38Å; D145-I148 PolarHBondContact OD1-N 2.83Å; D145-I148 WeakPolarHBondContact OD2-CD1 3.49Å; D145-I148 WeakPolarHBondContact OD2-CG1 3.35Å; I148-Q151 PolarHBondContact O-N 3.38Å; I148-A152 PolarHBondContact O-N 2.86Å
149	I	92.2	Very high	93	Very high	21 Å²	21	96.1 Å²	96.1	11%	0.108	47%	0.465	C	S	.	.	H	α-helix	trans	-62.1	-48.2	177.2	-66.7	167.4	0	0	0	110.7	L135 T138 R139 D145 R146 Q151 A152 E153	L135-I149 HydrophobicContact CD1-CG2 4.24Å; T138-I149 HydrophobicContact CG2-CG1 4.14Å; R139-I149 HydrophobicContact CG-CD1 4.37Å; R139-I149 HydrophobicContact CG-CG1 4.37Å; R139-I149 HydrophobicContact CG-CG2 4.21Å; D145-I149 WeakPolarHBondContact O-CG1 3.49Å; D145-I149 PolarHBondContact O-N 3.36Å; R146-I149 PolarHBondContact O-N 2.93Å; I149-Q151 VanDerWaalsContact C-N 3.28Å; I149-Q151 PolarHBondContact O-N 3.16Å; I149-A152 PolarHBondContact O-N 3.41Å; I149-E153 HydrophobicContact CG2-CG 4.35Å; I149-E153 VanDerWaalsContact O-CG 3.32Å; I149-E153 WeakPolarHBondContact O-CG 3.37Å; I149-E153 PolarHBondContact O-N 2.81Å
150	T	93.8	Very high	93.1	Very high	76 Å²	76	92.6 Å²	92.6	47%	0.466	46%	0.456	S	S	.	.	H	α-helix	trans	-62.6	-35.1	178.9	-61.3	0	0	0	0	112.4	R146 Q147 E153 T154	R146-T150 WeakPolarHBondContact O-CB 3.47Å; R146-T150 PolarHBondContact O-N 3.38Å; R146-T150 PolarHBondContact O-OG1 3.29Å; Q147-T150 PolarHBondContact O-N 2.93Å; T150-E153 PolarHBondContact O-N 3.18Å; T150-T154 PolarHBondContact O-N 3.47Å; T150-T154 PolarHBondContact O-OG1 3.28Å
151	Q	93.8	Very high	93.4	Very high	114 Å²	114	91.4 Å²	91.4	53%	0.533	45%	0.448	S	S	.	.	H	α-helix	trans	-64.9	-48.4	173.9	-176.8	170	-1.4	0	0	111.7	Q147 I148 I149 E153 T154 E155	Q147-Q151 PolarHBondContact O-N 3.25Å; Q147-Q151 VanDerWaalsContact O-N 3.07Å; I148-Q151 PolarHBondContact O-N 3.38Å; I149-Q151 VanDerWaalsContact C-N 3.28Å; I149-Q151 PolarHBondContact O-N 3.16Å; Q151-E153 VanDerWaalsContact C-N 3.3Å; Q151-E153 PolarHBondContact O-N 3.45Å; Q151-T154 WeakPolarHBondContact O-CB 3.45Å; Q151-T154 PolarHBondContact O-N 2.99Å; Q151-T154 VanDerWaalsContact O-N 3.16Å; Q151-E155 PolarHBondContact O-N 3.18Å
152	A	93.3	Very high	93.5	Very high	10 Å²	10	84.2 Å²	84.2	8%	0.083	43%	0.425	C	S	.	.	H	α-helix	trans	-62.5	-35.6	176.8	0	0	0	0	0	112.4	L135 I148 I149 E155 L156	L135-A152 HydrophobicContact CB-CB 4.49Å; L135-A152 HydrophobicContact CD1-CB 3.77Å; I148-A152 PolarHBondContact O-N 2.86Å; I149-A152 PolarHBondContact O-N 3.41Å; A152-E155 PolarHBondContact O-N 3.11Å; A152-L156 WeakPolarHBondContact O-CB 3.39Å; A152-L156 PolarHBondContact O-N 2.83Å
153	E	94.3	Very high	93.8	Very high	70 Å²	70	81 Å²	81	33%	0.327	41%	0.407	S	S	.	.	H	α-helix	trans	-62.4	-42.3	173	-74.6	172.1	165.6	0	0	111.9	L135 R139 I149 T150 Q151 L156 Q157	L135-E153 HydrophobicContact CD1-CG 3.7Å; L135-E153 HydrophobicContact CD2-CG 3.86Å; L135-E153 HydrophobicContact CG-CG 4.46Å; R139-E153 IonicContact CZ-OE1 3.66Å; R139-E153 IonicContact NE-OE1 2.7Å; R139-E153 IonicContact NH2-OE1 2.7Å; R139-E153 PolarHBondContact NH2-OE1 3.28Å; I149-E153 HydrophobicContact CG2-CG 4.35Å; I149-E153 VanDerWaalsContact O-CG 3.32Å; I149-E153 WeakPolarHBondContact O-CG 3.37Å; I149-E153 PolarHBondContact O-N 2.81Å; T150-E153 PolarHBondContact O-N 3.18Å; Q151-E153 VanDerWaalsContact C-N 3.3Å; Q151-E153 PolarHBondContact O-N 3.45Å; E153-L156 PolarHBondContact O-N 2.72Å; E153-Q157 WeakPolarHBondContact O-CB 3.38Å; E153-Q157 PolarHBondContact O-N 3Å
154	T	95.6	Very high	94.1	Very high	72 Å²	72	80.7 Å²	80.7	44%	0.442	40%	0.404	S	S	.	.	H	α-helix	trans	-65.9	-41	177.5	-55.5	0	0	0	0	111.6	T150 Q151 Q157 R158	T150-T154 PolarHBondContact O-N 3.47Å; T150-T154 PolarHBondContact O-OG1 3.28Å; Q151-T154 WeakPolarHBondContact O-CB 3.45Å; Q151-T154 PolarHBondContact O-N 2.99Å; Q151-T154 VanDerWaalsContact O-N 3.16Å; T154-Q157 PolarHBondContact O-N 3.45Å; T154-R158 PolarHBondContact O-N 3.36Å
155	E	94.7	Very high	94.3	Very high	77 Å²	77	82.2 Å²	82.2	36%	0.36	39%	0.392	S	S	.	.	H	α-helix	trans	-65.5	-43.2	176.1	-72.1	-178.6	-161.3	0	0	112.2	Q131 Q151 A152 R158 A159	Q131-E155 PolarHBondContact NE2-OE2 3.25Å; Q151-E155 PolarHBondContact O-N 3.18Å; A152-E155 PolarHBondContact O-N 3.11Å; E155-R158 PolarHBondContact O-N 2.99Å; E155-A159 PolarHBondContact O-N 3.41Å
156	L	95.4	Very high	94.4	Very high	24 Å²	24	80.4 Å²	80.4	13%	0.126	38%	0.383	C	S	.	.	H	α-helix	trans	-60.7	-47.6	173.4	175.8	58.4	0	0	0	110.9	E128 Q131 M132 L135 A152 E153 R158 A159 T160	E128-L156 HydrophobicContact CG-CD1 4.38Å; Q131-L156 HydrophobicContact CB-CB 4.3Å; Q131-L156 HydrophobicContact CB-CD1 3.96Å; M132-L156 HydrophobicContact CB-CD1 3.98Å; M132-L156 HydrophobicContact CB-CD2 4.47Å; L135-L156 HydrophobicContact CB-CD2 4.49Å; L135-L156 HydrophobicContact CD2-CD2 3.52Å; A152-L156 WeakPolarHBondContact O-CB 3.39Å; A152-L156 PolarHBondContact O-N 2.83Å; E153-L156 PolarHBondContact O-N 2.72Å; L156-R158 VanDerWaalsContact C-N 3.27Å; L156-R158 PolarHBondContact O-N 3.25Å; L156-A159 PolarHBondContact O-N 3.47Å; L156-A159 VanDerWaalsContact O-N 3.07Å; L156-T160 PolarHBondContact O-N 3.13Å; L156-T160 PolarHBondContact O-OG1 3.35Å
157	Q	96	Very high	94.4	Very high	126 Å²	126	71.7 Å²	71.7	59%	0.589	35%	0.352	S	S	*	.	H	α-helix	trans	-56.6	-43.4	178.7	-174	178.6	-3.2	0	0	111.4	E153 T154 T160 M161	E153-Q157 WeakPolarHBondContact O-CB 3.38Å; E153-Q157 PolarHBondContact O-N 3Å; T154-Q157 PolarHBondContact O-N 3.45Å; Q157-T160 PolarHBondContact O-N 3.1Å; Q157-M161 HydrophobicContact CG-SD 4.5Å; Q157-M161 VanDerWaalsContact O-CG 3.29Å; Q157-M161 WeakPolarHBondContact O-CG 3.25Å; Q157-M161 PolarHBondContact O-N 3.41Å
158	R	96.2	Very high	94.5	Very high	180 Å²	180	70.1 Å²	70.1	68%	0.679	34%	0.343	S	S	*	.	H	α-helix	trans	-62.8	-44.7	175.7	-173	-175.7	-66.6	160.1	0.1	111.9	T154 E155 L156 M161 D162	T154-R158 PolarHBondContact O-N 3.36Å; E155-R158 PolarHBondContact O-N 2.99Å; L156-R158 VanDerWaalsContact C-N 3.27Å; L156-R158 PolarHBondContact O-N 3.25Å; R158-M161 PolarHBondContact O-N 2.91Å; R158-D162 PolarHBondContact O-N 2.95Å; R158-D162 VanDerWaalsContact O-N 3.08Å
159	A	95.3	Very high	94.6	Very high	9 Å²	9	71.4 Å²	71.4	7%	0.074	35%	0.347	C	S	.	.	H	α-helix	trans	-64.7	-41	178.8	0	0	0	0	0	112.2	R127 E128 Q131 E155 L156 D162 A163	R127-A159 HydrophobicContact CG-CB 4.47Å; E128-A159 HydrophobicContact CB-CB 4.36Å; Q131-A159 HydrophobicContact CB-CB 4.44Å; Q131-A159 HydrophobicContact CG-CB 4.18Å; E155-A159 PolarHBondContact O-N 3.41Å; L156-A159 PolarHBondContact O-N 3.47Å; L156-A159 VanDerWaalsContact O-N 3.07Å; A159-D162 PolarHBondContact O-N 3.27Å; A159-A163 WeakPolarHBondContact O-CB 3.41Å; A159-A163 PolarHBondContact O-N 3Å
160	T	94.5	Very high	94.7	Very high	45 Å²	45	70.7 Å²	70.7	28%	0.276	34%	0.344	S	S	.	.	H	α-helix	trans	-63.2	-43.1	174.8	-67.9	0	0	0	0	112.1	E128 L156 Q157 D162 A163 T164	E128-T160 WeakPolarHBondContact OE1-CA 3.42Å; E128-T160 VanDerWaalsContact OE1-CB 3.24Å; E128-T160 WeakPolarHBondContact OE1-CB 3.48Å; E128-T160 VanDerWaalsContact OE1-CG2 3.28Å; E128-T160 WeakPolarHBondContact OE1-CG2 3.37Å; E128-T160 PolarHBondContact OE1-OG1 3.33Å; L156-T160 PolarHBondContact O-N 3.13Å; L156-T160 PolarHBondContact O-OG1 3.35Å; Q157-T160 PolarHBondContact O-N 3.1Å; T160-D162 VanDerWaalsContact C-N 3.33Å; T160-D162 PolarHBondContact O-N 3.48Å; T160-A163 PolarHBondContact O-N 3.04Å; T160-T164 VanDerWaalsContact O-CB 3.31Å; T160-T164 WeakPolarHBondContact O-CB 3.29Å; T160-T164 PolarHBondContact O-N 3.48Å; T160-T164 PolarHBondContact O-OG1 3.16Å
161	M	96.1	Very high	94.6	Very high	126 Å²	126	71.1 Å²	71.1	62%	0.621	34%	0.341	S	S	*	.	H	α-helix	trans	-61.2	-43.1	175.9	-74.1	-179.8	71	0	0	111.8	Q157 R158 R165	Q157-M161 HydrophobicContact CG-SD 4.5Å; Q157-M161 VanDerWaalsContact O-CG 3.29Å; Q157-M161 WeakPolarHBondContact O-CG 3.25Å; Q157-M161 PolarHBondContact O-N 3.41Å; R158-M161 PolarHBondContact O-N 2.91Å; M161-R165 WeakPolarHBondContact O-CB 3.45Å; M161-R165 PolarHBondContact O-N 3.04Å
162	D	95.8	Very high	94.7	Very high	44 Å²	44	71 Å²	71	24%	0.235	34%	0.34	C	S	.	.	H	α-helix	trans	-64.4	-50.7	177	-169.3	33.5	0	0	0	111.7	R158 A159 T160 T164 R165 T166	R158-D162 PolarHBondContact O-N 2.95Å; R158-D162 VanDerWaalsContact O-N 3.08Å; A159-D162 PolarHBondContact O-N 3.27Å; T160-D162 VanDerWaalsContact C-N 3.33Å; T160-D162 PolarHBondContact O-N 3.48Å; D162-T164 VanDerWaalsContact C-N 3.31Å; D162-T164 PolarHBondContact O-N 3.25Å; D162-R165 WeakPolarHBondContact O-CB 3.47Å; D162-R165 PolarHBondContact O-N 3.29Å; D162-R165 VanDerWaalsContact O-N 3.15Å; D162-R165 IonicContact OD1-CZ 3.69Å; D162-R165 IonicContact OD1-NE 2.72Å; D162-R165 IonicContact OD1-NH2 3.84Å; D162-R165 PolarHBondContact OD1-NH2 3.06Å; D162-T166 PolarHBondContact O-N 2.99Å; D162-T166 PolarHBondContact O-OG1 2.89Å
163	A	94.3	Very high	94.8	Very high	1 Å²	1	72.6 Å²	72.6	1%	0.008	35%	0.349	C	S	.	.	H	α-helix	trans	-59.9	-38.8	179	0	0	0	0	0	112.9	A124 R125 E128 A159 T160 T166 T167	A124-A163 HydrophobicContact CB-CB 4.37Å; R125-A163 HydrophobicContact CG-CB 4.35Å; E128-A163 HydrophobicContact CB-CB 4.1Å; E128-A163 WeakPolarHBondContact OE2-CB 3.39Å; A159-A163 WeakPolarHBondContact O-CB 3.41Å; A159-A163 PolarHBondContact O-N 3Å; T160-A163 PolarHBondContact O-N 3.04Å; A163-T166 PolarHBondContact O-OG1 3.36Å; A163-T167 WeakPolarHBondContact O-CB 3.43Å; A163-T167 PolarHBondContact O-N 2.99Å; A163-T167 PolarHBondContact O-OG1 3.29Å
