A0A087X1Z3_HUMAN Loading...

Proteasome activator complex subunit 2

Implicated in immunoproteasome assembly and required for efficient antigen processing. The PA28 activator complex enhances the generation of class I binding peptides by altering the cleavage pattern of the proteasome.

AlphaFold DB , UniProt , Accession A0A087X1Z3, Species HUMAN (Homo sapiens, Human), Gene PSME2, Length 254 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.6	Very low	75.5	Confident	244 Å²	244	131.8 Å²	131.8	100%	1.202	77%	0.773	S	S	*	*				0	115.1	0	-71.2	176.8	175.1	0	0	107.9
2	A	59.4	Low	77.1	Confident	103 Å²	103	132.3 Å²	132.3	85%	0.851	76%	0.762	S	S	*	*			trans	-70.6	130	174	0	0	0	0	0	108.9
3	K	66.8	Low	78.5	Confident	199 Å²	199	124.8 Å²	124.8	87%	0.865	73%	0.727	S	S	*	*			trans	-63.2	134.7	171.1	-79.8	-179.2	176.1	178	0	108.3	C5	K3-C5 PolarHBondContact O-N 3.39Å; K3-C5 VanDerWaalsContact O-N 3.07Å
4	P	65.7	Low	79.6	Confident	128 Å²	128	127 Å²	127	83%	0.831	72%	0.716	S	S	*	*			trans	-61.3	115.9	175.7	22.6	-29.8	0	0	0	109.4	G6	P4-G6 PolarHBondContact O-N 3.15Å
5	C	70.3	Confident	80.7	Confident	124 Å²	124	128.9 Å²	128.9	84%	0.838	71%	0.714	S	S	*	*			trans	-86.5	88.1	174	-167.8	0	0	0	0	108.1	K3	K3-C5 PolarHBondContact O-N 3.39Å; K3-C5 VanDerWaalsContact O-N 3.07Å
6	G	73.4	Confident	81.6	Confident	74 Å²	74	128.6 Å²	128.6	76%	0.763	71%	0.706	S	S	*	*			trans	-86.7	104.2	174.7	0	0	0	0	0	110.6	P4 R8	P4-G6 PolarHBondContact O-N 3.15Å; G6-R8 PolarHBondContact O-N 2.93Å
7	V	82.7	Confident	82.5	Confident	121 Å²	121	126.5 Å²	126.5	73%	0.733	70%	0.697	S	S	*	*			trans	-79.8	115	173	-179.2	0	0	0	0	109	L9	V7-L9 HydrophobicContact CG1-CD2 4.28Å
8	R	86.8	Confident	83.2	Confident	238 Å²	238	123.1 Å²	123.1	90%	0.898	68%	0.675	S	S	*	*			trans	-101.3	109.1	173.4	-171.3	177.6	-179.4	180	0.5	109.8	G6	G6-R8 PolarHBondContact O-N 2.93Å
9	L	89.2	Confident	84	Confident	101 Å²	101	120.8 Å²	120.8	53%	0.529	67%	0.665	S	S	.	*			trans	-72	134	175.5	-60	172	0	0	0	110.5	V7 R14	V7-L9 HydrophobicContact CG1-CD2 4.28Å; L9-R14 HydrophobicContact CB-CG 4.13Å
10	S	93.1	Very high	84.7	Confident	66 Å²	66	120.2 Å²	120.2	46%	0.462	66%	0.656	S	S	.	*			trans	-68.8	155.5	174.1	73.4	0	0	0	0	111	E12 A13 R14	S10-E12 VanDerWaalsContact C-N 3.26Å; S10-E12 PolarHBondContact O-N 3.02Å; S10-A13 PolarHBondContact O-N 3.5Å; S10-A13 VanDerWaalsContact OG-CB 3.31Å; S10-A13 WeakPolarHBondContact OG-CB 3.39Å; S10-A13 PolarHBondContact OG-N 3.45Å; S10-A13 VanDerWaalsContact OG-N 3.15Å; S10-R14 PolarHBondContact O-N 3.04Å
11	G	93.6	Very high	85.3	Confident	52 Å²	52	119.6 Å²	119.6	54%	0.536	64%	0.644	S	S	.	*	H	α-helix	trans	-62	-35.3	177.2	0	0	0	0	0	112.7	K15	G11-K15 WeakPolarHBondContact O-CG 3.31Å; G11-K15 PolarHBondContact O-N 3.09Å; G11-K15 VanDerWaalsContact O-N 3.15Å
12	E	94.9	Very high	87.5	Confident	137 Å²	137	113.2 Å²	113.2	64%	0.64	61%	0.611	S	S	*	*	H	α-helix	trans	-67.2	-45.8	176.6	-174.4	174.2	-173.8	0	0	112.3	S10 R14 K15 Q16	S10-E12 VanDerWaalsContact C-N 3.26Å; S10-E12 PolarHBondContact O-N 3.02Å; E12-R14 VanDerWaalsContact C-N 3.28Å; E12-R14 PolarHBondContact O-N 3.31Å; E12-K15 PolarHBondContact O-N 3.11Å; E12-K15 VanDerWaalsContact O-N 3.11Å; E12-Q16 WeakPolarHBondContact O-CG 3.27Å; E12-Q16 PolarHBondContact O-N 3.18Å
13	A	95.1	Very high	89.4	Confident	36 Å²	36	112.6 Å²	112.6	30%	0.298	59%	0.594	S	S	.	*	H	α-helix	trans	-59.6	-40.3	177.4	0	0	0	0	0	111.7	S10 Q16 V17	S10-A13 PolarHBondContact O-N 3.5Å; S10-A13 VanDerWaalsContact OG-CB 3.31Å; S10-A13 WeakPolarHBondContact OG-CB 3.39Å; S10-A13 PolarHBondContact OG-N 3.45Å; S10-A13 VanDerWaalsContact OG-N 3.15Å; A13-Q16 PolarHBondContact O-N 3.15Å; A13-V17 PolarHBondContact O-N 3.43Å
14	R	93.5	Very high	90.9	Very high	155 Å²	155	103.6 Å²	103.6	59%	0.585	56%	0.555	S	S	*	*	H	α-helix	trans	-62.8	-43.1	175.1	-71	-178.9	-177.4	177	-0.3	112.3	L9 S10 E12 Q16 V17 E18	L9-R14 HydrophobicContact CB-CG 4.13Å; S10-R14 PolarHBondContact O-N 3.04Å; E12-R14 VanDerWaalsContact C-N 3.28Å; E12-R14 PolarHBondContact O-N 3.31Å; R14-Q16 PolarHBondContact O-N 3.37Å; R14-V17 PolarHBondContact O-N 2.93Å; R14-E18 VanDerWaalsContact O-CB 3.29Å; R14-E18 WeakPolarHBondContact O-CB 3.3Å; R14-E18 PolarHBondContact O-N 3.45Å
15	K	95.7	Very high	92.4	Very high	156 Å²	156	100.8 Å²	100.8	68%	0.678	53%	0.529	S	S	*	.	H	α-helix	trans	-62.3	-42.4	178.6	-74.7	178	-179.8	-174.8	0	112	G11 E12 E18 V19	G11-K15 WeakPolarHBondContact O-CG 3.31Å; G11-K15 PolarHBondContact O-N 3.09Å; G11-K15 VanDerWaalsContact O-N 3.15Å; E12-K15 PolarHBondContact O-N 3.11Å; E12-K15 VanDerWaalsContact O-N 3.11Å; K15-E18 PolarHBondContact O-N 3.33Å; K15-V19 WeakPolarHBondContact O-CG2 3.38Å; K15-V19 PolarHBondContact O-N 3Å
16	Q	96.3	Very high	93.7	Very high	124 Å²	124	100.3 Å²	100.3	58%	0.579	52%	0.515	S	S	*	.	H	α-helix	trans	-61.3	-45.8	179.2	-70	176.7	0	0	0	112	E12 A13 R14 F20	E12-Q16 WeakPolarHBondContact O-CG 3.27Å; E12-Q16 PolarHBondContact O-N 3.18Å; A13-Q16 PolarHBondContact O-N 3.15Å; R14-Q16 PolarHBondContact O-N 3.37Å; Q16-F20 PolarHBondContact O-N 3.46Å
17	V	96.4	Very high	94.9	Very high	93 Å²	93	101.7 Å²	101.7	56%	0.564	50%	0.502	S	S	*	.	H	α-helix	trans	-68.4	-36.9	177.6	177.8	0	0	0	0	111.5	A13 R14 F20 R21	A13-V17 PolarHBondContact O-N 3.43Å; R14-V17 PolarHBondContact O-N 2.93Å; V17-F20 PolarHBondContact O-N 3.35Å; V17-R21 WeakPolarHBondContact O-CB 3.5Å; V17-R21 PolarHBondContact O-N 3.47Å
18	E	95.7	Very high	95.6	Very high	64 Å²	64	96 Å²	96	30%	0.299	47%	0.467	S	S	.	.	H	α-helix	trans	-64.9	-40.5	178.8	-174.6	57.9	-157.9	0	0	112.3	R14 K15 F20 R21 Q22	R14-E18 VanDerWaalsContact O-CB 3.29Å; R14-E18 WeakPolarHBondContact O-CB 3.3Å; R14-E18 PolarHBondContact O-N 3.45Å; K15-E18 PolarHBondContact O-N 3.33Å; E18-F20 PolarHBondContact O-N 2.78Å; E18-R21 VanDerWaalsContact CD-NH2 3.26Å; E18-R21 PolarHBondContact O-N 3.39Å; E18-R21 IonicContact OE1-CZ 3.59Å; E18-R21 IonicContact OE1-NE 3.53Å; E18-R21 IonicContact OE1-NH2 2.79Å; E18-R21 PolarHBondContact OE1-NH2 2.92Å; E18-R21 IonicContact OE2-CZ 3.25Å; E18-R21 VanDerWaalsContact OE2-CZ 3.25Å; E18-R21 IonicContact OE2-NE 2.96Å; E18-R21 PolarHBondContact OE2-NE 3.45Å; E18-R21 IonicContact OE2-NH2 2.95Å; E18-R21 PolarHBondContact OE2-NH2 3.24Å; E18-Q22 WeakPolarHBondContact O-CG 3.35Å; E18-Q22 PolarHBondContact O-N 2.92Å; E18-Q22 PolarHBondContact OE1-NE2 2.95Å; E18-Q22 VanDerWaalsContact OE1-NE2 3.09Å