164	T	93.2	Very high	94.9	Very high	86 Å²	86	70.2 Å²	70.2	53%	0.528	34%	0.338	S	S	.	.	H	α-helix	trans	-65.2	-46	175.5	-57.7	0	0	0	0	110.8	T160 D162 T167 K168	T160-T164 VanDerWaalsContact O-CB 3.31Å; T160-T164 WeakPolarHBondContact O-CB 3.29Å; T160-T164 PolarHBondContact O-N 3.48Å; T160-T164 PolarHBondContact O-OG1 3.16Å; D162-T164 VanDerWaalsContact C-N 3.31Å; D162-T164 PolarHBondContact O-N 3.25Å; T164-T167 PolarHBondContact O-N 3.34Å; T164-K168 PolarHBondContact O-N 3.26Å; T164-K168 VanDerWaalsContact O-N 3.09Å
165	R	95.8	Very high	95	Very high	150 Å²	150	71.5 Å²	71.5	57%	0.566	34%	0.342	S	S	*	.	H	α-helix	trans	-61.4	-51.4	178.8	177.1	-176.6	64.1	177.5	0.8	111.7	M161 D162 T167 K168 Q169	M161-R165 WeakPolarHBondContact O-CB 3.45Å; M161-R165 PolarHBondContact O-N 3.04Å; D162-R165 WeakPolarHBondContact O-CB 3.47Å; D162-R165 PolarHBondContact O-N 3.29Å; D162-R165 VanDerWaalsContact O-N 3.15Å; D162-R165 IonicContact OD1-CZ 3.69Å; D162-R165 IonicContact OD1-NE 2.72Å; D162-R165 IonicContact OD1-NH2 3.84Å; D162-R165 PolarHBondContact OD1-NH2 3.06Å; R165-T167 VanDerWaalsContact C-N 3.31Å; R165-T167 PolarHBondContact O-N 2.94Å; R165-K168 PolarHBondContact O-N 3.22Å; R165-Q169 WeakPolarHBondContact O-CG 3.2Å; R165-Q169 PolarHBondContact O-N 3.22Å; R165-Q169 VanDerWaalsContact O-N 3.09Å
166	T	95	Very high	95.1	Very high	21 Å²	21	72.3 Å²	72.3	13%	0.129	35%	0.346	C	S	.	.	H	α-helix	trans	-66.7	-34.7	-178.4	57.9	0	0	0	0	111.6	T121 A124 D162 A163 Q169 L170	T121-T166 PolarHBondContact OG1-O 3.13Å; A124-T166 HydrophobicContact CB-CG2 4.48Å; D162-T166 PolarHBondContact O-N 2.99Å; D162-T166 PolarHBondContact O-OG1 2.89Å; A163-T166 PolarHBondContact O-OG1 3.36Å; T166-Q169 PolarHBondContact O-N 3.23Å; T166-L170 WeakPolarHBondContact O-CB 3.14Å; T166-L170 PolarHBondContact O-N 3.36Å
167	T	92.8	Very high	95.2	Very high	21 Å²	21	71.5 Å²	71.5	13%	0.129	34%	0.341	C	S	.	.	H	α-helix	trans	-59.9	-49.5	173.9	-67.3	0	0	0	0	111.6	R125 A163 T164 R165 Q169 L170 E171	R125-T167 PolarHBondContact NE-OG1 3.12Å; R125-T167 PolarHBondContact NH2-OG1 3.17Å; A163-T167 WeakPolarHBondContact O-CB 3.43Å; A163-T167 PolarHBondContact O-N 2.99Å; A163-T167 PolarHBondContact O-OG1 3.29Å; T164-T167 PolarHBondContact O-N 3.34Å; R165-T167 VanDerWaalsContact C-N 3.31Å; R165-T167 PolarHBondContact O-N 2.94Å; T167-Q169 VanDerWaalsContact C-N 3.34Å; T167-Q169 PolarHBondContact O-N 3.03Å; T167-L170 WeakPolarHBondContact O-CB 3.36Å; T167-L170 PolarHBondContact O-N 3.35Å; T167-E171 WeakPolarHBondContact O-CG 3.48Å; T167-E171 PolarHBondContact O-N 3.29Å
168	K	93.1	Very high	95.2	Very high	126 Å²	126	67.7 Å²	67.7	55%	0.548	32%	0.324	S	S	.	.	H	α-helix	trans	-62.7	-42.3	179.8	-173.9	178.8	176.9	-173.3	0	111.8	T164 R165 L170 E171 E172	T164-K168 PolarHBondContact O-N 3.26Å; T164-K168 VanDerWaalsContact O-N 3.09Å; R165-K168 PolarHBondContact O-N 3.22Å; K168-L170 VanDerWaalsContact C-N 3.34Å; K168-L170 PolarHBondContact O-N 2.72Å; K168-E171 PolarHBondContact O-N 3.14Å; K168-E172 WeakPolarHBondContact CE-OE1 3.39Å; K168-E172 WeakPolarHBondContact O-CG 3.27Å; K168-E172 PolarHBondContact O-N 3.49Å; K168-E172 VanDerWaalsContact O-N 3.09Å
169	Q	95	Very high	95.3	Very high	101 Å²	101	65.5 Å²	65.5	47%	0.472	32%	0.315	S	S	.	.	H	α-helix	trans	-62.1	-41.1	175.5	-72	174.6	-24.5	0	0	111.9	R165 T166 T167 T173	R165-Q169 WeakPolarHBondContact O-CG 3.2Å; R165-Q169 PolarHBondContact O-N 3.22Å; R165-Q169 VanDerWaalsContact O-N 3.09Å; T166-Q169 PolarHBondContact O-N 3.23Å; T167-Q169 VanDerWaalsContact C-N 3.34Å; T167-Q169 PolarHBondContact O-N 3.03Å; Q169-T173 WeakPolarHBondContact O-CB 3.19Å; Q169-T173 WeakPolarHBondContact O-CG2 3.23Å; Q169-T173 PolarHBondContact O-N 3.28Å; Q169-T173 PolarHBondContact O-OG1 3.3Å
170	L	94.4	Very high	95.4	Very high	5 Å²	5	68.4 Å²	68.4	3%	0.026	33%	0.327	C	S	.	.	H	α-helix	trans	-61.6	-43.8	175.1	179.9	68.3	0	0	0	111.3	I21 D117 L118 T121 T166 T167 K168 T173 I174	I21-L170 HydrophobicContact CD1-CD2 4.36Å; D117-L170 HydrophobicContact CB-CD1 4.3Å; L118-L170 HydrophobicContact CB-CD1 4.34Å; L118-L170 HydrophobicContact CD1-CD1 4.26Å; L118-L170 HydrophobicContact CD1-CD2 3.52Å; L118-L170 HydrophobicContact CD1-CG 4.49Å; T121-L170 HydrophobicContact CG2-CB 4.32Å; T121-L170 HydrophobicContact CG2-CD2 3.77Å; T166-L170 WeakPolarHBondContact O-CB 3.14Å; T166-L170 PolarHBondContact O-N 3.36Å; T167-L170 WeakPolarHBondContact O-CB 3.36Å; T167-L170 PolarHBondContact O-N 3.35Å; K168-L170 VanDerWaalsContact C-N 3.34Å; K168-L170 PolarHBondContact O-N 2.72Å; L170-T173 WeakPolarHBondContact CA-OG1 3.44Å; L170-T173 PolarHBondContact O-N 2.92Å; L170-T173 PolarHBondContact O-OG1 3.46Å; L170-I174 HydrophobicContact CD1-CD1 4.35Å; L170-I174 HydrophobicContact CD1-CG1 3.83Å; L170-I174 HydrophobicContact CG-CG1 4.15Å; L170-I174 WeakPolarHBondContact O-CB 3.31Å; L170-I174 WeakPolarHBondContact O-CG1 3.46Å; L170-I174 PolarHBondContact O-N 3.04Å
171	E	92.9	Very high	95.5	Very high	86 Å²	86	67.8 Å²	67.8	40%	0.402	32%	0.321	S	S	.	.	H	α-helix	trans	-60.7	-48.9	178.9	-72.2	173.9	167.4	0	0	112.2	Q17 T167 K168 T173 I174 D175	Q17-E171 PolarHBondContact NE2-OE1 3.16Å; T167-E171 WeakPolarHBondContact O-CG 3.48Å; T167-E171 PolarHBondContact O-N 3.29Å; K168-E171 PolarHBondContact O-N 3.14Å; E171-T173 VanDerWaalsContact C-N 3.33Å; E171-T173 PolarHBondContact O-N 3.06Å; E171-I174 PolarHBondContact O-N 2.88Å; E171-D175 PolarHBondContact O-N 3.21Å
172	E	95	Very high	95.7	Very high	110 Å²	110	66.5 Å²	66.5	51%	0.514	32%	0.316	S	S	.	.	H	α-helix	trans	-60.5	-42.9	177.4	-69.6	170.2	179.8	0	0	111.5	K168 E176	K168-E172 WeakPolarHBondContact CE-OE1 3.39Å; K168-E172 WeakPolarHBondContact O-CG 3.27Å; K168-E172 PolarHBondContact O-N 3.49Å; K168-E172 VanDerWaalsContact O-N 3.09Å; E172-E176 PolarHBondContact O-N 3.2Å; E172-E176 VanDerWaalsContact O-N 3.15Å
173	T	95.8	Very high	95.8	Very high	44 Å²	44	69.1 Å²	69.1	27%	0.27	33%	0.326	S	S	.	.	H	α-helix	trans	-75.4	-26	-178	58.6	0	0	0	0	113.4	K114 Q169 L170 E171 F177	K114-T173 PolarHBondContact NZ-O 2.94Å; Q169-T173 WeakPolarHBondContact O-CB 3.19Å; Q169-T173 WeakPolarHBondContact O-CG2 3.23Å; Q169-T173 PolarHBondContact O-N 3.28Å; Q169-T173 PolarHBondContact O-OG1 3.3Å; L170-T173 WeakPolarHBondContact CA-OG1 3.44Å; L170-T173 PolarHBondContact O-N 2.92Å; L170-T173 PolarHBondContact O-OG1 3.46Å; E171-T173 VanDerWaalsContact C-N 3.33Å; E171-T173 PolarHBondContact O-N 3.06Å; T173-F177 WeakPolarHBondContact O-CB 3.48Å; T173-F177 PolarHBondContact O-N 3.25Å; T173-F177 VanDerWaalsContact O-N 3.15Å
174	I	96.5	Very high	96	Very high	21 Å²	21	70.7 Å²	70.7	11%	0.108	34%	0.335	C	S	.	.	H	α-helix	trans	-78.2	-38.6	173.2	-70.7	-62.8	0	0	0	111.1	I21 I25 K114 L170 E171 E176 F177 E178	I21-I174 HydrophobicContact CD1-CG1 4.37Å; I21-I174 HydrophobicContact CG1-CG2 4.33Å; I21-I174 HydrophobicContact CG2-CD1 3.5Å; I21-I174 VanDerWaalsContact CG2-CD1 3.5Å; I21-I174 HydrophobicContact CG2-CG1 3.83Å; I21-I174 HydrophobicContact CG2-CG2 4.48Å; I25-I174 HydrophobicContact CD1-CD1 4.23Å; K114-I174 HydrophobicContact CD-CD1 4.39Å; L170-I174 HydrophobicContact CD1-CD1 4.35Å; L170-I174 HydrophobicContact CD1-CG1 3.83Å; L170-I174 HydrophobicContact CG-CG1 4.15Å; L170-I174 WeakPolarHBondContact O-CB 3.31Å; L170-I174 WeakPolarHBondContact O-CG1 3.46Å; L170-I174 PolarHBondContact O-N 3.04Å; E171-I174 PolarHBondContact O-N 2.88Å; I174-E176 VanDerWaalsContact C-N 3.33Å; I174-E176 PolarHBondContact O-N 3.28Å; I174-F177 WeakPolarHBondContact O-CB 3.17Å; I174-F177 PolarHBondContact O-N 3.45Å; I174-E178 HydrophobicContact CG2-CG 4.45Å; I174-E178 WeakPolarHBondContact O-CG 3.44Å; I174-E178 PolarHBondContact O-N 3.37Å
175	D	96.4	Very high	96.2	Very high	98 Å²	98	69.2 Å²	69.2	52%	0.524	32%	0.323	S	S	.	.	H	α-helix	trans	-58.8	-46.6	173.4	-173.4	65.6	0	0	0	111.1	E171 F177 E178 R179	E171-D175 PolarHBondContact O-N 3.21Å; D175-F177 VanDerWaalsContact C-N 3.33Å; D175-F177 PolarHBondContact O-N 3.19Å; D175-E178 PolarHBondContact O-N 2.86Å; D175-R179 WeakPolarHBondContact O-CB 3.43Å; D175-R179 PolarHBondContact O-N 2.7Å
176	E	96.9	Very high	96.3	Very high	95 Å²	95	69.5 Å²	69.5	44%	0.444	33%	0.328	S	S	.	.	H	α-helix	trans	-64.2	-38.5	176.3	-173.6	56.6	-151.4	0	0	112.2	E172 I174 R179 Q180	E172-E176 PolarHBondContact O-N 3.2Å; E172-E176 VanDerWaalsContact O-N 3.15Å; I174-E176 VanDerWaalsContact C-N 3.33Å; I174-E176 PolarHBondContact O-N 3.28Å; E176-R179 PolarHBondContact O-N 3.34Å; E176-Q180 VanDerWaalsContact O-CB 3.25Å; E176-Q180 WeakPolarHBondContact O-CB 3.44Å; E176-Q180 PolarHBondContact O-N 2.95Å