19	V	97.6	Very high	96	Very high	80 Å²	80	89 Å²	89	49%	0.485	45%	0.445	S	S	.	.	H	α-helix	trans	-60.8	-45.5	174.3	170.5	0	0	0	0	110.9	K15 R21 Q22 N23	K15-V19 WeakPolarHBondContact O-CG2 3.38Å; K15-V19 PolarHBondContact O-N 3Å; V19-R21 VanDerWaalsContact C-N 3.34Å; V19-R21 PolarHBondContact O-N 3.33Å; V19-Q22 PolarHBondContact O-N 3.01Å; V19-N23 VanDerWaalsContact O-CG 3.28Å; V19-N23 PolarHBondContact O-N 2.96Å; V19-N23 PolarHBondContact O-ND2 3.27Å
20	F	97.7	Very high	96.4	Very high	109 Å²	109	88 Å²	88	48%	0.478	44%	0.437	S	S	.	.	H	α-helix	trans	-58.4	-46.4	175	167.1	-98.6	0	0	0	111.6	Q16 V17 E18 Q22 N23 L24 T138 H142	Q16-F20 PolarHBondContact O-N 3.46Å; V17-F20 PolarHBondContact O-N 3.35Å; E18-F20 PolarHBondContact O-N 2.78Å; F20-Q22 PolarHBondContact O-N 3.06Å; F20-N23 PolarHBondContact O-N 3.3Å; F20-L24 HydrophobicContact CE1-CD2 4.18Å; F20-L24 HydrophobicContact CZ-CD2 4.34Å; F20-L24 WeakPolarHBondContact O-CB 3.29Å; F20-L24 PolarHBondContact O-N 2.9Å; F20-T138 HydrophobicContact CZ-CG2 4.39Å; F20-H142 AromaticContact CE1-CE1 3.96Å; F20-H142 AromaticContact CE1-NE2 3.86Å
21	R	97.3	Very high	96.6	Very high	107 Å²	107	85 Å²	85	40%	0.404	42%	0.416	S	S	.	.	H	α-helix	trans	-61.2	-44.3	179.9	-171.7	177	71.9	135.8	6.7	111.8	V17 E18 V19 L24 F25	V17-R21 WeakPolarHBondContact O-CB 3.5Å; V17-R21 PolarHBondContact O-N 3.47Å; E18-R21 VanDerWaalsContact CD-NH2 3.26Å; E18-R21 PolarHBondContact O-N 3.39Å; E18-R21 IonicContact OE1-CZ 3.59Å; E18-R21 IonicContact OE1-NE 3.53Å; E18-R21 IonicContact OE1-NH2 2.79Å; E18-R21 PolarHBondContact OE1-NH2 2.92Å; E18-R21 IonicContact OE2-CZ 3.25Å; E18-R21 VanDerWaalsContact OE2-CZ 3.25Å; E18-R21 IonicContact OE2-NE 2.96Å; E18-R21 PolarHBondContact OE2-NE 3.45Å; E18-R21 IonicContact OE2-NH2 2.95Å; E18-R21 PolarHBondContact OE2-NH2 3.24Å; V19-R21 VanDerWaalsContact C-N 3.34Å; V19-R21 PolarHBondContact O-N 3.33Å; R21-L24 PolarHBondContact O-N 3.27Å; R21-F25 HydrophobicContact CG-CD2 4.05Å; R21-F25 HydrophobicContact CG-CE2 3.8Å; R21-F25 WeakPolarHBondContact O-CD2 3.49Å; R21-F25 PolarHBondContact O-N 2.84Å
22	Q	97.3	Very high	96.6	Very high	111 Å²	111	83.3 Å²	83.3	52%	0.519	40%	0.395	S	S	.	.	H	α-helix	trans	-62.9	-44.9	178.3	-72	174.3	4.3	0	0	111.7	E18 V19 F20 F25 Q26	E18-Q22 WeakPolarHBondContact O-CG 3.35Å; E18-Q22 PolarHBondContact O-N 2.92Å; E18-Q22 PolarHBondContact OE1-NE2 2.95Å; E18-Q22 VanDerWaalsContact OE1-NE2 3.09Å; V19-Q22 PolarHBondContact O-N 3.01Å; F20-Q22 PolarHBondContact O-N 3.06Å; Q22-F25 PolarHBondContact O-N 3.5Å; Q22-Q26 PolarHBondContact O-N 2.79Å
23	N	98.1	Very high	96.5	Very high	90 Å²	90	84.1 Å²	84.1	48%	0.481	39%	0.393	S	S	.	.	H	α-helix	trans	-62.4	-45.3	176.5	-67.7	-14.2	0	0	0	111.7	V19 F20 F25 Q26 E27	V19-N23 VanDerWaalsContact O-CG 3.28Å; V19-N23 PolarHBondContact O-N 2.96Å; V19-N23 PolarHBondContact O-ND2 3.27Å; F20-N23 PolarHBondContact O-N 3.3Å; N23-F25 VanDerWaalsContact C-N 3.3Å; N23-F25 PolarHBondContact O-N 3.31Å; N23-Q26 PolarHBondContact O-N 3.49Å; N23-E27 WeakPolarHBondContact O-CB 3.21Å; N23-E27 WeakPolarHBondContact O-CG 3.43Å; N23-E27 PolarHBondContact O-N 3.18Å
24	L	98.1	Very high	96.6	Very high	10 Å²	10	88.9 Å²	88.9	5%	0.052	40%	0.403	C	S	.	.	H	α-helix	trans	-55.2	-45.2	176.4	171.2	65.1	0	0	0	111.9	F20 R21 A28 L135 T138 W139 H142	F20-L24 HydrophobicContact CE1-CD2 4.18Å; F20-L24 HydrophobicContact CZ-CD2 4.34Å; F20-L24 WeakPolarHBondContact O-CB 3.29Å; F20-L24 PolarHBondContact O-N 2.9Å; R21-L24 PolarHBondContact O-N 3.27Å; L24-A28 WeakPolarHBondContact O-CB 3.34Å; L24-A28 PolarHBondContact O-N 3.07Å; L24-L135 HydrophobicContact CD1-CD1 3.58Å; L24-T138 HydrophobicContact CD1-CG2 4.28Å; L24-T138 HydrophobicContact CD2-CG2 3.86Å; L24-W139 HydrophobicContact CD1-CB 4.28Å; L24-W139 HydrophobicContact CG-CB 4.42Å; L24-H142 HydrophobicContact CD2-CB 4.49Å
25	F	97.4	Very high	96.8	Very high	68 Å²	68	84.1 Å²	84.1	30%	0.298	39%	0.387	S	S	.	.	H	α-helix	trans	-69.3	-41.7	-178.7	-83.9	-126.5	0	0	0	111.3	R21 Q22 N23 E27 A28 E29 W139 H142 L143	R21-F25 HydrophobicContact CG-CD2 4.05Å; R21-F25 HydrophobicContact CG-CE2 3.8Å; R21-F25 WeakPolarHBondContact O-CD2 3.49Å; R21-F25 PolarHBondContact O-N 2.84Å; Q22-F25 PolarHBondContact O-N 3.5Å; N23-F25 VanDerWaalsContact C-N 3.3Å; N23-F25 PolarHBondContact O-N 3.31Å; F25-E27 VanDerWaalsContact C-N 3.35Å; F25-E27 PolarHBondContact O-N 2.89Å; F25-A28 PolarHBondContact O-N 3Å; F25-E29 WeakPolarHBondContact O-CB 3.46Å; F25-E29 PolarHBondContact O-N 3.49Å; F25-W139 AromaticContact CD2-CD1 3.95Å; F25-H142 HydrophobicContact CE2-CB 3.9Å; F25-H142 HydrophobicContact CZ-CB 4.28Å; F25-L143 HydrophobicContact CE1-CD2 3.6Å; F25-L143 HydrophobicContact CE1-CG 4.36Å; F25-L143 HydrophobicContact CZ-CD2 3.68Å; F25-L143 HydrophobicContact CZ-CG 4.11Å
26	Q	97.7	Very high	96.9	Very high	114 Å²	114	76.7 Å²	76.7	53%	0.533	36%	0.355	S	S	.	.	H	α-helix	trans	-63.5	-40.7	176.3	-173	61.2	72.9	0	0	112.1	Q22 N23 E29 E30	Q22-Q26 PolarHBondContact O-N 2.79Å; N23-Q26 PolarHBondContact O-N 3.49Å; Q26-E29 PolarHBondContact O-N 3.43Å; Q26-E30 PolarHBondContact O-N 2.97Å
27	E	97.9	Very high	96.9	Very high	103 Å²	103	72.9 Å²	72.9	48%	0.481	34%	0.34	S	S	.	.	H	α-helix	trans	-67.4	-40	176.3	-76.7	-175.7	-145.3	0	0	112.3	N23 F25 E29 E30 F31 L135	N23-E27 WeakPolarHBondContact O-CB 3.21Å; N23-E27 WeakPolarHBondContact O-CG 3.43Å; N23-E27 PolarHBondContact O-N 3.18Å; F25-E27 VanDerWaalsContact C-N 3.35Å; F25-E27 PolarHBondContact O-N 2.89Å; E27-E29 VanDerWaalsContact C-N 3.3Å; E27-E29 PolarHBondContact O-N 3.26Å; E27-E30 PolarHBondContact O-N 3.35Å; E27-F31 VanDerWaalsContact O-CB 3.24Å; E27-F31 WeakPolarHBondContact O-CB 3.38Å; E27-F31 PolarHBondContact O-N 3.35Å; E27-L135 HydrophobicContact CB-CD1 3.96Å; E27-L135 HydrophobicContact CB-CD2 4.24Å
28	A	97.4	Very high	97	Very high	1 Å²	1	73.4 Å²	73.4	1%	0.008	34%	0.337	C	S	.	.	H	α-helix	trans	-64.1	-38	175.4	0	0	0	0	0	111.6	L24 F25 F31 L32 W139	L24-A28 WeakPolarHBondContact O-CB 3.34Å; L24-A28 PolarHBondContact O-N 3.07Å; F25-A28 PolarHBondContact O-N 3Å; A28-F31 WeakPolarHBondContact O-CB 3.11Å; A28-F31 PolarHBondContact O-N 3.05Å; A28-L32 WeakPolarHBondContact O-CG 3.43Å; A28-L32 PolarHBondContact O-N 3.48Å; A28-L32 VanDerWaalsContact O-N 3.12Å; A28-W139 HydrophobicContact CB-CB 3.95Å; A28-W139 HydrophobicContact CB-CD2 3.75Å; A28-W139 HydrophobicContact CB-CE3 4.35Å; A28-W139 HydrophobicContact CB-CG 3.54Å