177	F	97.2	Very high	96.5	Very high	6 Å²	6	74.8 Å²	74.8	3%	0.026	35%	0.349	C	S	.	.	H	α-helix	trans	-62.1	-45.4	175.9	170.8	-106.5	0	0	0	112.2	I25 V28 Y107 V110 K114 T173 I174 D175 Q180 K181	I25-F177 HydrophobicContact CG1-CE1 4.47Å; V28-F177 HydrophobicContact CB-CZ 4.26Å; V28-F177 HydrophobicContact CG1-CZ 4.04Å; V28-F177 HydrophobicContact CG2-CE1 4.39Å; V28-F177 HydrophobicContact CG2-CZ 4.14Å; Y107-F177 HydrophobicContact CE1-CE2 4.19Å; V110-F177 HydrophobicContact CG1-CD2 3.87Å; V110-F177 HydrophobicContact CG1-CE2 3.84Å; K114-F177 HydrophobicContact CD-CB 4.26Å; K114-F177 HydrophobicContact CD-CG 4.45Å; K114-F177 HydrophobicContact CG-CD2 4.07Å; K114-F177 HydrophobicContact CG-CE2 4.48Å; K114-F177 HydrophobicContact CG-CG 4.27Å; T173-F177 WeakPolarHBondContact O-CB 3.48Å; T173-F177 PolarHBondContact O-N 3.25Å; T173-F177 VanDerWaalsContact O-N 3.15Å; I174-F177 WeakPolarHBondContact O-CB 3.17Å; I174-F177 PolarHBondContact O-N 3.45Å; D175-F177 VanDerWaalsContact C-N 3.33Å; D175-F177 PolarHBondContact O-N 3.19Å; F177-Q180 PolarHBondContact O-N 3.33Å; F177-K181 VanDerWaalsContact O-CB 3.29Å; F177-K181 WeakPolarHBondContact O-CB 3.36Å; F177-K181 PolarHBondContact O-N 3.13Å
178	E	97.1	Very high	96.8	Very high	47 Å²	47	74 Å²	74	22%	0.22	35%	0.345	C	S	.	.	H	α-helix	trans	-65.4	-41	178.6	-75	-68.1	138	0	0	111.6	I174 D175 K181 I182	I174-E178 HydrophobicContact CG2-CG 4.45Å; I174-E178 WeakPolarHBondContact O-CG 3.44Å; I174-E178 PolarHBondContact O-N 3.37Å; D175-E178 PolarHBondContact O-N 2.86Å; E178-K181 IonicContact OE1-NZ 3.38Å; E178-K181 PolarHBondContact OE1-NZ 3.35Å; E178-K181 VanDerWaalsContact OE2-CE 3.29Å; E178-K181 WeakPolarHBondContact OE2-CE 3.42Å; E178-K181 IonicContact OE2-NZ 2.63Å; E178-K181 PolarHBondContact OE2-NZ 3.25Å; E178-I182 WeakPolarHBondContact O-CG1 3.43Å; E178-I182 PolarHBondContact O-N 3.08Å
179	R	98	Very high	97.1	Very high	133 Å²	133	72.2 Å²	72.2	50%	0.502	34%	0.337	S	S	.	.	H	α-helix	trans	-60.2	-51.3	173	178.9	-173.8	-64.6	-95.5	-3.6	111.7	D175 E176 K181 I182 Q183	D175-R179 WeakPolarHBondContact O-CB 3.43Å; D175-R179 PolarHBondContact O-N 2.7Å; E176-R179 PolarHBondContact O-N 3.34Å; R179-K181 VanDerWaalsContact C-N 3.33Å; R179-K181 PolarHBondContact O-N 2.89Å; R179-I182 PolarHBondContact O-N 2.87Å; R179-Q183 WeakPolarHBondContact O-CG 3.4Å; R179-Q183 PolarHBondContact O-N 3.04Å; R179-Q183 VanDerWaalsContact O-N 3.16Å
180	Q	97.3	Very high	97.2	Very high	70 Å²	70	69 Å²	69	33%	0.327	33%	0.331	S	S	.	.	H	α-helix	trans	-60.5	-44	-179.3	-175.2	60.9	55.1	0	0	111	E176 F177 I182 Q183 D184	E176-Q180 VanDerWaalsContact O-CB 3.25Å; E176-Q180 WeakPolarHBondContact O-CB 3.44Å; E176-Q180 PolarHBondContact O-N 2.95Å; F177-Q180 PolarHBondContact O-N 3.33Å; Q180-I182 VanDerWaalsContact C-N 3.34Å; Q180-I182 PolarHBondContact O-N 3.2Å; Q180-Q183 PolarHBondContact O-N 3.29Å; Q180-Q183 VanDerWaalsContact O-N 3.13Å; Q180-D184 WeakPolarHBondContact CG-OD2 3.35Å; Q180-D184 PolarHBondContact NE2-OD1 3.19Å; Q180-D184 PolarHBondContact NE2-OD2 3.34Å; Q180-D184 PolarHBondContact O-N 2.98Å
181	K	97.9	Very high	97.5	Very high	33 Å²	33	71 Å²	71	14%	0.143	34%	0.34	C	S	.	.	H	α-helix	trans	-53.2	-48.9	175.1	179.9	-173.2	68.6	-172	0	112.3	V28 F32 Y107 F177 E178 R179 Q183 D184 I185	V28-K181 HydrophobicContact CG2-CD 3.49Å; V28-K181 VanDerWaalsContact CG2-CD 3.49Å; F32-K181 HydrophobicContact CZ-CG 3.97Å; Y107-K181 WeakPolarHBondContact OH-CA 3.45Å; F177-K181 VanDerWaalsContact O-CB 3.29Å; F177-K181 WeakPolarHBondContact O-CB 3.36Å; F177-K181 PolarHBondContact O-N 3.13Å; E178-K181 IonicContact OE1-NZ 3.38Å; E178-K181 PolarHBondContact OE1-NZ 3.35Å; E178-K181 VanDerWaalsContact OE2-CE 3.29Å; E178-K181 WeakPolarHBondContact OE2-CE 3.42Å; E178-K181 IonicContact OE2-NZ 2.63Å; E178-K181 PolarHBondContact OE2-NZ 3.25Å; R179-K181 VanDerWaalsContact C-N 3.33Å; R179-K181 PolarHBondContact O-N 2.89Å; K181-Q183 VanDerWaalsContact C-N 3.32Å; K181-Q183 PolarHBondContact O-N 3Å; K181-D184 PolarHBondContact O-N 2.92Å; K181-I185 HydrophobicContact CG-CD1 3.94Å; K181-I185 VanDerWaalsContact O-CG1 3.27Å; K181-I185 WeakPolarHBondContact O-CG1 3.49Å; K181-I185 PolarHBondContact O-N 3.02Å
182	I	98.4	Very high	97.7	Very high	99 Å²	99	69.1 Å²	69.1	51%	0.508	33%	0.331	S	S	.	.	H	α-helix	trans	-62.2	-42.7	179.9	-67.1	164.4	0	0	0	110.8	E178 R179 Q180 K186	E178-I182 WeakPolarHBondContact O-CG1 3.43Å; E178-I182 PolarHBondContact O-N 3.08Å; R179-I182 PolarHBondContact O-N 2.87Å; Q180-I182 VanDerWaalsContact C-N 3.34Å; Q180-I182 PolarHBondContact O-N 3.2Å; I182-K186 HydrophobicContact CG2-CD 4.48Å; I182-K186 WeakPolarHBondContact O-CG 3.45Å; I182-K186 PolarHBondContact O-N 3.09Å
183	Q	98.4	Very high	97.9	Very high	99 Å²	99	67.5 Å²	67.5	46%	0.463	33%	0.328	S	S	.	.	H	α-helix	trans	-65.4	-42.6	179.4	-68.4	178.9	3.9	0	0	111.9	R179 Q180 K181 K186 K187	R179-Q183 WeakPolarHBondContact O-CG 3.4Å; R179-Q183 PolarHBondContact O-N 3.04Å; R179-Q183 VanDerWaalsContact O-N 3.16Å; Q180-Q183 PolarHBondContact O-N 3.29Å; Q180-Q183 VanDerWaalsContact O-N 3.13Å; K181-Q183 VanDerWaalsContact C-N 3.32Å; K181-Q183 PolarHBondContact O-N 3Å; Q183-K186 PolarHBondContact O-N 3.46Å; Q183-K187 WeakPolarHBondContact O-CB 3.32Å; Q183-K187 PolarHBondContact O-N 2.7Å
184	D	98.2	Very high	98.1	Very high	34 Å²	34	68.8 Å²	68.8	18%	0.182	34%	0.336	C	S	.	.	H	α-helix	trans	-69.8	-39.1	-179.4	-70.9	-24.3	0	0	0	112.2	Y107 Q180 K181 K186 K187 V188	Y107-D184 HydrophobicContact CE2-CB 4.04Å; Y107-D184 WeakPolarHBondContact CE2-OD2 3.4Å; Y107-D184 WeakPolarHBondContact OH-CB 3.43Å; Y107-D184 PolarHBondContact OH-OD2 3.48Å; Q180-D184 WeakPolarHBondContact CG-OD2 3.35Å; Q180-D184 PolarHBondContact NE2-OD1 3.19Å; Q180-D184 PolarHBondContact NE2-OD2 3.34Å; Q180-D184 PolarHBondContact O-N 2.98Å; K181-D184 PolarHBondContact O-N 2.92Å; D184-K186 VanDerWaalsContact C-N 3.31Å; D184-K186 PolarHBondContact O-N 3.18Å; D184-K187 PolarHBondContact O-N 3.03Å; D184-K187 VanDerWaalsContact O-N 3.14Å; D184-V188 WeakPolarHBondContact O-CB 3.26Å; D184-V188 VanDerWaalsContact O-CG2 3.3Å; D184-V188 WeakPolarHBondContact O-CG2 3.28Å; D184-V188 PolarHBondContact O-N 3.45Å
185	I	98.4	Very high	98.2	Very high	55 Å²	55	68 Å²	68	28%	0.282	33%	0.333	S	S	.	.	H	α-helix	trans	-56.7	-49.4	173.4	-71.7	168.2	0	0	0	110.2	F32 K181 K187 V188 F189	F32-I185 HydrophobicContact CE1-CD1 4.08Å; F32-I185 HydrophobicContact CE1-CG1 4.07Å; F32-I185 HydrophobicContact CZ-CD1 3.87Å; F32-I185 HydrophobicContact CZ-CG1 3.56Å; K181-I185 HydrophobicContact CG-CD1 3.94Å; K181-I185 VanDerWaalsContact O-CG1 3.27Å; K181-I185 WeakPolarHBondContact O-CG1 3.49Å; K181-I185 PolarHBondContact O-N 3.02Å; I185-K187 VanDerWaalsContact C-N 3.26Å; I185-K187 PolarHBondContact O-N 3.41Å; I185-V188 PolarHBondContact O-N 3.04Å; I185-F189 HydrophobicContact CG2-CD2 3.73Å; I185-F189 HydrophobicContact CG2-CE2 3.58Å; I185-F189 HydrophobicContact CG2-CZ 4.3Å; I185-F189 WeakPolarHBondContact O-CB 3.44Å; I185-F189 WeakPolarHBondContact O-CG 3.12Å; I185-F189 PolarHBondContact O-N 3.16Å
186	K	98.7	Very high	98.3	Very high	156 Å²	156	64.3 Å²	64.3	68%	0.678	31%	0.312	S	S	*	.	H	α-helix	trans	-59.4	-41.4	178.1	-71.5	177.2	64.4	179.2	0	111.6	I182 Q183 D184 G190	I182-K186 HydrophobicContact CG2-CD 4.48Å; I182-K186 WeakPolarHBondContact O-CG 3.45Å; I182-K186 PolarHBondContact O-N 3.09Å; Q183-K186 PolarHBondContact O-N 3.46Å; D184-K186 VanDerWaalsContact C-N 3.31Å; D184-K186 PolarHBondContact O-N 3.18Å; K186-G190 PolarHBondContact O-N 2.99Å
187	K	98.6	Very high	98.4	Very high	131 Å²	131	65.9 Å²	65.9	57%	0.57	32%	0.321	S	S	*	.	H	α-helix	trans	-67.8	-52.3	-179.6	-174.4	-180	176.7	-173.7	0	111.4	Q183 D184 I185 F189 G190 E191	Q183-K187 WeakPolarHBondContact O-CB 3.32Å; Q183-K187 PolarHBondContact O-N 2.7Å; D184-K187 PolarHBondContact O-N 3.03Å; D184-K187 VanDerWaalsContact O-N 3.14Å; I185-K187 VanDerWaalsContact C-N 3.26Å; I185-K187 PolarHBondContact O-N 3.41Å; K187-F189 PolarHBondContact O-N 3.5Å; K187-G190 PolarHBondContact O-N 2.94Å; K187-E191 HydrophobicContact CG-CG 4.27Å; K187-E191 WeakPolarHBondContact O-CB 3.45Å; K187-E191 VanDerWaalsContact O-CG 3.25Å; K187-E191 WeakPolarHBondContact O-CG 3.02Å; K187-E191 PolarHBondContact O-N 3.26Å
188	V	98.7	Very high	98.4	Very high	6 Å²	6	68 Å²	68	4%	0.036	34%	0.336	C	S	.	.	H	α-helix	trans	-57.8	-49.7	-178.7	169.3	0	0	0	0	110.7	V100 P103 L104 D184 I185 E191 F192	V100-V188 HydrophobicContact CG1-CG1 3.83Å; P103-V188 HydrophobicContact CB-CG2 3.9Å; L104-V188 HydrophobicContact CD1-CG1 4.13Å; L104-V188 HydrophobicContact CD2-CG1 4.33Å; L104-V188 HydrophobicContact CG-CG1 4.1Å; D184-V188 WeakPolarHBondContact O-CB 3.26Å; D184-V188 VanDerWaalsContact O-CG2 3.3Å; D184-V188 WeakPolarHBondContact O-CG2 3.28Å; D184-V188 PolarHBondContact O-N 3.45Å; I185-V188 PolarHBondContact O-N 3.04Å; V188-E191 PolarHBondContact O-N 3.23Å; V188-F192 PolarHBondContact O-N 3.28Å
189	F	98.8	Very high	98.5	Very high	88 Å²	88	66.3 Å²	66.3	39%	0.386	33%	0.329	S	S	.	.	H	α-helix	trans	-69.9	-36.6	179.9	-63.6	-15.9	0	0	0	112.6	M35 F39 I185 K187 F192 V193	M35-F189 HydrophobicContact SD-CE1 3.97Å; M35-F189 HydrophobicContact SD-CZ 3.76Å; F39-F189 HydrophobicContact CE2-CE1 4.46Å; I185-F189 HydrophobicContact CG2-CD2 3.73Å; I185-F189 HydrophobicContact CG2-CE2 3.58Å; I185-F189 HydrophobicContact CG2-CZ 4.3Å; I185-F189 WeakPolarHBondContact O-CB 3.44Å; I185-F189 WeakPolarHBondContact O-CG 3.12Å; I185-F189 PolarHBondContact O-N 3.16Å; K187-F189 PolarHBondContact O-N 3.5Å; F189-F192 PolarHBondContact O-N 3.44Å; F189-V193 WeakPolarHBondContact O-CG2 3.46Å; F189-V193 PolarHBondContact O-N 3.3Å; F189-V193 VanDerWaalsContact O-N 3.13Å
190	G	98.8	Very high	98.5	Very high	34 Å²	34	65.1 Å²	65.1	35%	0.351	33%	0.329	S	S	.	.	H	α-helix	trans	-64.3	-41.4	174.1	0	0	0	0	0	112.9	K186 K187 T194	K186-G190 PolarHBondContact O-N 2.99Å; K187-G190 PolarHBondContact O-N 2.94Å; G190-T194 WeakPolarHBondContact O-CB 3.31Å; G190-T194 PolarHBondContact O-N 3.49Å; G190-T194 PolarHBondContact O-OG1 3.23Å
191	E	98.8	Very high	98.6	Very high	45 Å²	45	64.7 Å²	64.7	21%	0.21	34%	0.337	C	S	.	.	H	α-helix	trans	-66.3	-43.9	175.9	-71.5	-71.4	175.4	0	0	111.1	R99 K187 V188 V193 T194 V195	R99-E191 HydrophobicContact CB-CB 4.04Å; R99-E191 HydrophobicContact CB-CG 4.34Å; R99-E191 WeakPolarHBondContact CD-OE2 3.26Å; R99-E191 IonicContact CZ-OE2 2.69Å; R99-E191 IonicContact NE-OE2 2.61Å; R99-E191 IonicContact NH1-OE1 3.82Å; R99-E191 IonicContact NH1-OE2 3.67Å; R99-E191 PolarHBondContact NH1-OE2 3.41Å; K187-E191 HydrophobicContact CG-CG 4.27Å; K187-E191 WeakPolarHBondContact O-CB 3.45Å; K187-E191 VanDerWaalsContact O-CG 3.25Å; K187-E191 WeakPolarHBondContact O-CG 3.02Å; K187-E191 PolarHBondContact O-N 3.26Å; V188-E191 PolarHBondContact O-N 3.23Å; E191-V193 PolarHBondContact O-N 2.94Å; E191-T194 PolarHBondContact O-N 2.98Å; E191-T194 VanDerWaalsContact O-N 3.16Å; E191-V195 WeakPolarHBondContact O-CB 3.37Å; E191-V195 VanDerWaalsContact O-CG2 3.27Å; E191-V195 WeakPolarHBondContact O-CG2 3.23Å; E191-V195 PolarHBondContact O-N 3.47Å
192	F	98.9	Very high	98.6	Very high	48 Å²	48	66.6 Å²	66.6	21%	0.211	35%	0.345	C	S	.	.	H	α-helix	trans	-52.9	-56	174.8	173.3	-111.1	0	0	0	111.4	F39 Y42 L96 V100 V188 F189 T194 V195 E196	F39-F192 HydrophobicContact CD1-CD2 4.23Å; F39-F192 HydrophobicContact CD1-CE2 4.31Å; F39-F192 HydrophobicContact CE1-CD1 4.25Å; F39-F192 AromaticContact CE1-CD2 3.66Å; F39-F192 HydrophobicContact CE1-CD2 3.66Å; F39-F192 HydrophobicContact CE1-CE1 4.36Å; F39-F192 AromaticContact CE1-CE2 3.8Å; F39-F192 HydrophobicContact CE1-CE2 3.8Å; F39-F192 AromaticContact CE1-CG 3.91Å; F39-F192 HydrophobicContact CE1-CG 3.91Å; F39-F192 HydrophobicContact CE1-CZ 4.15Å; F39-F192 HydrophobicContact CZ-CG 4.4Å; Y42-F192 HydrophobicContact CE1-CE2 4.15Å; L96-F192 HydrophobicContact CD2-CD2 3.58Å; L96-F192 HydrophobicContact CD2-CE2 3.92Å; V100-F192 HydrophobicContact CG2-CB 3.86Å; V100-F192 HydrophobicContact CG2-CD2 4.5Å; V188-F192 PolarHBondContact O-N 3.28Å; F189-F192 PolarHBondContact O-N 3.44Å; F192-T194 VanDerWaalsContact C-N 3.28Å; F192-T194 PolarHBondContact O-N 3.39Å; F192-V195 PolarHBondContact O-N 2.9Å; F192-V195 VanDerWaalsContact O-N 3.16Å; F192-E196 HydrophobicContact CD2-CG 4.23Å; F192-E196 HydrophobicContact CE1-CG 4.33Å; F192-E196 HydrophobicContact CE2-CG 3.74Å; F192-E196 HydrophobicContact CZ-CG 3.8Å; F192-E196 WeakPolarHBondContact O-CG 3.46Å; F192-E196 PolarHBondContact O-N 3.4Å; F192-E196 VanDerWaalsContact O-N 3.08Å
193	V	98.9	Very high	98.7	Very high	75 Å²	75	62.1 Å²	62.1	46%	0.455	32%	0.323	S	S	.	.	H	α-helix	trans	-58.8	-40.7	178.8	173.7	0	0	0	0	111.5	F189 E191 V195 M197	F189-V193 WeakPolarHBondContact O-CG2 3.46Å; F189-V193 PolarHBondContact O-N 3.3Å; F189-V193 VanDerWaalsContact O-N 3.13Å; E191-V193 PolarHBondContact O-N 2.94Å; V193-V195 PolarHBondContact O-N 2.79Å; V193-M197 HydrophobicContact CG1-CG 4.18Å; V193-M197 HydrophobicContact CG1-SD 3.8Å; V193-M197 VanDerWaalsContact O-CB 3.31Å; V193-M197 WeakPolarHBondContact O-CB 3.07Å; V193-M197 WeakPolarHBondContact O-CG 3.28Å; V193-M197 PolarHBondContact O-N 2.94Å
194	T	98.8	Very high	98.7	Very high	72 Å²	72	63.1 Å²	63.1	44%	0.442	33%	0.331	S	S	.	.	H	α-helix	trans	-66.9	-37.1	-179.7	-58.1	0	0	0	0	112.2	G190 E191 F192 S198	G190-T194 WeakPolarHBondContact O-CB 3.31Å; G190-T194 PolarHBondContact O-N 3.49Å; G190-T194 PolarHBondContact O-OG1 3.23Å; E191-T194 PolarHBondContact O-N 2.98Å; E191-T194 VanDerWaalsContact O-N 3.16Å; F192-T194 VanDerWaalsContact C-N 3.28Å; F192-T194 PolarHBondContact O-N 3.39Å; T194-S198 WeakPolarHBondContact O-CB 3.41Å; T194-S198 PolarHBondContact O-N 3.28Å; T194-S198 PolarHBondContact O-OG 3.12Å
195	V	98.8	Very high	98.7	Very high	5 Å²	5	66.5 Å²	66.5	3%	0.03	35%	0.346	C	S	.	.	H	α-helix	trans	-64.7	-52.6	176.7	169.9	0	0	0	0	110.2	E92 R95 L96 E191 F192 V193 M197 S198 F199	E92-V195 HydrophobicContact CG-CG1 4.06Å; R95-V195 HydrophobicContact CB-CG1 3.9Å; R95-V195 HydrophobicContact CB-CG2 3.72Å; L96-V195 HydrophobicContact CD2-CB 4.39Å; L96-V195 HydrophobicContact CD2-CG1 3.94Å; L96-V195 HydrophobicContact CG-CG1 3.98Å; E191-V195 WeakPolarHBondContact O-CB 3.37Å; E191-V195 VanDerWaalsContact O-CG2 3.27Å; E191-V195 WeakPolarHBondContact O-CG2 3.23Å; E191-V195 PolarHBondContact O-N 3.47Å; F192-V195 PolarHBondContact O-N 2.9Å; F192-V195 VanDerWaalsContact O-N 3.16Å; V193-V195 PolarHBondContact O-N 2.79Å; V195-M197 PolarHBondContact O-N 2.91Å; V195-S198 WeakPolarHBondContact O-CB 3.41Å; V195-S198 PolarHBondContact O-N 2.96Å; V195-S198 VanDerWaalsContact O-N 3.14Å; V195-F199 PolarHBondContact O-N 3.44Å
196	E	98.7	Very high	98.7	Very high	20 Å²	20	64.2 Å²	64.2	9%	0.093	33%	0.334	C	S	.	.	H	α-helix	trans	-57.9	-47.9	177.4	-66.8	-66	143.7	0	0	111.6	Y42 F192 S198 F199 H200	Y42-E196 WeakPolarHBondContact CE1-OE1 3.49Å; Y42-E196 PolarHBondContact OH-OE1 3.22Å; Y42-E196 PolarHBondContact OH-OE2 2.71Å; F192-E196 HydrophobicContact CD2-CG 4.23Å; F192-E196 HydrophobicContact CE1-CG 4.33Å; F192-E196 HydrophobicContact CE2-CG 3.74Å; F192-E196 HydrophobicContact CZ-CG 3.8Å; F192-E196 WeakPolarHBondContact O-CG 3.46Å; F192-E196 PolarHBondContact O-N 3.4Å; F192-E196 VanDerWaalsContact O-N 3.08Å; E196-S198 VanDerWaalsContact C-N 3.27Å; E196-S198 PolarHBondContact O-N 3.15Å; E196-F199 PolarHBondContact O-N 2.92Å; E196-H200 WeakPolarHBondContact O-CB 3.19Å; E196-H200 PolarHBondContact O-CD2 2.76Å; E196-H200 PolarHBondContact O-N 2.79Å; E196-H200 IonicContact OE2-NE2 3.11Å
197	M	98.8	Very high	98.7	Very high	127 Å²	127	61.4 Å²	61.4	63%	0.626	32%	0.32	S	S	*	.	H	α-helix	trans	-58.5	-40.6	177.4	-77.1	-179.2	68.8	0	0	112.2	V193 V195 A201	V193-M197 HydrophobicContact CG1-CG 4.18Å; V193-M197 HydrophobicContact CG1-SD 3.8Å; V193-M197 VanDerWaalsContact O-CB 3.31Å; V193-M197 WeakPolarHBondContact O-CB 3.07Å; V193-M197 WeakPolarHBondContact O-CG 3.28Å; V193-M197 PolarHBondContact O-N 2.94Å; V195-M197 PolarHBondContact O-N 2.91Å; M197-A201 VanDerWaalsContact O-CB 3.28Å; M197-A201 WeakPolarHBondContact O-CB 3.32Å; M197-A201 PolarHBondContact O-N 2.9Å
198	S	98.4	Very high	98.7	Very high	50 Å²	50	58.4 Å²	58.4	35%	0.35	31%	0.312	S	S	.	.	H	α-helix	trans	-66.3	-42.8	179.7	-61.6	0	0	0	0	111.6	T194 V195 E196 K202	T194-S198 WeakPolarHBondContact O-CB 3.41Å; T194-S198 PolarHBondContact O-N 3.28Å; T194-S198 PolarHBondContact O-OG 3.12Å; V195-S198 WeakPolarHBondContact O-CB 3.41Å; V195-S198 PolarHBondContact O-N 2.96Å; V195-S198 VanDerWaalsContact O-N 3.14Å; E196-S198 VanDerWaalsContact C-N 3.27Å; E196-S198 PolarHBondContact O-N 3.15Å; S198-K202 PolarHBondContact O-N 3.35Å
199	F	98.8	Very high	98.7	Very high	13 Å²	13	60.8 Å²	60.8	6%	0.057	33%	0.327	C	S	.	.	H	α-helix	trans	-63.6	-53.9	175.2	171.4	-104.5	0	0	0	110.9	I85 R89 E92 V195 E196 A201 K202 A203	I85-F199 HydrophobicContact CG2-CE2 4.3Å; I85-F199 HydrophobicContact CG2-CZ 4.21Å; R89-F199 HydrophobicContact CB-CD2 4.5Å; R89-F199 HydrophobicContact CB-CE2 3.79Å; R89-F199 HydrophobicContact CB-CZ 4.31Å; R89-F199 HydrophobicContact CG-CE2 4.5Å; R89-F199 VanDerWaalsContact NH2-CZ 3.31Å; E92-F199 HydrophobicContact CB-CB 4.16Å; E92-F199 HydrophobicContact CB-CD2 4.26Å; E92-F199 HydrophobicContact CB-CG 4.29Å; E92-F199 VanDerWaalsContact CD-CG 3.44Å; E92-F199 HydrophobicContact CG-CB 4.24Å; E92-F199 HydrophobicContact CG-CG 4.41Å; E92-F199 WeakPolarHBondContact OE1-CB 3.17Å; E92-F199 WeakPolarHBondContact OE1-CD1 3.43Å; E92-F199 VanDerWaalsContact OE1-CG 3.23Å; E92-F199 WeakPolarHBondContact OE1-CG 3.38Å; E92-F199 WeakPolarHBondContact OE2-CD1 3.4Å; E92-F199 WeakPolarHBondContact OE2-CG 3.35Å; V195-F199 PolarHBondContact O-N 3.44Å; E196-F199 PolarHBondContact O-N 2.92Å; F199-A201 VanDerWaalsContact C-N 3.32Å; F199-A201 PolarHBondContact O-N 3.12Å; F199-K202 CarbonylContact O-C 3.45Å; F199-K202 PolarHBondContact O-N 2.9Å; F199-A203 HydrophobicContact CE1-CB 4.18Å; F199-A203 HydrophobicContact CE2-CB 4.43Å; F199-A203 HydrophobicContact CZ-CB 4.01Å; F199-A203 WeakPolarHBondContact O-CB 3.35Å; F199-A203 PolarHBondContact O-N 3.24Å
200	H	98.8	Very high	98.7	Very high	108 Å²	108	56.7 Å²	56.7	50%	0.5	31%	0.309	S	S	.	.	H	α-helix	trans	-59.5	-39.4	-177.7	-73.6	-49	0	0	0	113.4	E196 K202 A203 L204	E196-H200 WeakPolarHBondContact O-CB 3.19Å; E196-H200 PolarHBondContact O-CD2 2.76Å; E196-H200 PolarHBondContact O-N 2.79Å; E196-H200 IonicContact OE2-NE2 3.11Å; H200-K202 VanDerWaalsContact C-N 3.32Å; H200-K202 PolarHBondContact O-N 3.47Å; H200-A203 PolarHBondContact O-N 3.46Å; H200-L204 WeakPolarHBondContact O-CB 3.48Å; H200-L204 PolarHBondContact O-N 3.23Å