29	E	95.3	Very high	97.1	Very high	92 Å²	92	71.9 Å²	71.9	43%	0.43	33%	0.329	S	S	.	.	H	α-helix	trans	-64	-52.4	174.8	-174.9	168.6	-155.4	0	0	112	F25 Q26 E27 F31 L32 Y33	F25-E29 WeakPolarHBondContact O-CB 3.46Å; F25-E29 PolarHBondContact O-N 3.49Å; Q26-E29 PolarHBondContact O-N 3.43Å; E27-E29 VanDerWaalsContact C-N 3.3Å; E27-E29 PolarHBondContact O-N 3.26Å; E29-F31 PolarHBondContact O-N 2.84Å; E29-L32 PolarHBondContact O-N 3Å; E29-L32 VanDerWaalsContact O-N 3.15Å; E29-Y33 HydrophobicContact CG-CD2 3.44Å; E29-Y33 VanDerWaalsContact CG-CD2 3.44Å; E29-Y33 HydrophobicContact CG-CE2 3.54Å; E29-Y33 VanDerWaalsContact O-CD2 3.29Å; E29-Y33 WeakPolarHBondContact O-CD2 3.36Å; E29-Y33 PolarHBondContact O-N 3.24Å
30	E	97.7	Very high	97.1	Very high	79 Å²	79	70.2 Å²	70.2	37%	0.369	32%	0.317	S	S	.	.	H	α-helix	trans	-60.1	-35	176.6	179.3	67.6	173.9	0	0	111.5	Q26 E27 R34 F35	Q26-E30 PolarHBondContact O-N 2.97Å; E27-E30 PolarHBondContact O-N 3.35Å; E30-R34 PolarHBondContact O-N 3.48Å; E30-R34 VanDerWaalsContact O-N 3.1Å; E30-R34 WeakPolarHBondContact OE1-CD 3.22Å; E30-R34 IonicContact OE1-CZ 3.48Å; E30-R34 IonicContact OE1-NE 3.54Å; E30-R34 IonicContact OE1-NH1 2.84Å; E30-R34 PolarHBondContact OE1-NH1 3.15Å; E30-F35 PolarHBondContact O-N 3.12Å
31	F	97.6	Very high	97.1	Very high	4 Å²	4	69.8 Å²	69.8	2%	0.018	32%	0.319	C	S	.	.	I	π-helix	trans	-59.2	-50.8	174.8	170.3	-107.9	0	0	0	111.8	E27 A28 E29 F35 L36 K132 L135 V136 Y228	E27-F31 VanDerWaalsContact O-CB 3.24Å; E27-F31 WeakPolarHBondContact O-CB 3.38Å; E27-F31 PolarHBondContact O-N 3.35Å; A28-F31 WeakPolarHBondContact O-CB 3.11Å; A28-F31 PolarHBondContact O-N 3.05Å; E29-F31 PolarHBondContact O-N 2.84Å; F31-F35 HydrophobicContact CD2-CB 4.25Å; F31-F35 AromaticContact CD2-CD1 3.56Å; F31-F35 HydrophobicContact CD2-CD1 3.56Å; F31-F35 HydrophobicContact CD2-CE1 4.31Å; F31-F35 HydrophobicContact CD2-CG 4.23Å; F31-F35 AromaticContact CE2-CD1 3.77Å; F31-F35 HydrophobicContact CE2-CD1 3.77Å; F31-F35 HydrophobicContact CE2-CE1 4.25Å; F31-F35 PolarHBondContact O-N 2.87Å; F31-L36 HydrophobicContact CE1-CD1 3.97Å; F31-L36 HydrophobicContact CE2-CB 4.14Å; F31-L36 HydrophobicContact CE2-CD1 4.47Å; F31-L36 HydrophobicContact CZ-CB 4.22Å; F31-L36 HydrophobicContact CZ-CD1 3.76Å; F31-L36 HydrophobicContact CZ-CG 4.34Å; F31-L36 VanDerWaalsContact O-CB 3.22Å; F31-L36 WeakPolarHBondContact O-CB 3.18Å; F31-L36 PolarHBondContact O-N 3.39Å; F31-K132 HydrophobicContact CD2-CB 3.97Å; F31-K132 HydrophobicContact CD2-CD 4.02Å; F31-K132 HydrophobicContact CD2-CG 3.85Å; F31-K132 HydrophobicContact CE2-CB 3.54Å; F31-K132 HydrophobicContact CE2-CD 4.43Å; F31-K132 HydrophobicContact CE2-CG 3.75Å; F31-K132 HydrophobicContact CZ-CB 4.03Å; F31-L135 HydrophobicContact CB-CD2 4.11Å; F31-L135 HydrophobicContact CG-CD2 4.49Å; F31-V136 HydrophobicContact CD1-CG2 3.69Å; F31-V136 HydrophobicContact CE1-CG2 3.43Å; F31-V136 VanDerWaalsContact CE1-CG2 3.43Å; F31-V136 HydrophobicContact CZ-CG2 4.32Å; F31-Y228 HydrophobicContact CE2-CD1 4.47Å; F31-Y228 HydrophobicContact CE2-CE1 4.05Å; F31-Y228 HydrophobicContact CZ-CD1 4.48Å; F31-Y228 HydrophobicContact CZ-CE1 4.4Å
32	L	94.3	Very high	97.2	Very high	17 Å²	17	68.9 Å²	68.9	9%	0.089	32%	0.316	C	S	.	.	I	π-helix	trans	-72.4	-44.4	-175.3	-67.4	173.1	0	0	0	112.7	A28 E29 P37 W139 I235	A28-L32 WeakPolarHBondContact O-CG 3.43Å; A28-L32 PolarHBondContact O-N 3.48Å; A28-L32 VanDerWaalsContact O-N 3.12Å; E29-L32 PolarHBondContact O-N 3Å; E29-L32 VanDerWaalsContact O-N 3.15Å; L32-P37 WeakPolarHBondContact O-CD 3.4Å; L32-W139 HydrophobicContact CD1-CH2 3.89Å; L32-W139 HydrophobicContact CD1-CZ3 4.08Å; L32-I235 HydrophobicContact CD1-CG2 3.84Å; L32-I235 HydrophobicContact CD2-CB 4.32Å; L32-I235 HydrophobicContact CD2-CD1 3.89Å; L32-I235 HydrophobicContact CD2-CG2 3.87Å
33	Y	92.7	Very high	97.2	Very high	153 Å²	153	63.6 Å²	63.6	60%	0.6	29%	0.291	S	S	*	.	I	π-helix	trans	-82.7	-31.5	-172.4	-71.5	-63.8	0	0	0	114	E29	E29-Y33 HydrophobicContact CG-CD2 3.44Å; E29-Y33 VanDerWaalsContact CG-CD2 3.44Å; E29-Y33 HydrophobicContact CG-CE2 3.54Å; E29-Y33 VanDerWaalsContact O-CD2 3.29Å; E29-Y33 WeakPolarHBondContact O-CD2 3.36Å; E29-Y33 PolarHBondContact O-N 3.24Å
34	R	96.5	Very high	97.2	Very high	137 Å²	137	62.8 Å²	62.8	52%	0.517	29%	0.287	S	S	.	.	I	π-helix	trans	-121.5	-57	-172.8	-178.7	166.3	153.9	-155.1	12.1	113	E30 L36 Q38	E30-R34 PolarHBondContact O-N 3.48Å; E30-R34 VanDerWaalsContact O-N 3.1Å; E30-R34 WeakPolarHBondContact OE1-CD 3.22Å; E30-R34 IonicContact OE1-CZ 3.48Å; E30-R34 IonicContact OE1-NE 3.54Å; E30-R34 IonicContact OE1-NH1 2.84Å; E30-R34 PolarHBondContact OE1-NH1 3.15Å; R34-L36 PolarHBondContact O-N 3.1Å; R34-Q38 WeakPolarHBondContact O-CB 3.29Å; R34-Q38 WeakPolarHBondContact O-CG 3.47Å; R34-Q38 PolarHBondContact O-N 3Å
35	F	98.2	Very high	97.2	Very high	55 Å²	55	67.8 Å²	67.8	24%	0.241	31%	0.31	C	S	.	.	I	π-helix	trans	-62.7	-48.8	-170.6	-176.4	-90.6	0	0	0	112.4	E30 F31 Q38 K39 T128 K132 Y228	E30-F35 PolarHBondContact O-N 3.12Å; F31-F35 HydrophobicContact CD2-CB 4.25Å; F31-F35 AromaticContact CD2-CD1 3.56Å; F31-F35 HydrophobicContact CD2-CD1 3.56Å; F31-F35 HydrophobicContact CD2-CE1 4.31Å; F31-F35 HydrophobicContact CD2-CG 4.23Å; F31-F35 AromaticContact CE2-CD1 3.77Å; F31-F35 HydrophobicContact CE2-CD1 3.77Å; F31-F35 HydrophobicContact CE2-CE1 4.25Å; F31-F35 PolarHBondContact O-N 2.87Å; F35-Q38 PolarHBondContact O-N 3.5Å; F35-K39 HydrophobicContact CD1-CG 3.92Å; F35-K39 HydrophobicContact CE1-CD 4.37Å; F35-K39 HydrophobicContact CE1-CG 3.48Å; F35-K39 VanDerWaalsContact CE1-CG 3.48Å; F35-K39 HydrophobicContact CE2-CG 4.36Å; F35-K39 HydrophobicContact CZ-CD 4.19Å; F35-K39 VanDerWaalsContact CZ-CE 3.45Å; F35-K39 HydrophobicContact CZ-CG 3.72Å; F35-K39 WeakPolarHBondContact O-CB 3.44Å; F35-K39 WeakPolarHBondContact O-CG 3.24Å; F35-K39 PolarHBondContact O-N 3.13Å; F35-T128 HydrophobicContact CE1-CG2 4.15Å; F35-T128 HydrophobicContact CZ-CG2 3.52Å; F35-K132 HydrophobicContact CD1-CG 4.46Å; F35-K132 HydrophobicContact CE1-CG 3.93Å; F35-K132 HydrophobicContact CZ-CG 4.49Å; F35-Y228 HydrophobicContact CE1-CE1 4.27Å
36	L	97	Very high	97.2	Very high	0 Å²	0	65 Å²	65	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.7	-53.3	-174.7	-175.5	169.4	0	0	0	111.6	F31 R34 Q38 K39 I40 Y228 L231 Y232	F31-L36 HydrophobicContact CE1-CD1 3.97Å; F31-L36 HydrophobicContact CE2-CB 4.14Å; F31-L36 HydrophobicContact CE2-CD1 4.47Å; F31-L36 HydrophobicContact CZ-CB 4.22Å; F31-L36 HydrophobicContact CZ-CD1 3.76Å; F31-L36 HydrophobicContact CZ-CG 4.34Å; F31-L36 VanDerWaalsContact O-CB 3.22Å; F31-L36 WeakPolarHBondContact O-CB 3.18Å; F31-L36 PolarHBondContact O-N 3.39Å; R34-L36 PolarHBondContact O-N 3.1Å; L36-Q38 VanDerWaalsContact C-N 3.25Å; L36-Q38 PolarHBondContact O-N 2.96Å; L36-K39 PolarHBondContact O-N 3.23Å; L36-I40 HydrophobicContact CD2-CD1 3.5Å; L36-I40 HydrophobicContact CD2-CG1 4.08Å; L36-I40 PolarHBondContact O-N 3.28Å; L36-Y228 HydrophobicContact CD1-CD1 4.41Å; L36-Y228 WeakPolarHBondContact CD2-O 3.36Å; L36-Y228 HydrophobicContact CG-CD1 3.88Å; L36-Y228 HydrophobicContact CG-CG 4.45Å; L36-L231 HydrophobicContact CD1-CB 4.47Å; L36-Y232 HydrophobicContact CD1-CD2 4.28Å; L36-Y232 HydrophobicContact CD2-CD2 3.93Å; L36-Y232 HydrophobicContact CD2-CG 4.02Å