201	A	98.8	Very high	98.7	Very high	61 Å²	61	61 Å²	61	50%	0.504	32%	0.319	S	S	.	.	H	α-helix	trans	-60.7	-43	175.4	0	0	0	0	0	111.7	M197 F199 E205	M197-A201 VanDerWaalsContact O-CB 3.28Å; M197-A201 WeakPolarHBondContact O-CB 3.32Å; M197-A201 PolarHBondContact O-N 2.9Å; F199-A201 VanDerWaalsContact C-N 3.32Å; F199-A201 PolarHBondContact O-N 3.12Å; A201-E205 PolarHBondContact O-N 3.32Å; A201-E205 VanDerWaalsContact O-N 3.16Å
202	K	98.4	Very high	98.6	Very high	72 Å²	72	64.2 Å²	64.2	31%	0.313	33%	0.333	S	S	.	.	H	α-helix	trans	-72.1	-39.1	177	-75.3	-55.7	-173.2	-174.1	0	113.3	Y88 S198 F199 H200 L204 E205 I206	Y88-K202 HydrophobicContact CD1-CB 4.24Å; Y88-K202 HydrophobicContact CD1-CG 4.23Å; Y88-K202 HydrophobicContact CD2-CB 4.44Å; Y88-K202 HydrophobicContact CE1-CB 4.45Å; Y88-K202 HydrophobicContact CE1-CG 4.08Å; Y88-K202 HydrophobicContact CG-CB 4.25Å; S198-K202 PolarHBondContact O-N 3.35Å; F199-K202 CarbonylContact O-C 3.45Å; F199-K202 PolarHBondContact O-N 2.9Å; H200-K202 VanDerWaalsContact C-N 3.32Å; H200-K202 PolarHBondContact O-N 3.47Å; K202-L204 VanDerWaalsContact C-N 3.34Å; K202-L204 PolarHBondContact O-N 3.46Å; K202-E205 WeakPolarHBondContact CD-OE2 3.14Å; K202-E205 IonicContact NZ-OE1 2.72Å; K202-E205 IonicContact NZ-OE2 2.64Å; K202-E205 PolarHBondContact NZ-OE2 3.49Å; K202-E205 PolarHBondContact O-N 3.05Å; K202-I206 WeakPolarHBondContact O-CD1 3.4Å; K202-I206 VanDerWaalsContact O-CG1 3.26Å; K202-I206 WeakPolarHBondContact O-CG1 3.32Å; K202-I206 PolarHBondContact O-N 3.42Å
203	A	98.6	Very high	98.5	Very high	6 Å²	6	62.4 Å²	62.4	5%	0.05	33%	0.327	C	S	.	.	H	α-helix	trans	-58.9	-47.9	173.9	0	0	0	0	0	110.5	F199 H200 E205 I206 Y207	F199-A203 HydrophobicContact CE1-CB 4.18Å; F199-A203 HydrophobicContact CE2-CB 4.43Å; F199-A203 HydrophobicContact CZ-CB 4.01Å; F199-A203 WeakPolarHBondContact O-CB 3.35Å; F199-A203 PolarHBondContact O-N 3.24Å; H200-A203 PolarHBondContact O-N 3.46Å; A203-E205 PolarHBondContact O-N 3.39Å; A203-I206 PolarHBondContact O-N 3.02Å; A203-Y207 HydrophobicContact CB-CD2 4.08Å; A203-Y207 HydrophobicContact CB-CE2 4.03Å; A203-Y207 VanDerWaalsContact O-CB 3.31Å; A203-Y207 WeakPolarHBondContact O-CB 3.09Å; A203-Y207 WeakPolarHBondContact O-CD2 3.18Å; A203-Y207 PolarHBondContact O-N 3Å
204	L	98.8	Very high	98.4	Very high	119 Å²	119	61.4 Å²	61.4	62%	0.623	32%	0.319	S	S	*	.	H	α-helix	trans	-59.9	-46.6	178.6	-179.8	62.9	0	0	0	112.5	H200 K202 I206 T208	H200-L204 WeakPolarHBondContact O-CB 3.48Å; H200-L204 PolarHBondContact O-N 3.23Å; K202-L204 VanDerWaalsContact C-N 3.34Å; K202-L204 PolarHBondContact O-N 3.46Å; L204-I206 VanDerWaalsContact C-N 3.32Å; L204-I206 PolarHBondContact O-N 3.34Å; L204-T208 WeakPolarHBondContact O-CB 3.5Å; L204-T208 PolarHBondContact O-N 2.93Å; L204-T208 VanDerWaalsContact O-N 3.08Å; L204-T208 PolarHBondContact O-OG1 2.88Å
205	E	98.6	Very high	98.4	Very high	105 Å²	105	64.2 Å²	64.2	49%	0.491	33%	0.327	S	S	.	.	H	α-helix	trans	-54.5	-49.1	175.8	-176.8	-173.1	150.9	0	0	110.8	A201 K202 A203	A201-E205 PolarHBondContact O-N 3.32Å; A201-E205 VanDerWaalsContact O-N 3.16Å; K202-E205 WeakPolarHBondContact CD-OE2 3.14Å; K202-E205 IonicContact NZ-OE1 2.72Å; K202-E205 IonicContact NZ-OE2 2.64Å; K202-E205 PolarHBondContact NZ-OE2 3.49Å; K202-E205 PolarHBondContact O-N 3.05Å; A203-E205 PolarHBondContact O-N 3.39Å
206	I	98.7	Very high	98.3	Very high	8 Å²	8	67.6 Å²	67.6	4%	0.041	35%	0.35	C	S	.	.	H	α-helix	trans	-77.4	-40.5	-174	-60.3	162.7	0	0	0	111.9	H81 K84 I85 Y88 K202 A203 L204 T208 V209 A210	H81-I206 HydrophobicContact CB-CG2 3.94Å; H81-I206 WeakPolarHBondContact O-CG2 3.39Å; K84-I206 HydrophobicContact CD-CD1 4.08Å; K84-I206 HydrophobicContact CG-CD1 4.07Å; I85-I206 HydrophobicContact CD1-CB 4.1Å; I85-I206 HydrophobicContact CD1-CG2 3.86Å; I85-I206 HydrophobicContact CG1-CB 3.8Å; I85-I206 HydrophobicContact CG1-CD1 4.21Å; I85-I206 HydrophobicContact CG1-CG2 3.58Å; Y88-I206 HydrophobicContact CD2-CD1 3.52Å; Y88-I206 HydrophobicContact CE2-CD1 3.38Å; K202-I206 WeakPolarHBondContact O-CD1 3.4Å; K202-I206 VanDerWaalsContact O-CG1 3.26Å; K202-I206 WeakPolarHBondContact O-CG1 3.32Å; K202-I206 PolarHBondContact O-N 3.42Å; A203-I206 PolarHBondContact O-N 3.02Å; L204-I206 VanDerWaalsContact C-N 3.32Å; L204-I206 PolarHBondContact O-N 3.34Å; I206-T208 PolarHBondContact O-N 3.5Å; I206-V209 PolarHBondContact O-N 3.43Å; I206-A210 PolarHBondContact O-N 3.23Å
207	Y	98.8	Very high	98.2	Very high	96 Å²	96	67.9 Å²	67.9	38%	0.376	35%	0.353	S	S	.	.	H	α-helix	trans	-60.2	-34	175.4	-81.2	-55	0	0	0	111.8	L82 I85 A203 V209 A210 F211	L82-Y207 HydrophobicContact CD1-CE1 4Å; I85-Y207 HydrophobicContact CD1-CD1 3.36Å; I85-Y207 HydrophobicContact CD1-CD2 3.79Å; I85-Y207 HydrophobicContact CD1-CE1 3.26Å; I85-Y207 HydrophobicContact CD1-CE2 3.7Å; I85-Y207 HydrophobicContact CD1-CG 3.61Å; I85-Y207 VanDerWaalsContact CD1-CZ 3.43Å; I85-Y207 HydrophobicContact CG2-CE2 4.25Å; A203-Y207 HydrophobicContact CB-CD2 4.08Å; A203-Y207 HydrophobicContact CB-CE2 4.03Å; A203-Y207 VanDerWaalsContact O-CB 3.31Å; A203-Y207 WeakPolarHBondContact O-CB 3.09Å; A203-Y207 WeakPolarHBondContact O-CD2 3.18Å; A203-Y207 PolarHBondContact O-N 3Å; Y207-V209 VanDerWaalsContact C-N 3.32Å; Y207-V209 PolarHBondContact O-N 3.26Å; Y207-A210 PolarHBondContact O-N 3.45Å; Y207-F211 WeakPolarHBondContact O-CB 3.47Å; Y207-F211 PolarHBondContact O-N 3.3Å
208	T	98.6	Very high	98.1	Very high	68 Å²	68	65.7 Å²	65.7	42%	0.417	34%	0.344	S	S	.	.	H	α-helix	trans	-61.5	-42.2	174.3	-58.4	0	0	0	0	111.2	L204 I206 Q212	L204-T208 WeakPolarHBondContact O-CB 3.5Å; L204-T208 PolarHBondContact O-N 2.93Å; L204-T208 VanDerWaalsContact O-N 3.08Å; L204-T208 PolarHBondContact O-OG1 2.88Å; I206-T208 PolarHBondContact O-N 3.5Å; T208-Q212 VanDerWaalsContact O-CG 3.31Å; T208-Q212 WeakPolarHBondContact O-CG 3.21Å; T208-Q212 PolarHBondContact O-N 3.08Å; T208-Q212 VanDerWaalsContact O-N 3.11Å
209	V	98.3	Very high	98	Very high	57 Å²	57	70.6 Å²	70.6	35%	0.345	36%	0.362	S	S	.	.	H	α-helix	trans	-73.9	-37.9	177.8	-174.3	0	0	0	0	111.6	H81 I206 Y207 F211 Q212 S213	H81-V209 WeakPolarHBondContact CE1-CG1 3.31Å; I206-V209 PolarHBondContact O-N 3.43Å; Y207-V209 VanDerWaalsContact C-N 3.32Å; Y207-V209 PolarHBondContact O-N 3.26Å; V209-F211 VanDerWaalsContact C-N 3.32Å; V209-F211 PolarHBondContact O-N 3.16Å; V209-Q212 PolarHBondContact O-N 3.45Å; V209-S213 PolarHBondContact O-N 2.92Å; V209-S213 PolarHBondContact O-OG 2.86Å
210	A	98.4	Very high	97.9	Very high	1 Å²	1	74.2 Å²	74.2	1%	0.008	38%	0.379	C	S	.	.	H	α-helix	trans	-58.2	-46.9	173.6	0	0	0	0	0	110.8	F78 H81 I206 Y207 Q212 S213 I214	F78-A210 HydrophobicContact CD2-CB 3.88Å; F78-A210 WeakPolarHBondContact CD2-O 3.45Å; F78-A210 HydrophobicContact CE2-CB 4.04Å; H81-A210 HydrophobicContact CB-CB 3.67Å; I206-A210 PolarHBondContact O-N 3.23Å; Y207-A210 PolarHBondContact O-N 3.45Å; A210-Q212 PolarHBondContact O-N 2.88Å; A210-S213 WeakPolarHBondContact O-CB 3.26Å; A210-S213 PolarHBondContact O-N 3.38Å; A210-S213 VanDerWaalsContact O-N 3.16Å; A210-I214 PolarHBondContact O-N 2.84Å
211	F	98.4	Very high	97.6	Very high	125 Å²	125	70.4 Å²	70.4	55%	0.548	37%	0.366	S	S	.	.	H	α-helix	trans	-58.8	-45.7	175.5	179.4	-99.1	0	0	0	111.8	Y207 V209 S213 I214 Q215	Y207-F211 WeakPolarHBondContact O-CB 3.47Å; Y207-F211 PolarHBondContact O-N 3.3Å; V209-F211 VanDerWaalsContact C-N 3.32Å; V209-F211 PolarHBondContact O-N 3.16Å; F211-S213 VanDerWaalsContact C-N 3.3Å; F211-S213 PolarHBondContact O-N 3.26Å; F211-I214 VanDerWaalsContact O-CG2 3.26Å; F211-I214 WeakPolarHBondContact O-CG2 3.43Å; F211-I214 PolarHBondContact O-N 3.27Å; F211-Q215 HydrophobicContact CD1-CG 4.04Å; F211-Q215 HydrophobicContact CD2-CG 4.24Å; F211-Q215 HydrophobicContact CE1-CG 3.64Å; F211-Q215 HydrophobicContact CE2-CG 3.85Å; F211-Q215 HydrophobicContact CG-CG 4.33Å; F211-Q215 HydrophobicContact CZ-CG 3.54Å; F211-Q215 WeakPolarHBondContact O-CB 3.26Å; F211-Q215 WeakPolarHBondContact O-CG 3.42Å; F211-Q215 PolarHBondContact O-N 2.75Å
212	Q	98.1	Very high	97.4	Very high	112 Å²	112	68 Å²	68	52%	0.523	35%	0.345	S	S	.	.	H	α-helix	trans	-60.9	-39	176.2	-71.9	169.2	6	0	0	112.4	T208 V209 A210 I214 Q215 S216	T208-Q212 VanDerWaalsContact O-CG 3.31Å; T208-Q212 WeakPolarHBondContact O-CG 3.21Å; T208-Q212 PolarHBondContact O-N 3.08Å; T208-Q212 VanDerWaalsContact O-N 3.11Å; V209-Q212 PolarHBondContact O-N 3.45Å; A210-Q212 PolarHBondContact O-N 2.88Å; Q212-I214 PolarHBondContact O-N 2.55Å; Q212-Q215 PolarHBondContact O-N 3.19Å; Q212-S216 VanDerWaalsContact O-CB 3.26Å; Q212-S216 WeakPolarHBondContact O-CB 3.19Å; Q212-S216 PolarHBondContact O-N 3.34Å; Q212-S216 PolarHBondContact O-OG 2.72Å