37	P	96.8	Very high	97.2	Very high	43 Å²	43	59.9 Å²	59.9	28%	0.279	27%	0.274	S	S	.	.	H	α-helix	trans	-56	-40.7	177	-26.8	35.2	0	0	0	112.8	L32 K39 I40 I41 Y232	L32-P37 WeakPolarHBondContact O-CD 3.4Å; P37-K39 PolarHBondContact O-N 3.27Å; P37-I40 PolarHBondContact O-N 3.44Å; P37-I41 WeakPolarHBondContact O-CG1 3.42Å; P37-I41 PolarHBondContact O-N 2.87Å; P37-Y232 HydrophobicContact CG-CE2 4.33Å
38	Q	98.1	Very high	97.2	Very high	105 Å²	105	61.1 Å²	61.1	49%	0.491	28%	0.28	S	S	.	.	H	α-helix	trans	-63.4	-40.8	176.1	-72	177	-6.9	0	0	112	R34 F35 L36 I40 I41 Y42	R34-Q38 WeakPolarHBondContact O-CB 3.29Å; R34-Q38 WeakPolarHBondContact O-CG 3.47Å; R34-Q38 PolarHBondContact O-N 3Å; F35-Q38 PolarHBondContact O-N 3.5Å; L36-Q38 VanDerWaalsContact C-N 3.25Å; L36-Q38 PolarHBondContact O-N 2.96Å; Q38-I40 PolarHBondContact O-N 2.85Å; Q38-I41 PolarHBondContact O-N 2.92Å; Q38-Y42 WeakPolarHBondContact O-CB 3.48Å; Q38-Y42 PolarHBondContact O-N 3.41Å
39	K	98.1	Very high	97.2	Very high	32 Å²	32	66.2 Å²	66.2	14%	0.139	30%	0.304	C	S	.	.	H	α-helix	trans	-64.6	-37	176.7	-82.8	-64.2	-173.4	176.1	0	113.1	F35 L36 P37 I41 Y42 L43 E125 Y228	F35-K39 HydrophobicContact CD1-CG 3.92Å; F35-K39 HydrophobicContact CE1-CD 4.37Å; F35-K39 HydrophobicContact CE1-CG 3.48Å; F35-K39 VanDerWaalsContact CE1-CG 3.48Å; F35-K39 HydrophobicContact CE2-CG 4.36Å; F35-K39 HydrophobicContact CZ-CD 4.19Å; F35-K39 VanDerWaalsContact CZ-CE 3.45Å; F35-K39 HydrophobicContact CZ-CG 3.72Å; F35-K39 WeakPolarHBondContact O-CB 3.44Å; F35-K39 WeakPolarHBondContact O-CG 3.24Å; F35-K39 PolarHBondContact O-N 3.13Å; L36-K39 PolarHBondContact O-N 3.23Å; P37-K39 PolarHBondContact O-N 3.27Å; K39-I41 VanDerWaalsContact C-N 3.34Å; K39-I41 PolarHBondContact O-N 3.33Å; K39-Y42 HydrophobicContact CD-CD1 4.27Å; K39-Y42 PolarHBondContact O-N 3.1Å; K39-L43 WeakPolarHBondContact O-CB 3.41Å; K39-L43 VanDerWaalsContact O-CG 3.26Å; K39-L43 WeakPolarHBondContact O-CG 3.35Å; K39-L43 PolarHBondContact O-N 3.36Å; K39-E125 IonicContact NZ-OE1 3.56Å; K39-E125 PolarHBondContact NZ-OE1 2.85Å; K39-E125 IonicContact NZ-OE2 2.89Å; K39-E125 PolarHBondContact NZ-OE2 2.86Å; K39-Y228 HydrophobicContact CB-CD2 4.2Å; K39-Y228 HydrophobicContact CB-CE1 4.45Å; K39-Y228 HydrophobicContact CB-CE2 4.05Å; K39-Y228 HydrophobicContact CB-CG 4.48Å; K39-Y228 HydrophobicContact CG-CE2 4.41Å
40	I	98.1	Very high	97.2	Very high	45 Å²	45	68.6 Å²	68.6	23%	0.231	32%	0.319	C	S	.	.	H	α-helix	trans	-60.5	-46.7	174.6	-66.9	171.9	0	0	0	110.5	L36 P37 Q38 N44 R225 A229	L36-I40 HydrophobicContact CD2-CD1 3.5Å; L36-I40 HydrophobicContact CD2-CG1 4.08Å; L36-I40 PolarHBondContact O-N 3.28Å; P37-I40 PolarHBondContact O-N 3.44Å; Q38-I40 PolarHBondContact O-N 2.85Å; I40-N44 WeakPolarHBondContact O-CB 3.48Å; I40-N44 PolarHBondContact O-N 2.94Å; I40-R225 HydrophobicContact CG2-CG 4.26Å; I40-A229 HydrophobicContact CD1-CB 4.01Å
41	I	98.1	Very high	97.1	Very high	100 Å²	100	67.1 Å²	67.1	51%	0.513	32%	0.318	S	S	.	.	H	α-helix	trans	-63.8	-47.5	179.5	-63.3	169	0	0	0	110.5	P37 Q38 K39 L43 N44 Q45	P37-I41 WeakPolarHBondContact O-CG1 3.42Å; P37-I41 PolarHBondContact O-N 2.87Å; Q38-I41 PolarHBondContact O-N 2.92Å; K39-I41 VanDerWaalsContact C-N 3.34Å; K39-I41 PolarHBondContact O-N 3.33Å; I41-L43 PolarHBondContact O-N 3.43Å; I41-N44 WeakPolarHBondContact O-CB 3.43Å; I41-N44 PolarHBondContact O-N 3.37Å; I41-Q45 WeakPolarHBondContact O-CG 3.41Å; I41-Q45 PolarHBondContact O-N 2.93Å
42	Y	98.3	Very high	97.1	Very high	88 Å²	88	67 Å²	67	35%	0.345	32%	0.317	S	S	.	.	H	α-helix	trans	-58.1	-49.4	178	168.1	-99.9	0	0	0	112.1	Q38 K39 N44 Q45 L46 E125	Q38-Y42 WeakPolarHBondContact O-CB 3.48Å; Q38-Y42 PolarHBondContact O-N 3.41Å; K39-Y42 HydrophobicContact CD-CD1 4.27Å; K39-Y42 PolarHBondContact O-N 3.1Å; Y42-N44 PolarHBondContact O-N 3.28Å; Y42-Q45 WeakPolarHBondContact O-CB 3.47Å; Y42-Q45 PolarHBondContact O-N 2.94Å; Y42-Q45 VanDerWaalsContact O-N 3.13Å; Y42-L46 HydrophobicContact CE1-CD2 4.37Å; Y42-L46 PolarHBondContact O-N 3.15Å; Y42-E125 HydrophobicContact CE1-CG 4.3Å; Y42-E125 VanDerWaalsContact CE1-OE1 3.27Å; Y42-E125 WeakPolarHBondContact CE1-OE1 3.39Å
43	L	98.4	Very high	97.2	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-65.8	-31.2	178.8	-67.6	172.6	0	0	0	111.7	K39 I41 L46 L47 E125 V221 L224 R225 Y228	K39-L43 WeakPolarHBondContact O-CB 3.41Å; K39-L43 VanDerWaalsContact O-CG 3.26Å; K39-L43 WeakPolarHBondContact O-CG 3.35Å; K39-L43 PolarHBondContact O-N 3.36Å; I41-L43 PolarHBondContact O-N 3.43Å; L43-L46 HydrophobicContact CD2-CD2 4.25Å; L43-L47 WeakPolarHBondContact O-CB 3.22Å; L43-L47 WeakPolarHBondContact O-CD1 3.46Å; L43-L47 VanDerWaalsContact O-CG 3.28Å; L43-L47 WeakPolarHBondContact O-CG 3.28Å; L43-L47 PolarHBondContact O-N 3.43Å; L43-E125 HydrophobicContact CD2-CB 4.41Å; L43-E125 HydrophobicContact CD2-CG 4.03Å; L43-V221 HydrophobicContact CD2-CG1 4.2Å; L43-L224 HydrophobicContact CD1-CB 4.03Å; L43-R225 HydrophobicContact CB-CB 3.97Å; L43-R225 HydrophobicContact CB-CG 4.25Å; L43-R225 HydrophobicContact CD1-CB 4.09Å; L43-Y228 HydrophobicContact CD1-CD2 3.67Å; L43-Y228 HydrophobicContact CD1-CE2 3.83Å
44	N	97.9	Very high	97.3	Very high	72 Å²	72	63.9 Å²	63.9	39%	0.385	31%	0.312	S	S	.	.	H	α-helix	trans	-65.2	-41.1	172.7	-168.9	69.9	0	0	0	112.3	I40 I41 Y42 L47 Q48 R225	I40-N44 WeakPolarHBondContact O-CB 3.48Å; I40-N44 PolarHBondContact O-N 2.94Å; I41-N44 WeakPolarHBondContact O-CB 3.43Å; I41-N44 PolarHBondContact O-N 3.37Å; Y42-N44 PolarHBondContact O-N 3.28Å; N44-L47 PolarHBondContact O-N 3.46Å; N44-Q48 WeakPolarHBondContact O-CG 3.35Å; N44-R225 PolarHBondContact OD1-NH1 2.97Å
45	Q	98	Very high	97.2	Very high	115 Å²	115	62.5 Å²	62.5	54%	0.537	33%	0.33	S	S	.	.	H	α-helix	trans	-66.2	-45.3	174.4	-70.3	170.5	-15.2	0	0	111.4	I41 Y42 L47 Q48	I41-Q45 WeakPolarHBondContact O-CG 3.41Å; I41-Q45 PolarHBondContact O-N 2.93Å; Y42-Q45 WeakPolarHBondContact O-CB 3.47Å; Y42-Q45 PolarHBondContact O-N 2.94Å; Y42-Q45 VanDerWaalsContact O-N 3.13Å; Q45-L47 PolarHBondContact O-N 2.76Å; Q45-Q48 WeakPolarHBondContact O-CA 3.48Å; Q45-Q48 WeakPolarHBondContact O-CB 3.34Å; Q45-Q48 PolarHBondContact O-N 3.46Å
46	L	97.5	Very high	97.1	Very high	11 Å²	11	64.1 Å²	64.1	6%	0.058	34%	0.342	C	S	.	.	H	α-helix	trans	-55.8	-39.8	175.8	-177.5	60.8	0	0	0	111.5	Y42 L43 Q48 E49 L52 L121 V221	Y42-L46 HydrophobicContact CE1-CD2 4.37Å; Y42-L46 PolarHBondContact O-N 3.15Å; L43-L46 HydrophobicContact CD2-CD2 4.25Å; L46-Q48 PolarHBondContact O-N 3.45Å; L46-E49 HydrophobicContact CD1-CG 4.28Å; L46-E49 WeakPolarHBondContact O-CB 3.41Å; L46-E49 WeakPolarHBondContact O-CG 3.49Å; L46-E49 PolarHBondContact O-N 2.91Å; L46-E49 VanDerWaalsContact O-N 3.12Å; L46-L52 HydrophobicContact CD1-CD1 4.13Å; L46-L52 HydrophobicContact CD2-CD1 4.49Å; L46-L52 HydrophobicContact CG-CD1 3.75Å; L46-L52 VanDerWaalsContact O-CD1 3.31Å; L46-L52 WeakPolarHBondContact O-CD1 3.4Å; L46-L121 HydrophobicContact CD1-CD1 4.26Å; L46-V221 HydrophobicContact CD2-CG1 4.12Å; L46-V221 HydrophobicContact CD2-CG2 4.47Å; L46-V221 HydrophobicContact CG-CG1 4.48Å
47	L	97.8	Very high	97	Very high	6 Å²	6	67 Å²	67	3%	0.031	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-10.8	175.1	-75.6	165.4	0	0	0	114.6	L43 N44 Q45 N53 V221 L222	L43-L47 WeakPolarHBondContact O-CB 3.22Å; L43-L47 WeakPolarHBondContact O-CD1 3.46Å; L43-L47 VanDerWaalsContact O-CG 3.28Å; L43-L47 WeakPolarHBondContact O-CG 3.28Å; L43-L47 PolarHBondContact O-N 3.43Å; N44-L47 PolarHBondContact O-N 3.46Å; Q45-L47 PolarHBondContact O-N 2.76Å; L47-N53 PolarHBondContact O-ND2 3.04Å; L47-V221 HydrophobicContact CD1-CG1 4.19Å; L47-V221 HydrophobicContact CD2-CB 3.96Å; L47-V221 HydrophobicContact CD2-CG1 3.7Å; L47-V221 HydrophobicContact CG-CB 4.43Å; L47-V221 HydrophobicContact CG-CG1 3.62Å; L47-L222 HydrophobicContact CD1-CD2 3.66Å; L47-L222 HydrophobicContact CD1-CG 4.32Å; L47-L222 HydrophobicContact CD2-CD2 3.94Å; L47-L222 HydrophobicContact CD2-CG 3.94Å; L47-L222 HydrophobicContact CG-CD2 4.46Å
48	Q	97.6	Very high	96.9	Very high	129 Å²	129	68.1 Å²	68.1	60%	0.603	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-12.6	172.3	-56.5	-49.7	-66	0	0	112.7	N44 Q45 L46 N53	N44-Q48 WeakPolarHBondContact O-CG 3.35Å; Q45-Q48 WeakPolarHBondContact O-CA 3.48Å; Q45-Q48 WeakPolarHBondContact O-CB 3.34Å; Q45-Q48 PolarHBondContact O-N 3.46Å; L46-Q48 PolarHBondContact O-N 3.45Å; Q48-N53 VanDerWaalsContact C-ND2 3.32Å; Q48-N53 PolarHBondContact O-ND2 3.34Å
49	E	96.8	Very high	96.7	Very high	107 Å²	107	65.7 Å²	65.7	50%	0.5	36%	0.357	S	S	.	.	S	Bend	trans	-63.5	141.7	179.9	-63.8	-65.8	153.7	0	0	111.3	L46 S51 L52 N53	L46-E49 HydrophobicContact CD1-CG 4.28Å; L46-E49 WeakPolarHBondContact O-CB 3.41Å; L46-E49 WeakPolarHBondContact O-CG 3.49Å; L46-E49 PolarHBondContact O-N 2.91Å; L46-E49 VanDerWaalsContact O-N 3.12Å; E49-S51 PolarHBondContact O-N 3.3Å; E49-S51 VanDerWaalsContact O-N 3.14Å; E49-L52 PolarHBondContact O-N 3.49Å; E49-N53 PolarHBondContact O-N 3.49Å; E49-N53 PolarHBondContact O-ND2 3.04Å
50	D	96.3	Very high	96.6	Very high	142 Å²	142	64.4 Å²	64.4	76%	0.759	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-57.4	-32.8	-179.3	-69.6	-22.2	0	0	0	112	L52 N53	D50-L52 PolarHBondContact O-N 2.88Å; D50-N53 CarbonylContact O-C 3.53Å; D50-N53 PolarHBondContact O-N 3.27Å
51	S	95.2	Very high	96.4	Very high	49 Å²	49	68.4 Å²	68.4	34%	0.343	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-61.7	-23.5	177.7	60.2	0	0	0	0	113.5	E49 L118 Y214	E49-S51 PolarHBondContact O-N 3.3Å; E49-S51 VanDerWaalsContact O-N 3.14Å; S51-L118 WeakPolarHBondContact O-CD2 3.41Å; S51-Y214 WeakPolarHBondContact O-CE2 3.34Å
52	L	96.5	Very high	96.2	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-106.7	3.6	177.3	-78.1	165.3	0	0	0	112.9	L46 E49 D50 L118 Y214 R218 V221	L46-L52 HydrophobicContact CD1-CD1 4.13Å; L46-L52 HydrophobicContact CD2-CD1 4.49Å; L46-L52 HydrophobicContact CG-CD1 3.75Å; L46-L52 VanDerWaalsContact O-CD1 3.31Å; L46-L52 WeakPolarHBondContact O-CD1 3.4Å; E49-L52 PolarHBondContact O-N 3.49Å; D50-L52 PolarHBondContact O-N 2.88Å; L52-L118 HydrophobicContact CD2-CD2 3.96Å; L52-L118 HydrophobicContact CG-CD2 3.91Å; L52-Y214 PolarHBondContact O-OH 3.4Å; L52-R218 HydrophobicContact CD2-CB 4.03Å; L52-R218 HydrophobicContact CD2-CG 4.17Å; L52-R218 WeakPolarHBondContact O-CD 3.36Å; L52-R218 PolarHBondContact O-NE 3.28Å; L52-V221 HydrophobicContact CD1-CG2 4.3Å
53	N	96.8	Very high	96	Very high	70 Å²	70	64.5 Å²	64.5	37%	0.374	36%	0.357	S	S	.	.			trans	-126.4	39.4	180	-65.9	-64.5	0	0	0	112.2	L47 Q48 E49 D50 A55 Y214	L47-N53 PolarHBondContact O-ND2 3.04Å; Q48-N53 VanDerWaalsContact C-ND2 3.32Å; Q48-N53 PolarHBondContact O-ND2 3.34Å; E49-N53 PolarHBondContact O-N 3.49Å; E49-N53 PolarHBondContact O-ND2 3.04Å; D50-N53 CarbonylContact O-C 3.53Å; D50-N53 PolarHBondContact O-N 3.27Å; N53-A55 PolarHBondContact O-N 2.89Å; N53-Y214 PolarHBondContact N-OH 3.34Å
54	V	96.3	Very high	95.8	Very high	35 Å²	35	65.6 Å²	65.6	21%	0.212	36%	0.363	C	S	.	.			trans	-66.8	115.6	174	-176.9	0	0	0	0	109.8	D56 S59 L60 Y214	V54-D56 WeakPolarHBondContact CG1-O 3.46Å; V54-S59 VanDerWaalsContact CG1-OG 3.29Å; V54-S59 WeakPolarHBondContact CG1-OG 3.18Å; V54-L60 HydrophobicContact CG1-CG 4.35Å; V54-L60 HydrophobicContact CG2-CD2 4.3Å; V54-Y214 HydrophobicContact CB-CE1 4.35Å; V54-Y214 HydrophobicContact CB-CE2 4.14Å; V54-Y214 WeakPolarHBondContact CB-OH 3.28Å; V54-Y214 HydrophobicContact CG2-CE2 3.81Å; V54-Y214 PolarHBondContact N-OH 3.34Å
55	A	94.5	Very high	95.5	Very high	108 Å²	108	67.9 Å²	67.9	89%	0.893	38%	0.375	S	S	*	.	S	Bend	trans	-76.7	-40.1	179.7	0	0	0	0	0	112.9	N53	N53-A55 PolarHBondContact O-N 2.89Å
56	D	95.6	Very high	95.1	Very high	90 Å²	90	62.8 Å²	62.8	48%	0.481	35%	0.351	S	S	.	.			trans	-111.5	107.8	178.1	178.4	6.9	0	0	0	110	V54 T58 S59	V54-D56 WeakPolarHBondContact CG1-O 3.46Å; D56-T58 PolarHBondContact O-N 2.74Å; D56-T58 WeakPolarHBondContact OD1-CB 3.45Å; D56-T58 WeakPolarHBondContact OD1-CG2 3.4Å; D56-T58 PolarHBondContact OD1-N 2.92Å; D56-T58 PolarHBondContact OD1-OG1 3.21Å; D56-T58 PolarHBondContact OD2-OG1 3.38Å; D56-S59 VanDerWaalsContact O-CB 3.3Å; D56-S59 WeakPolarHBondContact O-CB 3.5Å; D56-S59 PolarHBondContact O-N 2.92Å; D56-S59 VanDerWaalsContact O-N 3.15Å; D56-S59 PolarHBondContact O-OG 3.18Å