213	S	97.1	Very high	97.2	Very high	10 Å²	10	68.3 Å²	68.3	7%	0.07	35%	0.349	C	S	.	.	H	α-helix	trans	-59.4	-47.8	-179.3	-56.8	0	0	0	0	111.4	H81 V209 A210 F211 S216	H81-S213 PolarHBondContact CD2-OG 2.79Å; H81-S213 PolarHBondContact NE2-OG 3.07Å; V209-S213 PolarHBondContact O-N 2.92Å; V209-S213 PolarHBondContact O-OG 2.86Å; A210-S213 WeakPolarHBondContact O-CB 3.26Å; A210-S213 PolarHBondContact O-N 3.38Å; A210-S213 VanDerWaalsContact O-N 3.16Å; F211-S213 VanDerWaalsContact C-N 3.3Å; F211-S213 PolarHBondContact O-N 3.26Å; S213-S216 PolarHBondContact O-N 2.95Å; S213-S216 PolarHBondContact O-OG 2.83Å
214	I	96.9	Very high	97	Very high	55 Å²	55	73.1 Å²	73.1	28%	0.282	37%	0.371	S	S	.	.	H	α-helix	trans	-73.3	-34.9	179.3	-166.4	63.2	0	0	0	112.6	M75 F78 A210 F211 Q212 S216 V217	M75-I214 HydrophobicContact CG-CD1 4.21Å; F78-I214 HydrophobicContact CD2-CB 4.36Å; F78-I214 HydrophobicContact CD2-CG2 4.34Å; A210-I214 PolarHBondContact O-N 2.84Å; F211-I214 VanDerWaalsContact O-CG2 3.26Å; F211-I214 WeakPolarHBondContact O-CG2 3.43Å; F211-I214 PolarHBondContact O-N 3.27Å; Q212-I214 PolarHBondContact O-N 2.55Å; I214-S216 PolarHBondContact O-N 2.64Å; I214-V217 HydrophobicContact CD1-CG2 4.26Å; I214-V217 WeakPolarHBondContact O-CG2 3.08Å; I214-V217 PolarHBondContact O-N 3.24Å
215	Q	97.9	Very high	96.6	Very high	131 Å²	131	70.3 Å²	70.3	61%	0.612	36%	0.358	S	S	*	.	H	α-helix	trans	-72.1	-17.5	177	-67.5	-63.4	-65.9	0	0	113.4	F211 Q212 V217	F211-Q215 HydrophobicContact CD1-CG 4.04Å; F211-Q215 HydrophobicContact CD2-CG 4.24Å; F211-Q215 HydrophobicContact CE1-CG 3.64Å; F211-Q215 HydrophobicContact CE2-CG 3.85Å; F211-Q215 HydrophobicContact CG-CG 4.33Å; F211-Q215 HydrophobicContact CZ-CG 3.54Å; F211-Q215 WeakPolarHBondContact O-CB 3.26Å; F211-Q215 WeakPolarHBondContact O-CG 3.42Å; F211-Q215 PolarHBondContact O-N 2.75Å; Q212-Q215 PolarHBondContact O-N 3.19Å; Q215-V217 VanDerWaalsContact C-N 3.32Å
216	S	96	Very high	96.2	Very high	75 Å²	75	70.8 Å²	70.8	52%	0.524	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	3.8	178.9	71.9	0	0	0	0	114.3	Q212 S213 I214 D218	Q212-S216 VanDerWaalsContact O-CB 3.26Å; Q212-S216 WeakPolarHBondContact O-CB 3.19Å; Q212-S216 PolarHBondContact O-N 3.34Å; Q212-S216 PolarHBondContact O-OG 2.72Å; S213-S216 PolarHBondContact O-N 2.95Å; S213-S216 PolarHBondContact O-OG 2.83Å; I214-S216 PolarHBondContact O-N 2.64Å; S216-D218 PolarHBondContact O-N 3.43Å
217	V	97.2	Very high	96	Very high	26 Å²	26	75.5 Å²	75.5	16%	0.158	38%	0.376	C	S	.	.			trans	-63.9	130.5	175.3	173.5	0	0	0	0	109.6	L71 I214 Q215 E219	L71-V217 HydrophobicContact CB-CG1 4.18Å; L71-V217 HydrophobicContact CD1-CG1 4.27Å; L71-V217 HydrophobicContact CD1-CG2 4.43Å; I214-V217 HydrophobicContact CD1-CG2 4.26Å; I214-V217 WeakPolarHBondContact O-CG2 3.08Å; I214-V217 PolarHBondContact O-N 3.24Å; Q215-V217 VanDerWaalsContact C-N 3.32Å; V217-E219 PolarHBondContact O-N 3.43Å
218	D	96.3	Very high	95.5	Very high	82 Å²	82	76.3 Å²	76.3	44%	0.439	39%	0.387	S	S	.	.			trans	-86.1	97.5	175.1	-170.9	-20.1	0	0	0	109.6	S216 E220 A221 D222	S216-D218 PolarHBondContact O-N 3.43Å; D218-E220 VanDerWaalsContact C-N 3.3Å; D218-E220 PolarHBondContact O-N 3.34Å; D218-E220 PolarHBondContact OD1-N 3.05Å; D218-E220 VanDerWaalsContact OD1-N 3.1Å; D218-A221 HydrophobicContact CB-CB 3.97Å; D218-A221 PolarHBondContact OD1-N 3.46Å; D218-A221 VanDerWaalsContact OD1-N 3.16Å; D218-D222 PolarHBondContact O-N 3.31Å
219	E	96.3	Very high	94.9	Very high	153 Å²	153	77.5 Å²	77.5	72%	0.715	40%	0.397	S	S	*	.	H	α-helix	trans	-62.2	-36.6	-179.3	-61.6	174.9	-175.7	0	0	112.2	V217 D222 L223	V217-E219 PolarHBondContact O-N 3.43Å; E219-D222 PolarHBondContact O-N 2.72Å; E219-L223 WeakPolarHBondContact O-CB 3.48Å; E219-L223 WeakPolarHBondContact O-CG 3.42Å; E219-L223 PolarHBondContact O-N 3.38Å
220	E	96.6	Very high	94.4	Very high	88 Å²	88	79.7 Å²	79.7	41%	0.411	41%	0.406	S	S	.	.	H	α-helix	trans	-73.9	-38.9	-175	-173.7	62.6	-169.3	0	0	111	D218 D222 L223 E224 R227	D218-E220 VanDerWaalsContact C-N 3.3Å; D218-E220 PolarHBondContact O-N 3.34Å; D218-E220 PolarHBondContact OD1-N 3.05Å; D218-E220 VanDerWaalsContact OD1-N 3.1Å; E220-D222 VanDerWaalsContact C-N 3.29Å; E220-D222 PolarHBondContact O-N 2.67Å; E220-L223 PolarHBondContact O-N 2.94Å; E220-E224 WeakPolarHBondContact O-CG 3.35Å; E220-E224 PolarHBondContact O-N 3.37Å; E220-R227 IonicContact OE1-CZ 3.23Å; E220-R227 IonicContact OE1-NH1 3.6Å; E220-R227 PolarHBondContact OE1-NH1 3.11Å; E220-R227 IonicContact OE1-NH2 2.67Å; E220-R227 PolarHBondContact OE1-NH2 2.99Å; E220-R227 IonicContact OE2-CZ 3.04Å; E220-R227 IonicContact OE2-NH1 3.4Å; E220-R227 IonicContact OE2-NH2 3.86Å; E220-R227 PolarHBondContact OE2-NH2 3.35Å
221	A	93.9	Very high	93.7	Very high	28 Å²	28	86.6 Å²	86.6	23%	0.231	44%	0.438	C	S	.	.	H	α-helix	trans	-56.9	-44.1	173.5	0	0	0	0	0	111.9	D218 E224 V225	D218-A221 HydrophobicContact CB-CB 3.97Å; D218-A221 PolarHBondContact OD1-N 3.46Å; D218-A221 VanDerWaalsContact OD1-N 3.16Å; A221-E224 PolarHBondContact O-N 3.2Å; A221-V225 PolarHBondContact O-N 3.41Å
222	D	93.9	Very high	92.3	Very high	12 Å²	12	84.7 Å²	84.7	6%	0.064	44%	0.438	C	S	.	.	H	α-helix	trans	-73.4	-36.5	178.5	-85.5	-8.8	0	0	0	112.9	T68 D70 L71 D218 E219 E220 E224 V225 F226	T68-D222 WeakPolarHBondContact CB-OD1 3.43Å; T68-D222 WeakPolarHBondContact CB-OD2 3.48Å; T68-D222 HydrophobicContact CG2-CB 4.43Å; T68-D222 WeakPolarHBondContact OG1-CB 3.34Å; T68-D222 PolarHBondContact OG1-OD1 3.41Å; T68-D222 PolarHBondContact OG1-OD2 3.45Å; D70-D222 WeakPolarHBondContact CB-OD1 3.43Å; D70-D222 PolarHBondContact N-OD1 3.06Å; L71-D222 WeakPolarHBondContact CA-OD2 3.34Å; L71-D222 WeakPolarHBondContact CB-OD2 3.42Å; L71-D222 PolarHBondContact N-OD2 3.45Å; D218-D222 PolarHBondContact O-N 3.31Å; E219-D222 PolarHBondContact O-N 2.72Å; E220-D222 VanDerWaalsContact C-N 3.29Å; E220-D222 PolarHBondContact O-N 2.67Å; D222-E224 VanDerWaalsContact C-N 3.29Å; D222-E224 PolarHBondContact O-N 2.86Å; D222-V225 WeakPolarHBondContact O-CB 3.21Å; D222-V225 PolarHBondContact O-N 2.84Å; D222-F226 PolarHBondContact O-N 3.31Å
223	L	94.9	Very high	90.8	Very high	77 Å²	77	84.4 Å²	84.4	40%	0.403	45%	0.446	S	S	.	.	H	α-helix	trans	-63.7	-34.5	172.6	-73.5	175.1	0	0	0	111.9	E219 E220 F226 R227	E219-L223 WeakPolarHBondContact O-CB 3.48Å; E219-L223 WeakPolarHBondContact O-CG 3.42Å; E219-L223 PolarHBondContact O-N 3.38Å; E220-L223 PolarHBondContact O-N 2.94Å; L223-F226 PolarHBondContact O-N 3.31Å; L223-R227 WeakPolarHBondContact O-CB 3.48Å; L223-R227 WeakPolarHBondContact O-CG 3.43Å; L223-R227 PolarHBondContact O-N 3.01Å
224	E	93.2	Very high	89.3	Confident	108 Å²	108	90 Å²	90	51%	0.505	48%	0.475	S	S	.	.	H	α-helix	trans	-62.3	-42.7	172.5	-76.3	-176.4	-178.1	0	0	111.8	E220 A221 D222 F226 R227 N228	E220-E224 WeakPolarHBondContact O-CG 3.35Å; E220-E224 PolarHBondContact O-N 3.37Å; A221-E224 PolarHBondContact O-N 3.2Å; D222-E224 VanDerWaalsContact C-N 3.29Å; D222-E224 PolarHBondContact O-N 2.86Å; E224-F226 VanDerWaalsContact C-N 3.3Å; E224-F226 PolarHBondContact O-N 3.12Å; E224-R227 PolarHBondContact O-N 3.46Å; E224-N228 WeakPolarHBondContact O-CB 3.34Å; E224-N228 PolarHBondContact O-N 3.29Å; E224-N228 PolarHBondContact O-ND2 3.4Å
225	V	91.3	Very high	87.3	Confident	59 Å²	59	95.2 Å²	95.2	36%	0.358	50%	0.496	S	S	.	.	H	α-helix	trans	-57.5	-46.5	173.6	176	0	0	0	0	110.3	T68 A221 D222 N228 C229	T68-V225 HydrophobicContact CG2-CB 4.35Å; T68-V225 HydrophobicContact CG2-CG1 4.14Å; A221-V225 PolarHBondContact O-N 3.41Å; D222-V225 WeakPolarHBondContact O-CB 3.21Å; D222-V225 PolarHBondContact O-N 2.84Å; V225-N228 PolarHBondContact O-N 3.39Å; V225-C229 PolarHBondContact O-N 3.42Å; V225-C229 PolarHBondContact O-SG 3.42Å; V225-C229 VanDerWaalsContact O-SG 3.41Å
226	F	90.5	Very high	85.3	Confident	116 Å²	116	95.1 Å²	95.1	51%	0.509	50%	0.496	S	S	.	.	H	α-helix	trans	-64.9	-44.8	178.4	-178.9	-105.3	0	0	0	113.1	D222 L223 E224 N228 C229 L230	D222-F226 PolarHBondContact O-N 3.31Å; L223-F226 PolarHBondContact O-N 3.31Å; E224-F226 VanDerWaalsContact C-N 3.3Å; E224-F226 PolarHBondContact O-N 3.12Å; F226-N228 VanDerWaalsContact C-N 3.3Å; F226-N228 PolarHBondContact O-N 3.45Å; F226-C229 WeakPolarHBondContact O-CA 3.4Å; F226-C229 WeakPolarHBondContact O-CB 3.25Å; F226-C229 PolarHBondContact O-N 2.91Å; F226-L230 HydrophobicContact CD1-CD1 3.91Å; F226-L230 HydrophobicContact CD1-CG 4.26Å; F226-L230 HydrophobicContact CE1-CD1 3.36Å; F226-L230 HydrophobicContact CE1-CD2 4.3Å; F226-L230 HydrophobicContact CE1-CG 3.85Å; F226-L230 HydrophobicContact CZ-CD1 3.92Å; F226-L230 HydrophobicContact CZ-CD2 4Å; F226-L230 HydrophobicContact CZ-CG 4.01Å; F226-L230 PolarHBondContact O-N 3.47Å
227	R	92.9	Very high	83.4	Confident	106 Å²	106	94.3 Å²	94.3	40%	0.4	49%	0.49	S	S	.	.	H	α-helix	trans	-61.1	-38.6	177.7	-71.1	166.8	-165.7	162.1	9.5	111.7	E220 L223 E224 C229 L230 H231	E220-R227 IonicContact OE1-CZ 3.23Å; E220-R227 IonicContact OE1-NH1 3.6Å; E220-R227 PolarHBondContact OE1-NH1 3.11Å; E220-R227 IonicContact OE1-NH2 2.67Å; E220-R227 PolarHBondContact OE1-NH2 2.99Å; E220-R227 IonicContact OE2-CZ 3.04Å; E220-R227 IonicContact OE2-NH1 3.4Å; E220-R227 IonicContact OE2-NH2 3.86Å; E220-R227 PolarHBondContact OE2-NH2 3.35Å; L223-R227 WeakPolarHBondContact O-CB 3.48Å; L223-R227 WeakPolarHBondContact O-CG 3.43Å; L223-R227 PolarHBondContact O-N 3.01Å; E224-R227 PolarHBondContact O-N 3.46Å; R227-C229 VanDerWaalsContact C-N 3.27Å; R227-C229 PolarHBondContact O-N 3.33Å; R227-L230 PolarHBondContact O-N 3.05Å; R227-H231 PolarHBondContact O-N 3.2Å
228	N	88.8	Confident	81.4	Confident	114 Å²	114	101.4 Å²	101.4	61%	0.61	51%	0.514	S	S	*	.	H	α-helix	trans	-64.2	-30.7	174.4	-72	-33.6	0	0	0	112.6	E224 V225 F226 H231	E224-N228 WeakPolarHBondContact O-CB 3.34Å; E224-N228 PolarHBondContact O-N 3.29Å; E224-N228 PolarHBondContact O-ND2 3.4Å; V225-N228 PolarHBondContact O-N 3.39Å; F226-N228 VanDerWaalsContact C-N 3.3Å; F226-N228 PolarHBondContact O-N 3.45Å; N228-H231 CarbonylContact O-C 3.59Å
229	C	86.9	Confident	79.5	Confident	93 Å²	93	102 Å²	102	63%	0.628	52%	0.517	S	S	*	.	H	α-helix	trans	-73.5	-36	172.2	-68.1	0	0	0	0	112.7	V225 F226 R227	V225-C229 PolarHBondContact O-N 3.42Å; V225-C229 PolarHBondContact O-SG 3.42Å; V225-C229 VanDerWaalsContact O-SG 3.41Å; F226-C229 WeakPolarHBondContact O-CA 3.4Å; F226-C229 WeakPolarHBondContact O-CB 3.25Å; F226-C229 PolarHBondContact O-N 2.91Å; R227-C229 VanDerWaalsContact C-N 3.27Å; R227-C229 PolarHBondContact O-N 3.33Å
230	L	87.3	Confident	77.7	Confident	102 Å²	102	98.8 Å²	98.8	53%	0.534	51%	0.505	S	S	.	.	H	α-helix	trans	-71.2	-30	177.5	-71.1	-176.9	0	0	0	113.5	F226 R227 P232	F226-L230 HydrophobicContact CD1-CD1 3.91Å; F226-L230 HydrophobicContact CD1-CG 4.26Å; F226-L230 HydrophobicContact CE1-CD1 3.36Å; F226-L230 HydrophobicContact CE1-CD2 4.3Å; F226-L230 HydrophobicContact CE1-CG 3.85Å; F226-L230 HydrophobicContact CZ-CD1 3.92Å; F226-L230 HydrophobicContact CZ-CD2 4Å; F226-L230 HydrophobicContact CZ-CG 4.01Å; F226-L230 PolarHBondContact O-N 3.47Å; R227-L230 PolarHBondContact O-N 3.05Å; L230-P232 VanDerWaalsContact C-CD 3.42Å; L230-P232 VanDerWaalsContact O-CD 3.31Å; L230-P232 WeakPolarHBondContact O-CD 3.48Å
231	H	83	Confident	76	Confident	147 Å²	147	99.4 Å²	99.4	68%	0.681	51%	0.509	S	S	*	.	S	Bend	trans	-118.2	74.1	176.1	-60.4	-61.8	0	0	0	110.2	R227 N228	R227-H231 PolarHBondContact O-N 3.2Å; N228-H231 CarbonylContact O-C 3.59Å
232	P	69.9	Low	74.4	Confident	84 Å²	84	102 Å²	102	55%	0.545	52%	0.523	S	S	.	.			trans	-54.3	138.8	172.3	-17.3	28.4	0	0	0	108.6	L230 D234	L230-P232 VanDerWaalsContact C-CD 3.42Å; L230-P232 VanDerWaalsContact O-CD 3.31Å; L230-P232 WeakPolarHBondContact O-CD 3.48Å; P232-D234 PolarHBondContact O-N 3.41Å
233	P	66.8	Low	72.8	Confident	106 Å²	106	108.4 Å²	108.4	69%	0.688	55%	0.546	S	S	*	.			trans	-52.7	121.4	179.5	18.9	-30	0	0	0	109.2	F235	P233-F235 PolarHBondContact O-N 3.47Å
234	D	63.9	Low	71.1	Confident	128 Å²	128	107.3 Å²	107.3	68%	0.684	55%	0.548	S	S	*	.			trans	-45.8	141.1	-174.9	-84.6	-34.9	0	0	0	110.7	P232 Q236 S237	P232-D234 PolarHBondContact O-N 3.41Å; D234-Q236 HydrophobicContact CB-CB 4.16Å; D234-Q236 PolarHBondContact O-N 3.04Å; D234-S237 WeakPolarHBondContact O-CB 3.31Å; D234-S237 PolarHBondContact O-N 3.24Å
235	F	56.7	Low	69.4	Low	165 Å²	165	107.3 Å²	107.3	72%	0.724	55%	0.551	S	S	*	*	H	α-helix	trans	-48.3	-23.5	171.8	-100.8	-97	0	0	0	112.8	P233 R238 L239	P233-F235 PolarHBondContact O-N 3.47Å; F235-R238 PolarHBondContact O-N 3.38Å; F235-L239 PolarHBondContact O-N 2.97Å; F235-L239 VanDerWaalsContact O-N 3.12Å
236	Q	54.8	Low	67.8	Low	129 Å²	129	107.7 Å²	107.7	60%	0.603	56%	0.557	S	S	*	*	H	α-helix	trans	-59.9	-40.6	172.5	-130.6	74	8.3	0	0	113.5	D234 R238 L239 D240	D234-Q236 HydrophobicContact CB-CB 4.16Å; D234-Q236 PolarHBondContact O-N 3.04Å; Q236-R238 VanDerWaalsContact C-N 3.35Å; Q236-R238 PolarHBondContact O-N 3.43Å; Q236-L239 PolarHBondContact O-N 3.35Å; Q236-D240 PolarHBondContact O-N 2.83Å
237	S	55.5	Low	66.1	Low	58 Å²	58	109.5 Å²	109.5	41%	0.406	56%	0.564	S	S	.	*	H	α-helix	trans	-65.5	-37.8	177	175	0	0	0	0	111.7	D234 D240 I241	D234-S237 WeakPolarHBondContact O-CB 3.31Å; D234-S237 PolarHBondContact O-N 3.24Å; S237-D240 PolarHBondContact O-N 3.03Å; S237-I241 WeakPolarHBondContact O-CG1 3.36Å; S237-I241 PolarHBondContact O-N 3.43Å
238	R	56.1	Low	64.4	Low	175 Å²	175	109.5 Å²	109.5	66%	0.66	58%	0.576	S	S	*	*	H	α-helix	trans	-64.8	-39.4	172.4	-77.7	-172.8	166.7	-167.4	-2.3	112.2	F235 Q236 V242	F235-R238 PolarHBondContact O-N 3.38Å; Q236-R238 VanDerWaalsContact C-N 3.35Å; Q236-R238 PolarHBondContact O-N 3.43Å; R238-V242 WeakPolarHBondContact O-CB 3.2Å; R238-V242 VanDerWaalsContact O-CG2 3.25Å; R238-V242 WeakPolarHBondContact O-CG2 3.49Å; R238-V242 PolarHBondContact O-N 3.05Å
239	L	57.5	Low	62.5	Low	94 Å²	94	108.6 Å²	108.6	49%	0.492	58%	0.579	S	S	.	*	H	α-helix	trans	-69.1	-34	176.2	-71.3	176.9	0	0	0	112.4	F235 Q236 V242 R243	F235-L239 PolarHBondContact O-N 2.97Å; F235-L239 VanDerWaalsContact O-N 3.12Å; Q236-L239 PolarHBondContact O-N 3.35Å; L239-V242 PolarHBondContact O-N 3.45Å; L239-R243 WeakPolarHBondContact O-CA 3.42Å; L239-R243 WeakPolarHBondContact O-CB 3.02Å; L239-R243 PolarHBondContact O-N 3.4Å
240	D	58.5	Low	60.6	Low	86 Å²	86	111 Å²	111	46%	0.46	58%	0.584	S	S	.	*	H	α-helix	trans	-72.9	-33.8	176.7	-76.4	-30	0	0	0	112.7	Q236 S237 R243 A244	Q236-D240 PolarHBondContact O-N 2.83Å; S237-D240 PolarHBondContact O-N 3.03Å; D240-R243 PolarHBondContact O-N 3.1Å; D240-R243 IonicContact OD1-NH1 3.85Å; D240-A244 WeakPolarHBondContact O-CB 3.41Å; D240-A244 PolarHBondContact O-N 3.16Å
241	I	60.8	Low	58.7	Low	100 Å²	100	112.7 Å²	112.7	51%	0.513	59%	0.594	S	S	.	*	H	α-helix	trans	-65.9	-45.1	170	-66.7	166.3	0	0	0	110.9	S237 A244 N245	S237-I241 WeakPolarHBondContact O-CG1 3.36Å; S237-I241 PolarHBondContact O-N 3.43Å; I241-A244 PolarHBondContact O-N 3.3Å; I241-N245 PolarHBondContact O-N 2.81Å; I241-N245 VanDerWaalsContact O-N 3.12Å; I241-N245 PolarHBondContact O-ND2 2.75Å
242	V	59.9	Low	57	Low	84 Å²	84	114.4 Å²	114.4	51%	0.509	60%	0.602	S	S	.	*	H	α-helix	trans	-64.7	-41.8	175.7	172.5	0	0	0	0	110.6	R238 L239 N245 S246	R238-V242 WeakPolarHBondContact O-CB 3.2Å; R238-V242 VanDerWaalsContact O-CG2 3.25Å; R238-V242 WeakPolarHBondContact O-CG2 3.49Å; R238-V242 PolarHBondContact O-N 3.05Å; L239-V242 PolarHBondContact O-N 3.45Å; V242-N245 PolarHBondContact O-N 3.47Å; V242-S246 WeakPolarHBondContact O-CB 3.18Å; V242-S246 PolarHBondContact O-N 3.05Å; V242-S246 PolarHBondContact O-OG 3.43Å
243	R	59.6	Low	55.7	Low	145 Å²	145	117.3 Å²	117.3	55%	0.547	62%	0.618	S	S	.	*	H	α-helix	trans	-68.8	-34.4	178.4	-177.4	-176.6	-73	174	-6.5	112.6	L239 D240 S246 K247	L239-R243 WeakPolarHBondContact O-CA 3.42Å; L239-R243 WeakPolarHBondContact O-CB 3.02Å; L239-R243 PolarHBondContact O-N 3.4Å; D240-R243 PolarHBondContact O-N 3.1Å; D240-R243 IonicContact OD1-NH1 3.85Å; R243-S246 PolarHBondContact O-N 2.89Å; R243-K247 WeakPolarHBondContact O-CG 3.41Å; R243-K247 PolarHBondContact O-N 3.04Å; R243-K247 VanDerWaalsContact O-N 3.09Å
244	A	58.5	Low	54.3	Low	54 Å²	54	115.7 Å²	115.7	45%	0.446	62%	0.621	S	S	.	*	H	α-helix	trans	-65.5	-40.9	172.8	0	0	0	0	0	111.3	D240 I241 K247 T248	D240-A244 WeakPolarHBondContact O-CB 3.41Å; D240-A244 PolarHBondContact O-N 3.16Å; I241-A244 PolarHBondContact O-N 3.3Å; A244-K247 PolarHBondContact O-N 3.09Å; A244-T248 PolarHBondContact O-N 3.28Å
245	N	58.3	Low	53.1	Low	108 Å²	108	113.7 Å²	113.7	58%	0.578	62%	0.617	S	S	*	*	H	α-helix	trans	-73.6	-26.6	174.2	-70.3	-29.3	0	0	0	113.5	I241 V242 T248	I241-N245 PolarHBondContact O-N 2.81Å; I241-N245 VanDerWaalsContact O-N 3.12Å; I241-N245 PolarHBondContact O-ND2 2.75Å; V242-N245 PolarHBondContact O-N 3.47Å; N245-T248 PolarHBondContact O-OG1 3.34Å; N245-T248 VanDerWaalsContact O-OG1 3.06Å
246	S	57.5	Low	52	Low	68 Å²	68	115.1 Å²	115.1	48%	0.476	62%	0.623	S	S	.	*	H	α-helix	trans	-74.7	-24.8	172.8	-58.3	0	0	0	0	113	V242 R243	V242-S246 WeakPolarHBondContact O-CB 3.18Å; V242-S246 PolarHBondContact O-N 3.05Å; V242-S246 PolarHBondContact O-OG 3.43Å; R243-S246 PolarHBondContact O-N 2.89Å
247	K	55.8	Low	51.2	Low	154 Å²	154	116.2 Å²	116.2	67%	0.67	63%	0.633	S	S	*	*	H	α-helix	trans	-81.2	-22.5	176.9	-77.1	-179.4	177.9	-176.4	0	113.3	R243 A244 S249	R243-K247 WeakPolarHBondContact O-CG 3.41Å; R243-K247 PolarHBondContact O-N 3.04Å; R243-K247 VanDerWaalsContact O-N 3.09Å; A244-K247 PolarHBondContact O-N 3.09Å; K247-S249 VanDerWaalsContact C-N 3.31Å
248	T	55.7	Low	50.2	Low	106 Å²	106	118.3 Å²	118.3	65%	0.65	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-4.3	174.6	53.6	0	0	0	0	113.4	A244 N245	A244-T248 PolarHBondContact O-N 3.28Å; N245-T248 PolarHBondContact O-OG1 3.34Å; N245-T248 VanDerWaalsContact O-OG1 3.06Å
249	S	48.7	Very low	49.1	Very low	95 Å²	95	117.1 Å²	117.1	66%	0.664	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-5.9	-176.6	-162.3	0	0	0	0	114.7	K247	K247-S249 VanDerWaalsContact C-N 3.31Å
250	L	48.3	Very low	48.3	Very low	142 Å²	142	118.9 Å²	118.9	74%	0.743	68%	0.68	S	S	*	*	S	Bend	trans	-100.2	-1.4	-176.6	-70.1	179.1	0	0	0	115.9
251	D	47.3	Very low	47.1	Very low	138 Å²	138	118.2 Å²	118.2	74%	0.738	69%	0.693	S	S	*	*	S	Bend	trans	-102.2	17.7	-177.1	-76.7	-26.8	0	0	0	115.5
252	H	47	Very low	46	Very low	184 Å²	184	119.7 Å²	119.7	85%	0.852	71%	0.707	S	S	*	*			trans	-130.1	65.1	170.5	-71.6	-47.2	0	0	0	112.8