57	L	94.8	Very high	94.7	Very high	61 Å²	61	64.5 Å²	64.5	32%	0.319	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-66.3	-20.6	-178.5	-58.1	-173	0	0	0	112.6	S59 L60 E211 Y214	L57-S59 PolarHBondContact O-N 3.31Å; L57-S59 VanDerWaalsContact O-N 3.16Å; L57-L60 HydrophobicContact CB-CD1 4.31Å; L57-L60 HydrophobicContact CD2-CD1 3.88Å; L57-L60 VanDerWaalsContact O-CB 3.22Å; L57-L60 WeakPolarHBondContact O-CB 3.34Å; L57-L60 PolarHBondContact O-N 3.39Å; L57-E211 HydrophobicContact CB-CB 4.5Å; L57-E211 HydrophobicContact CB-CG 4.05Å; L57-E211 HydrophobicContact CD1-CB 4.45Å; L57-Y214 HydrophobicContact CD2-CD1 3.5Å; L57-Y214 HydrophobicContact CD2-CE1 3.47Å; L57-Y214 VanDerWaalsContact CD2-CE1 3.47Å
58	T	93.5	Very high	94.3	Very high	65 Å²	65	69.6 Å²	69.6	40%	0.399	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-63.4	-24	175.8	72.2	0	0	0	0	111.9	D56 L60 R61	D56-T58 PolarHBondContact O-N 2.74Å; D56-T58 WeakPolarHBondContact OD1-CB 3.45Å; D56-T58 WeakPolarHBondContact OD1-CG2 3.4Å; D56-T58 PolarHBondContact OD1-N 2.92Å; D56-T58 PolarHBondContact OD1-OG1 3.21Å; D56-T58 PolarHBondContact OD2-OG1 3.38Å; T58-L60 PolarHBondContact O-N 3.22Å; T58-R61 WeakPolarHBondContact O-CB 3.42Å; T58-R61 VanDerWaalsContact O-CG 3.29Å; T58-R61 WeakPolarHBondContact O-CG 3.37Å; T58-R61 PolarHBondContact O-N 2.96Å; T58-R61 VanDerWaalsContact O-N 3.12Å
59	S	95.4	Very high	93.7	Very high	54 Å²	54	66.3 Å²	66.3	38%	0.378	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-64.8	-18.2	172.9	75.1	0	0	0	0	113.3	V54 D56 L57 R61 K114	V54-S59 VanDerWaalsContact CG1-OG 3.29Å; V54-S59 WeakPolarHBondContact CG1-OG 3.18Å; D56-S59 VanDerWaalsContact O-CB 3.3Å; D56-S59 WeakPolarHBondContact O-CB 3.5Å; D56-S59 PolarHBondContact O-N 2.92Å; D56-S59 VanDerWaalsContact O-N 3.15Å; D56-S59 PolarHBondContact O-OG 3.18Å; L57-S59 PolarHBondContact O-N 3.31Å; L57-S59 VanDerWaalsContact O-N 3.16Å; S59-R61 VanDerWaalsContact C-N 3.29Å; S59-K114 PolarHBondContact O-NZ 2.96Å
60	L	95	Very high	93.1	Very high	5 Å²	5	68 Å²	68	3%	0.026	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-78.6	-12.7	176.1	-62	167.7	0	0	0	112.6	V54 L57 T58 A62 N112 K114 Y214	V54-L60 HydrophobicContact CG1-CG 4.35Å; V54-L60 HydrophobicContact CG2-CD2 4.3Å; L57-L60 HydrophobicContact CB-CD1 4.31Å; L57-L60 HydrophobicContact CD2-CD1 3.88Å; L57-L60 VanDerWaalsContact O-CB 3.22Å; L57-L60 WeakPolarHBondContact O-CB 3.34Å; L57-L60 PolarHBondContact O-N 3.39Å; T58-L60 PolarHBondContact O-N 3.22Å; L60-A62 PolarHBondContact O-N 3.41Å; L60-A62 VanDerWaalsContact O-N 3.12Å; L60-N112 PolarHBondContact O-ND2 3.19Å; L60-K114 HydrophobicContact CD2-CB 4.27Å; L60-K114 HydrophobicContact CD2-CD 4.2Å; L60-Y214 HydrophobicContact CD1-CD1 3.78Å; L60-Y214 HydrophobicContact CD1-CD2 3.83Å; L60-Y214 HydrophobicContact CD1-CE1 4.48Å; L60-Y214 HydrophobicContact CD1-CG 3.4Å; L60-Y214 VanDerWaalsContact CD1-CG 3.4Å; L60-Y214 HydrophobicContact CD2-CD2 4.15Å
61	R	94.2	Very high	92.5	Very high	130 Å²	130	66.6 Å²	66.6	49%	0.491	39%	0.39	S	S	.	.			trans	-64.4	115	-175.3	-67.5	-179.4	-179.3	-177.1	-0.7	111	T58 S59 H207 E211	T58-R61 WeakPolarHBondContact O-CB 3.42Å; T58-R61 VanDerWaalsContact O-CG 3.29Å; T58-R61 WeakPolarHBondContact O-CG 3.37Å; T58-R61 PolarHBondContact O-N 2.96Å; T58-R61 VanDerWaalsContact O-N 3.12Å; S59-R61 VanDerWaalsContact C-N 3.29Å; R61-H207 HydrophobicContact CG-CB 4.14Å; R61-E211 IonicContact CZ-OE1 3.47Å; R61-E211 IonicContact NE-OE1 3.72Å; R61-E211 PolarHBondContact NE-OE1 2.85Å; R61-E211 IonicContact NH2-OE1 3.15Å; R61-E211 PolarHBondContact NH2-OE1 3.38Å; R61-E211 VanDerWaalsContact NH2-OE1 3.15Å
62	A	94.5	Very high	91.8	Very high	16 Å²	16	68.6 Å²	68.6	13%	0.132	40%	0.402	C	S	.	.			trans	-75.8	147.6	170	0	0	0	0	0	110.4	L60 L64 N112 H207	L60-A62 PolarHBondContact O-N 3.41Å; L60-A62 VanDerWaalsContact O-N 3.12Å; A62-L64 PolarHBondContact O-N 3.25Å; A62-N112 HydrophobicContact CB-CB 4.12Å; A62-H207 PolarHBondContact O-CE1 3.39Å
63	P	93.4	Very high	91	Very high	90 Å²	90	73.5 Å²	73.5	58%	0.584	43%	0.434	S	S	*	.			trans	-61.1	136.1	175.7	26	-33.6	0	0	0	110.9
64	L	93.5	Very high	89.7	Confident	23 Å²	23	78.9 Å²	78.9	12%	0.12	45%	0.454	C	S	.	.			trans	-122.8	80.5	179.3	-170.1	66.3	0	0	0	109.6	A62 I66 L109 R203 V206	A62-L64 PolarHBondContact O-N 3.25Å; L64-I66 HydrophobicContact CD1-CD1 3.82Å; L64-I66 HydrophobicContact CD1-CG1 4.22Å; L64-I66 HydrophobicContact CD2-CD1 4Å; L64-I66 HydrophobicContact CG-CD1 3.72Å; L64-I66 HydrophobicContact CG-CG1 4.04Å; L64-I66 PolarHBondContact O-N 2.97Å; L64-L109 HydrophobicContact CD1-CD1 4.28Å; L64-L109 HydrophobicContact CD1-CD2 4.44Å; L64-R203 HydrophobicContact CD2-CB 3.91Å; L64-R203 HydrophobicContact CD2-CG 3.96Å; L64-V206 HydrophobicContact CD1-CG1 4.43Å; L64-V206 HydrophobicContact CD2-CB 4.12Å; L64-V206 HydrophobicContact CD2-CG1 4.41Å; L64-V206 HydrophobicContact CD2-CG2 4.11Å
65	D	91.6	Very high	87.9	Confident	120 Å²	120	85 Å²	85	64%	0.642	49%	0.486	S	S	*	.			trans	-78.2	53.5	-170.5	-59.9	-31.9	0	0	0	113
66	I	90.9	Very high	85.9	Confident	7 Å²	7	86.7 Å²	86.7	4%	0.036	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-90.9	126.3	174.6	-58	172.2	0	0	0	108.2	L64 I68 L109 A193 T197 R203	L64-I66 HydrophobicContact CD1-CD1 3.82Å; L64-I66 HydrophobicContact CD1-CG1 4.22Å; L64-I66 HydrophobicContact CD2-CD1 4Å; L64-I66 HydrophobicContact CG-CD1 3.72Å; L64-I66 HydrophobicContact CG-CG1 4.04Å; L64-I66 PolarHBondContact O-N 2.97Å; I66-I68 PolarHBondContact O-N 2.8Å; I66-L109 HydrophobicContact CD1-CD1 3.92Å; I66-L109 HydrophobicContact CG1-CD1 3.74Å; I66-L109 HydrophobicContact CG1-CD2 4Å; I66-A193 HydrophobicContact CD1-CB 3.54Å; I66-T197 HydrophobicContact CG2-CG2 3.69Å; I66-R203 VanDerWaalsContact O-CZ 3.25Å; I66-R203 PolarHBondContact O-NH1 3.24Å; I66-R203 PolarHBondContact O-NH2 3.41Å
67	P	89.6	Confident	83.6	Confident	47 Å²	47	90.2 Å²	90.2	31%	0.305	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-56.7	135.2	177	-24.8	34.1	0	0	0	112.3	H104 R203	P67-H104 HydrophobicContact CB-CB 3.83Å; P67-H104 HydrophobicContact CG-CB 3.77Å; P67-R203 PolarHBondContact O-NH2 3.26Å; P67-R203 VanDerWaalsContact O-NH2 3.08Å
68	I	88.2	Confident	81.2	Confident	114 Å²	114	96.4 Å²	96.4	59%	0.585	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-90.1	127	175.4	-60.3	173.7	0	0	0	108	I66 M200	I66-I68 PolarHBondContact O-N 2.8Å; I68-M200 HydrophobicContact CD1-CE 4.3Å
69	P	85.6	Confident	78.7	Confident	59 Å²	59	100.7 Å²	100.7	38%	0.383	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-64.9	140.8	176.5	-22.1	34.7	0	0	0	112.1	T197 H198	P69-T197 WeakPolarHBondContact CD-O 3.21Å; P69-T197 WeakPolarHBondContact CG-OG1 3.36Å; P69-H198 HydrophobicContact CG-CB 4.28Å
70	D	84.6	Confident	76.3	Confident	144 Å²	144	104.3 Å²	104.3	77%	0.77	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-68.5	145	169.4	-67	-45.5	0	0	0	110.5
71	P	83.6	Confident	73.6	Confident	111 Å²	111	111.6 Å²	111.6	72%	0.721	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-59.7	143.7	173.8	25.1	-32.5	0	0	0	110
72	P	80.8	Confident	71.2	Confident	91 Å²	91	114.3 Å²	114.3	59%	0.591	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-58.8	147.8	175	25.6	-32.9	0	0	0	109.8	K74 F100	P72-K74 PolarHBondContact O-N 2.92Å; P72-F100 HydrophobicContact CB-CZ 4.07Å
73	P	78.3	Confident	68.4	Low	103 Å²	103	122.5 Å²	122.5	67%	0.669	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-52.4	137.1	172.4	-20.4	30.4	0	0	0	109.6	D75	P73-D75 PolarHBondContact O-N 3.02Å
74	K	70.6	Confident	65.6	Low	183 Å²	183	125.8 Å²	125.8	80%	0.796	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-66.1	124.3	167.6	-69.1	179.6	174.3	178.1	0	106.7	P72 D76	P72-K74 PolarHBondContact O-N 2.92Å; K74-D76 PolarHBondContact O-N 3.01Å
75	D	57.9	Low	62.9	Low	165 Å²	165	133 Å²	133	88%	0.882	69%	0.686	S	S	*	*			trans	-66.3	90.4	166.1	-75.7	-30.8	0	0	0	106.8	P73 E77	P73-D75 PolarHBondContact O-N 3.02Å; D75-E77 PolarHBondContact O-N 3.27Å; D75-E77 VanDerWaalsContact O-N 3.1Å
76	D	52.2	Low	60.1	Low	143 Å²	143	137 Å²	137	77%	0.765	70%	0.698	S	S	*	*			trans	-65	108.5	167.9	-72.3	-27.1	0	0	0	107.1	K74	K74-D76 PolarHBondContact O-N 3.01Å
77	E	48.3	Very low	57.7	Low	164 Å²	164	146.3 Å²	146.3	77%	0.766	74%	0.741	S	S	*	*			trans	38	96.5	156.5	-62.6	177.6	172.8	0	0	115.6	D75 E79	D75-E77 PolarHBondContact O-N 3.27Å; D75-E77 VanDerWaalsContact O-N 3.1Å; E77-E79 PolarHBondContact O-N 3.14Å
78	M	42.5	Very low	55	Low	190 Å²	190	147.6 Å²	147.6	94%	0.936	76%	0.763	S	S	*	*			trans	-62.8	86.5	154.4	-79.5	-170.1	-172.7	0	0	108.5	T80	M78-T80 PolarHBondContact O-N 3.11Å
79	E	42.1	Very low	52.8	Low	156 Å²	156	152.1 Å²	152.1	73%	0.729	78%	0.778	S	S	*	*			trans	-51.2	109.2	159	-86.9	-70.9	159	0	0	107.8	E77 D81	E77-E79 PolarHBondContact O-N 3.14Å; E79-D81 PolarHBondContact O-N 3.5Å
80	T	45	Very low	50.3	Low	130 Å²	130	160.7 Å²	160.7	80%	0.798	80%	0.803	S	S	*	*			trans	-64	109.5	166.8	42.6	0	0	0	0	108.2	M78	M78-T80 PolarHBondContact O-N 3.11Å
81	D	38.9	Very low	48.5	Very low	157 Å²	157	161.1 Å²	161.1	84%	0.84	81%	0.805	S	S	*	*			trans	-132.3	130.4	156.1	-142.1	-3.5	0	0	0	113.2	E79	E79-D81 PolarHBondContact O-N 3.5Å
82	K	43.1	Very low	46.3	Very low	187 Å²	187	164.6 Å²	164.6	81%	0.813	81%	0.809	S	S	*	*			trans	-82.2	134.6	-179.1	-69.9	170.2	174.4	171.9	0	108.4
83	Q	35	Very low	44.8	Very low	189 Å²	189	171.6 Å²	171.6	88%	0.883	82%	0.823	S	S	*	*			trans	-174	120.9	131.5	-105.7	166.8	10	0	0	114.9
84	E	35.9	Very low	43.2	Very low	159 Å²	159	176.4 Å²	176.4	74%	0.743	83%	0.834	S	S	*	*			trans	26.7	131.4	143.9	-58.5	-162.1	157.4	0	0	124.7
85	K	36.5	Very low	41.6	Very low	175 Å²	175	170.9 Å²	170.9	76%	0.761	83%	0.829	S	S	*	*			trans	60.1	114.4	137	-73	177	177.6	160.7	0	119.9
86	K	33.1	Very low	40.7	Very low	204 Å²	204	171.1 Å²	171.1	89%	0.887	83%	0.83	S	S	*	*				175.1	138.8	102	-97.9	175.4	179.8	174.9	0	112.2
87	E	40.8	Very low	40	Very low	202 Å²	202	170.8 Å²	170.8	94%	0.944	83%	0.828	S	S	*	*			trans	-58.3	143.6	168.6	-65.3	174.2	133.4	0	0	112.3
88	G	31.6	Very low	39.6	Very low	73 Å²	73	169 Å²	169	75%	0.753	83%	0.831	S	S	*	*			trans	171	104.7	168.5	0	0	0	0	0	113.3	R90	G88-R90 PolarHBondContact O-N 3.47Å
89	K	42.7	Very low	39.6	Very low	210 Å²	210	166.5 Å²	166.5	91%	0.913	82%	0.82	S	S	*	*			trans	-38.4	128	169.1	-81.1	172.6	170.7	172.6	0	112.6
90	R	31.8	Very low	39.7	Very low	239 Å²	239	166.7 Å²	166.7	90%	0.902	82%	0.819	S	S	*	*			trans	-164.6	118.6	141.7	-110	164.6	-176.9	-178.8	0.8	111.7	G88 K92	G88-R90 PolarHBondContact O-N 3.47Å; R90-K92 PolarHBondContact O-N 3.36Å
91	D	46.8	Very low	39.6	Very low	153 Å²	153	167.3 Å²	167.3	82%	0.818	82%	0.817	S	S	*	*			trans	-34.6	116.8	162.1	-162.1	-1	0	0	0	112.6
92	K	38.7	Very low	39.9	Very low	184 Å²	184	164.8 Å²	164.8	80%	0.8	81%	0.807	S	S	*	*			trans	-146	84.1	166.4	-80.2	-169	-179.9	174.8	0	109.5	R90 K94	R90-K92 PolarHBondContact O-N 3.36Å; K92-K94 VanDerWaalsContact C-N 3.33Å; K92-K94 PolarHBondContact O-N 2.96Å
93	R	48.6	Very low	40.4	Very low	237 Å²	237	161 Å²	161	89%	0.894	80%	0.799	S	S	*	*			trans	-51	104.5	136.6	-77.4	177.7	176.6	172.2	-0.9	107.6
94	K	45	Very low	41.4	Very low	204 Å²	204	157.8 Å²	157.8	89%	0.887	78%	0.784	S	S	*	*			trans	172	115.7	156.2	-99.2	163.7	-173.5	-169.8	0	108.3	K92	K92-K94 VanDerWaalsContact C-N 3.33Å; K92-K94 PolarHBondContact O-N 2.96Å
95	G	36.5	Very low	43.1	Very low	68 Å²	68	159.7 Å²	159.7	70%	0.701	79%	0.79	S	S	*	*			trans	158.2	17.3	172.9	0	0	0	0	0	116.5	N97	G95-N97 PolarHBondContact O-N 2.91Å
96	L	39.9	Very low	45.3	Very low	170 Å²	170	153.5 Å²	153.5	89%	0.89	77%	0.768	S	S	*	*			trans	-88.2	97.6	153.7	-133.6	76.9	0	0	0	105.7	P98	L96-P98 WeakPolarHBondContact O-CD 3.32Å
97	N	36.3	Very low	47.9	Very low	135 Å²	135	146.4 Å²	146.4	72%	0.722	75%	0.752	S	S	*	*			trans	-56.1	116.7	170.6	-81.8	-19	0	0	0	107.9	G95 L99	G95-N97 PolarHBondContact O-N 2.91Å; N97-L99 HydrophobicContact CB-CB 4.45Å; N97-L99 PolarHBondContact O-N 3.29Å
98	P	40.9	Very low	50.3	Low	128 Å²	128	145.4 Å²	145.4	83%	0.831	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-74.2	20.3	176.2	-9.7	27.4	0	0	0	112.5	L96	L96-P98 WeakPolarHBondContact O-CD 3.32Å
99	L	42.1	Very low	53.3	Low	137 Å²	137	143.6 Å²	143.6	72%	0.717	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-87.1	-7.6	-166.2	-165.7	58.6	0	0	0	113.5	N97	N97-L99 HydrophobicContact CB-CB 4.45Å; N97-L99 PolarHBondContact O-N 3.29Å
100	F	43.7	Very low	55.8	Low	159 Å²	159	136 Å²	136	70%	0.697	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-98.3	2.8	-169.1	-118	-87.8	0	0	0	116.7	P72	P72-F100 HydrophobicContact CB-CZ 4.07Å
101	L	44.7	Very low	58.9	Low	144 Å²	144	126 Å²	126	75%	0.754	66%	0.662	S	S	*	*			trans	-143.9	68.3	170.5	-87.9	110.2	0	0	0	109.9	V103	L101-V103 HydrophobicContact CB-CG2 4.24Å; L101-V103 HydrophobicContact CD2-CG2 3.82Å; L101-V103 PolarHBondContact O-N 3.43Å
102	T	44.8	Very low	61.3	Low	103 Å²	103	118.9 Å²	118.9	63%	0.632	62%	0.624	S	S	*	*			trans	-67.5	80.4	148.9	45.4	0	0	0	0	106.9	H104	T102-H104 PolarHBondContact O-N 2.95Å; T102-H104 PolarHBondContact O-ND1 3.43Å
103	V	53.4	Low	64.1	Low	107 Å²	107	116 Å²	116	65%	0.648	61%	0.613	S	S	*	*			trans	-59.5	91.5	160.6	179.2	0	0	0	0	104.6	L101 K105	L101-V103 HydrophobicContact CB-CG2 4.24Å; L101-V103 HydrophobicContact CD2-CG2 3.82Å; L101-V103 PolarHBondContact O-N 3.43Å; V103-K105 PolarHBondContact O-N 2.97Å