253	T	43.5	Very low	44.8	Very low	144 Å²	144	122.2 Å²	122.2	88%	0.883	72%	0.717	S	S	*	*			trans	-100.6	103.7	150.5	45.1	0	0	0	0	108.6
254	G	37.2	Very low	43.7	Very low	72 Å²	72	122.4 Å²	122.4	74%	0.742	72%	0.724	S	S	*	*			trans	-177.2	68.1	-177.6	0	0	0	0	0	114.2
255	S	37.3	Very low	42.7	Very low	86 Å²	86	126.8 Å²	126.8	60%	0.601	74%	0.735	S	S	*	*			trans	67.6	119.5	150.8	-157	0	0	0	0	118.2
256	F	34.6	Very low	41.5	Very low	195 Å²	195	129.1 Å²	129.1	86%	0.855	74%	0.743	S	S	*	*				175.4	150.7	96.8	-91	-72.8	0	0	0	111.5
257	L	37.7	Very low	40.4	Very low	153 Å²	153	137 Å²	137	80%	0.801	76%	0.762	S	S	*	*			trans	-74.6	145.2	-169.9	-67.3	153	0	0	0	113.4
258	S	35.1	Very low	39.3	Very low	102 Å²	102	134 Å²	134	71%	0.713	77%	0.766	S	S	*	*			trans	50.5	124.1	137.6	-53	0	0	0	0	120.5
259	T	33.3	Very low	38.5	Very low	150 Å²	150	135.1 Å²	135.1	92%	0.92	78%	0.778	S	S	*	*				-172.5	141.9	114.6	24	0	0	0	0	111.6
260	S	39.5	Very low	38.1	Very low	130 Å²	130	136.1 Å²	136.1	91%	0.909	79%	0.785	S	S	*	*			trans	-75.5	155.4	176.7	-67.4	0	0	0	0	112.6
261	G	33	Very low	37.6	Very low	72 Å²	72	139.9 Å²	139.9	74%	0.742	79%	0.79	S	S	*	*			trans	173.9	82.6	168.2	0	0	0	0	0	115.1
262	T	39.2	Very low	37.2	Very low	131 Å²	131	140.5 Å²	140.5	80%	0.804	79%	0.788	S	S	*	*			trans	11.4	149.7	142.8	-20.4	0	0	0	0	122.4
263	L	34.6	Very low	36.6	Very low	137 Å²	137	136.6 Å²	136.6	72%	0.717	78%	0.777	S	S	*	*			trans	102.7	109.1	145.7	-83.8	134.4	0	0	0	119.9
264	Q	35.6	Very low	36.2	Very low	150 Å²	150	140.3 Å²	140.3	70%	0.701	78%	0.775	S	S	*	*				91.6	135.1	114.8	-145.6	169.3	24.7	0	0	121.6
265	Q	36.8	Very low	36.1	Very low	145 Å²	145	148 Å²	148	68%	0.678	78%	0.782	S	S	*	*			trans	85.6	102.2	148.3	-113.9	156	19.6	0	0	117.5
266	Q	34.3	Very low	35.8	Very low	158 Å²	158	147.7 Å²	147.7	74%	0.738	79%	0.792	S	S	*	*				84.9	137.3	76.8	-111.1	-175.3	-8.9	0	0	114.5
267	R	33.5	Very low	35.7	Very low	233 Å²	233	141.3 Å²	141.3	88%	0.879	78%	0.781	S	S	*	*			trans	82.9	140.7	162	-67.3	176.4	158.9	-167.8	-5.2	116.4
268	A	33.1	Very low	35.7	Very low	92 Å²	92	143 Å²	143	76%	0.76	79%	0.785	S	S	*	*			cis	-162.1	136.7	-8.8	0	0	0	0	0	107.1
269	S	38.3	Very low	35.9	Very low	128 Å²	128	147.1 Å²	147.1	90%	0.895	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-85.4	146.3	168.4	-73.2	0	0	0	0	111.4
270	S	41.3	Very low	36.2	Very low	117 Å²	117	147 Å²	147	82%	0.818	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-66.4	144.2	-166.2	-30.1	0	0	0	0	115
271	R	36.6	Very low	36.4	Very low	221 Å²	221	149.7 Å²	149.7	83%	0.834	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-49.6	139.8	156.9	-94.9	171.1	160.3	162.8	-4.3	111.2
272	Q	39.1	Very low	36.9	Very low	151 Å²	151	155.2 Å²	155.2	71%	0.706	79%	0.791	S	S	*	*				59	120.1	88.9	-126.3	-174.2	-15.4	0	0	110.5
273	T	34.1	Very low	36.9	Very low	102 Å²	102	158 Å²	158	63%	0.626	80%	0.795	S	S	*	*				175.1	137.9	69.2	12.8	0	0	0	0	107.2
274	R	36.3	Very low	37.1	Very low	222 Å²	222	159.2 Å²	159.2	84%	0.838	80%	0.803	S	S	*	*				61.3	145.2	108.6	-68.5	-177.6	162.8	-179	-5.6	114.6
275	R	35.4	Very low	37.5	Very low	234 Å²	234	160.8 Å²	160.8	88%	0.883	81%	0.81	S	S	*	*			cis	164.8	149.9	2.3	174.7	-176.5	-169.3	-143.7	3.4	104.3
276	G	29.5	Very low	37.7	Very low	79 Å²	79	161.9 Å²	161.9	81%	0.814	82%	0.821	S	S	*	*			trans	94.5	148.3	160.2	0	0	0	0	0	114.2
277	G	32.8	Very low	38.3	Very low	61 Å²	61	162 Å²	162	63%	0.629	82%	0.821	S	S	*	*			cis	-154.5	150	4.3	0	0	0	0	0	107.7
278	E	38.3	Very low	38.6	Very low	188 Å²	188	156 Å²	156	88%	0.879	82%	0.815	S	S	*	*				75.2	92.8	98.2	-71.1	174.4	-171.3	0	0	110.9
279	E	38.6	Very low	39.1	Very low	188 Å²	188	159.1 Å²	159.1	88%	0.879	81%	0.813	S	S	*	*			trans	-93.9	101.6	161.5	-70.3	173.1	179.1	0	0	105.7
280	D	40.8	Very low	39.1	Very low	148 Å²	148	161.3 Å²	161.3	79%	0.791	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-94.4	116	163.5	-83.8	-28.2	0	0	0	107
281	E	43.7	Very low	39.1	Very low	186 Å²	186	163 Å²	163	87%	0.869	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-77.2	116.4	170.9	-65.1	177.3	163.2	0	0	107.7
282	E	43.6	Very low	39.3	Very low	189 Å²	189	160.3 Å²	160.3	88%	0.883	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-80	124	170.8	-68.2	-153.4	172.9	0	0	109.9
283	E	38.3	Very low	39.4	Very low	188 Å²	188	161.4 Å²	161.4	88%	0.879	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-69.8	123	172.2	-69.1	176.9	152.9	0	0	109.7	E285	E283-E285 PolarHBondContact O-N 2.96Å
284	D	39.3	Very low	39.9	Very low	164 Å²	164	164.6 Å²	164.6	88%	0.877	82%	0.815	S	S	*	*			trans	-67.5	112.5	169.5	-73.7	-53.9	0	0	0	110	D286	D284-D286 PolarHBondContact O-N 3.2Å
285	E	44	Very low	40.4	Very low	182 Å²	182	163.1 Å²	163.1	85%	0.85	82%	0.817	S	S	*	*			trans	-81.8	107.2	164.6	-76.2	-174.9	163.9	0	0	109.6	E283 E287	E283-E285 PolarHBondContact O-N 2.96Å; E285-E287 PolarHBondContact O-N 3.12Å
286	D	40.7	Very low	41.1	Very low	169 Å²	169	159.9 Å²	159.9	90%	0.904	82%	0.817	S	S	*	*			trans	-59.6	104.3	162.9	-93.7	-41.2	0	0	0	110	D284	D284-D286 PolarHBondContact O-N 3.2Å
287	E	47.7	Very low	41.6	Very low	161 Å²	161	159.7 Å²	159.7	75%	0.752	82%	0.816	S	S	*	*			trans	-91.2	106.6	161.5	-81.4	-166	164.5	0	0	109.6	E285 E289	E285-E287 PolarHBondContact O-N 3.12Å; E287-E289 PolarHBondContact O-N 3.49Å
288	S	38.4	Very low	42.4	Very low	107 Å²	107	164 Å²	164	75%	0.748	82%	0.824	S	S	*	*			trans	-55	115.2	169.8	51.2	0	0	0	0	111.8	E290	S288-E290 PolarHBondContact O-N 2.82Å
289	E	44.4	Very low	42.9	Very low	156 Å²	156	163 Å²	163	73%	0.729	82%	0.819	S	S	*	*			trans	-76.3	100.7	166.5	-64.4	-173.6	152.1	0	0	108.8	E287 E291	E287-E289 PolarHBondContact O-N 3.49Å; E289-E291 PolarHBondContact O-N 3.36Å
290	E	38.5	Very low	43.2	Very low	175 Å²	175	162 Å²	162	82%	0.818	82%	0.82	S	S	*	*			trans	-77.8	94.2	159.3	-71.1	-173.2	174.3	0	0	107.6	S288 E292	S288-E290 PolarHBondContact O-N 2.82Å; E290-E292 PolarHBondContact O-N 3.02Å
291	E	41	Very low	43.8	Very low	151 Å²	151	163.4 Å²	163.4	71%	0.706	82%	0.822	S	S	*	*			trans	-76.2	102.3	163.1	-66.4	-168.8	146.8	0	0	108.1	E289 E293	E289-E291 PolarHBondContact O-N 3.36Å; E291-E293 PolarHBondContact O-N 2.86Å
292	E	41.5	Very low	44	Very low	165 Å²	165	162.2 Å²	162.2	77%	0.771	82%	0.822	S	S	*	*			trans	-73.5	98.1	162.2	-72.4	-172.8	165.1	0	0	107.9	E290 E294	E290-E292 PolarHBondContact O-N 3.02Å; E292-E294 PolarHBondContact O-N 3.19Å
293	E	41.5	Very low	44.3	Very low	174 Å²	174	162.2 Å²	162.2	81%	0.813	82%	0.822	S	S	*	*			trans	-69.6	105.1	164.2	-68.8	-171.5	161.4	0	0	108.8	E291 E295	E291-E293 PolarHBondContact O-N 2.86Å; E293-E295 PolarHBondContact O-N 3.02Å
294	E	43.6	Very low	44.7	Very low	170 Å²	170	161 Å²	161	79%	0.794	82%	0.821	S	S	*	*			trans	-74.8	101.5	163.9	-70	-89.7	-173.2	0	0	107.8	E292 D296	E292-E294 PolarHBondContact O-N 3.19Å; E294-D296 PolarHBondContact O-N 3.23Å
295	E	46.6	Very low	45.1	Very low	190 Å²	190	158.8 Å²	158.8	89%	0.888	82%	0.819	S	S	*	*			trans	-77.6	94.3	174.9	-158.8	178.2	-153.4	0	0	109.2	E293 G297	E293-E295 PolarHBondContact O-N 3.02Å; E295-G297 PolarHBondContact O-N 2.67Å
296	D	49.5	Very low	45.7	Very low	166 Å²	166	157.7 Å²	157.7	89%	0.888	82%	0.818	S	S	*	*			trans	-69.1	103.5	163.4	-89.3	-31.5	0	0	0	108.7	E294	E294-D296 PolarHBondContact O-N 3.23Å
297	G	41.5	Very low	46.6	Very low	76 Å²	76	156.2 Å²	156.2	78%	0.784	81%	0.811	S	S	*	*			trans	-122	87.9	170.6	0	0	0	0	0	110.9	E295	E295-G297 PolarHBondContact O-N 2.67Å
298	D	48.6	Very low	46.5	Very low	150 Å²	150	156.6 Å²	156.6	80%	0.802	81%	0.813	S	S	*	*			trans	-86.3	140	167.3	-104	-24.5	0	0	0	110.6
299	E	48.6	Very low	47.7	Very low	167 Å²	167	160.2 Å²	160.2	78%	0.78	83%	0.834	S	S	*	*			trans	73.1	112.4	154.9	-61.5	176.3	-176.2	0	0	118.9
300	D	46.2	Very low	47.8	Very low	169 Å²	169	160.5 Å²	160.5	90%	0.904	84%	0.839	S	S	*	*				-149.1	132.2	125.2	-91	-36.4	0	0	0	110.4
301	E	52.1	Low	48.3	Very low	176 Å²	176	159.7 Å²	159.7	82%	0.822	84%	0.84	S	S	*	*			trans	-71.7	133.5	179.3	-59	173.1	143	0	0	110.7
302	D	47.9	Very low	48.7	Very low	161 Å²	161	160.2 Å²	160.2	86%	0.861	85%	0.847	S	S	*	*			trans	-117.9	100.2	158.9	-79.6	-40.8	0	0	0	109.1
303	E	50.5	Low	49.2	Very low	190 Å²	190	159.9 Å²	159.9	89%	0.888	85%	0.852	S	S	*	*			trans	-64.1	120.8	157.8	-75.7	-175.3	145.3	0	0	108.9
304	D	46.5	Very low	49.6	Very low	162 Å²	162	159 Å²	159	87%	0.866	85%	0.854	S	S	*	*			trans	-133.6	97.6	170.8	-125.2	-9	0	0	0	109
305	S	48.7	Very low	50	Low	118 Å²	118	158.3 Å²	158.3	83%	0.825	86%	0.858	S	S	*	*			trans	-170.5	99.1	139	66.9	0	0	0	0	111.4
306	D	56.7	Low	50.3	Low	158 Å²	158	156 Å²	156	85%	0.845	86%	0.856	S	S	*	*			trans	-94.7	130.5	159.9	-92.4	-19.8	0	0	0	110.8
307	D	57.8	Low	50.4	Low	138 Å²	138	155.2 Å²	155.2	74%	0.738	85%	0.854	S	S	*	*			trans	38.8	115.1	143.1	-80.6	-14.4	0	0	0	121.5
308	E	45.5	Very low	51.1	Low	170 Å²	170	161.8 Å²	161.8	79%	0.794	86%	0.86	S	S	*	*				83.5	152	85.7	-99.5	-158.9	-176.5	0	0	113.8
309	P	64.1	Low	51.3	Low	183 Å²	183	162.9 Å²	162.9	100%	1.188	87%	0.865	S	S	*	*			cis	-123.5	0	32.4	38.7	-23.4	0	0	0	117.6

Retrieved 309 of 309 residues in 189.2 ms (Link to these results)

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