104	H	56.2	Low	66.5	Low	123 Å²	123	109.9 Å²	109.9	57%	0.569	59%	0.593	S	S	*	*			trans	-57.5	111.1	167.3	-77.2	78.4	0	0	0	104.9	P67 T102 C106	P67-H104 HydrophobicContact CB-CB 3.83Å; P67-H104 HydrophobicContact CG-CB 3.77Å; T102-H104 PolarHBondContact O-N 2.95Å; T102-H104 PolarHBondContact O-ND1 3.43Å; H104-C106 PolarHBondContact O-N 3.35Å
105	K	70.9	Confident	69	Low	199 Å²	199	100.1 Å²	100.1	87%	0.865	55%	0.551	S	S	*	*			trans	-56.4	112.6	179.1	-75.5	-176.3	176.6	179.9	0	106.8	V103 G107	V103-K105 PolarHBondContact O-N 2.97Å; K105-G107 PolarHBondContact O-N 3.05Å
106	C	82.1	Confident	71.9	Confident	45 Å²	45	99.6 Å²	99.6	30%	0.304	53%	0.531	S	S	.	.			trans	-58.4	132.8	177.4	-173.5	0	0	0	0	108.8	H104	H104-C106 PolarHBondContact O-N 3.35Å
107	G	87.5	Confident	74.6	Confident	54 Å²	54	94.9 Å²	94.9	56%	0.557	51%	0.512	S	S	*	.			trans	-70.8	-174.9	175.7	0	0	0	0	0	112.4	K105 L109	K105-G107 PolarHBondContact O-N 3.05Å; G107-L109 PolarHBondContact O-N 3.21Å
108	F	92.2	Very high	77.6	Confident	182 Å²	182	88.7 Å²	88.7	80%	0.798	48%	0.479	S	S	*	.			trans	-65.1	128.2	171.6	174.3	-105.6	0	0	0	110.4	P110	F108-P110 HydrophobicContact CE1-CB 3.93Å; F108-P110 HydrophobicContact CZ-CB 4.45Å
109	L	94.5	Very high	80.3	Confident	35 Å²	35	82.7 Å²	82.7	18%	0.183	44%	0.44	C	S	.	.			trans	-111.6	112.1	177.7	-60.8	176.9	0	0	0	109.2	L64 I66 G107 V190	L64-L109 HydrophobicContact CD1-CD1 4.28Å; L64-L109 HydrophobicContact CD1-CD2 4.44Å; I66-L109 HydrophobicContact CD1-CD1 3.92Å; I66-L109 HydrophobicContact CG1-CD1 3.74Å; I66-L109 HydrophobicContact CG1-CD2 4Å; G107-L109 PolarHBondContact O-N 3.21Å; L109-V190 HydrophobicContact CB-CG1 4.23Å; L109-V190 HydrophobicContact CD1-CG1 3.51Å
110	P	95.7	Very high	82.9	Confident	50 Å²	50	79 Å²	79	33%	0.325	43%	0.43	S	S	.	.			trans	-74.9	168.8	-178.2	29.8	-34.2	0	0	0	113.7	F108 R186	F108-P110 HydrophobicContact CE1-CB 3.93Å; F108-P110 HydrophobicContact CZ-CB 4.45Å; P110-R186 PolarHBondContact O-NH1 3.29Å
111	G	96.1	Very high	85.5	Confident	30 Å²	30	74.8 Å²	74.8	31%	0.309	41%	0.414	S	S	.	.			trans	-70.6	170.7	167.3	0	0	0	0	0	112.4	E113	G111-E113 PolarHBondContact O-N 2.98Å
112	N	98.1	Very high	88	Confident	3 Å²	3	68 Å²	68	2%	0.016	38%	0.378	C	S	.	.			trans	-83.8	101.8	172.1	-171.4	-43.1	0	0	0	110.3	L60 A62 K114 V115 L116 D210	L60-N112 PolarHBondContact O-ND2 3.19Å; A62-N112 HydrophobicContact CB-CB 4.12Å; N112-K114 PolarHBondContact O-N 2.9Å; N112-K114 PolarHBondContact OD1-N 3.17Å; N112-K114 VanDerWaalsContact OD1-N 3.11Å; N112-V115 HydrophobicContact CB-CB 4.11Å; N112-V115 HydrophobicContact CB-CG2 4.1Å; N112-V115 PolarHBondContact O-N 3.49Å; N112-V115 PolarHBondContact OD1-N 2.84Å; N112-L116 WeakPolarHBondContact O-CB 3.44Å; N112-L116 VanDerWaalsContact O-CG 3.27Å; N112-L116 WeakPolarHBondContact O-CG 3.5Å; N112-L116 PolarHBondContact O-N 3.18Å; N112-D210 PolarHBondContact ND2-OD2 3.1Å
113	E	97.8	Very high	90.6	Very high	122 Å²	122	66.7 Å²	66.7	57%	0.57	36%	0.364	S	S	*	.	H	α-helix	trans	-58.7	-32.4	-176.1	-65.8	-56.9	144.9	0	0	113.9	G111 S117	G111-E113 PolarHBondContact O-N 2.98Å; E113-S117 WeakPolarHBondContact O-CB 3.24Å; E113-S117 PolarHBondContact O-N 2.77Å; E113-S117 PolarHBondContact O-OG 3.44Å
114	K	97.1	Very high	92.7	Very high	109 Å²	109	64.6 Å²	64.6	47%	0.474	35%	0.353	S	S	.	.	H	α-helix	trans	-69.2	-46.1	178	-65.4	-177.5	177.5	-175.9	0	110.9	S59 L60 N112 S117 L118	S59-K114 PolarHBondContact O-NZ 2.96Å; L60-K114 HydrophobicContact CD2-CB 4.27Å; L60-K114 HydrophobicContact CD2-CD 4.2Å; N112-K114 PolarHBondContact O-N 2.9Å; N112-K114 PolarHBondContact OD1-N 3.17Å; N112-K114 VanDerWaalsContact OD1-N 3.11Å; K114-S117 PolarHBondContact O-N 3.47Å; K114-L118 PolarHBondContact O-N 2.98Å
115	V	97.9	Very high	94.8	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-66.2	-39.8	176.1	-179.9	0	0	0	0	110.8	N112 S117 L118 L119 Y182 D210 A213 L217	N112-V115 HydrophobicContact CB-CB 4.11Å; N112-V115 HydrophobicContact CB-CG2 4.1Å; N112-V115 PolarHBondContact O-N 3.49Å; N112-V115 PolarHBondContact OD1-N 2.84Å; V115-S117 VanDerWaalsContact C-N 3.35Å; V115-S117 PolarHBondContact O-N 2.85Å; V115-L118 PolarHBondContact O-N 3.49Å; V115-L119 HydrophobicContact CG1-CD1 3.95Å; V115-L119 HydrophobicContact CG1-CG 4.43Å; V115-L119 WeakPolarHBondContact O-CB 3.42Å; V115-L119 WeakPolarHBondContact O-CG 3.39Å; V115-L119 PolarHBondContact O-N 3.13Å; V115-Y182 HydrophobicContact CG1-CD1 4.48Å; V115-Y182 HydrophobicContact CG1-CE1 3.71Å; V115-Y182 HydrophobicContact CG1-CE2 4.21Å; V115-Y182 WeakPolarHBondContact CG1-OH 3.44Å; V115-D210 HydrophobicContact CG2-CB 4.32Å; V115-A213 HydrophobicContact CG1-CB 4.12Å; V115-L217 HydrophobicContact CG1-CD1 4.06Å
116	L	98.1	Very high	96.1	Very high	57 Å²	57	49.9 Å²	49.9	30%	0.298	29%	0.287	S	S	.	.	H	α-helix	trans	-62.6	-40.4	176	-70	175.2	0	0	0	112.4	N112 L119 A120 F183	N112-L116 WeakPolarHBondContact O-CB 3.44Å; N112-L116 VanDerWaalsContact O-CG 3.27Å; N112-L116 WeakPolarHBondContact O-CG 3.5Å; N112-L116 PolarHBondContact O-N 3.18Å; L116-L119 HydrophobicContact CD2-CD1 4.39Å; L116-L119 WeakPolarHBondContact O-CB 3.37Å; L116-L119 PolarHBondContact O-N 3.5Å; L116-A120 PolarHBondContact O-N 2.65Å; L116-F183 HydrophobicContact CD2-CE1 3.74Å; L116-F183 HydrophobicContact CD2-CZ 4.24Å
117	S	97.4	Very high	96.9	Very high	70 Å²	70	55 Å²	55	49%	0.49	30%	0.3	S	S	.	.	H	α-helix	trans	-63.8	-43.9	175.5	-61.1	0	0	0	0	111.4	E113 K114 V115 A120 L121	E113-S117 WeakPolarHBondContact O-CB 3.24Å; E113-S117 PolarHBondContact O-N 2.77Å; E113-S117 PolarHBondContact O-OG 3.44Å; K114-S117 PolarHBondContact O-N 3.47Å; V115-S117 VanDerWaalsContact C-N 3.35Å; V115-S117 PolarHBondContact O-N 2.85Å; S117-A120 WeakPolarHBondContact O-CB 3.27Å; S117-A120 PolarHBondContact O-N 3.34Å; S117-L121 PolarHBondContact O-N 2.9Å
118	L	97.7	Very high	97.4	Very high	5 Å²	5	54 Å²	54	3%	0.026	28%	0.284	C	S	.	.	H	α-helix	trans	-63.2	-43.5	174.2	-76.1	173.1	0	0	0	112.4	S51 L52 K114 V115 A120 L121 V122 Y214 L217	S51-L118 WeakPolarHBondContact O-CD2 3.41Å; L52-L118 HydrophobicContact CD2-CD2 3.96Å; L52-L118 HydrophobicContact CG-CD2 3.91Å; K114-L118 PolarHBondContact O-N 2.98Å; V115-L118 PolarHBondContact O-N 3.49Å; L118-A120 PolarHBondContact O-N 3.32Å; L118-L121 WeakPolarHBondContact O-CB 3.38Å; L118-L121 PolarHBondContact O-N 3.19Å; L118-V122 WeakPolarHBondContact O-CG2 3.41Å; L118-V122 PolarHBondContact O-N 2.97Å; L118-Y214 HydrophobicContact CD1-CD2 3.47Å; L118-Y214 VanDerWaalsContact CD1-CD2 3.47Å; L118-Y214 HydrophobicContact CD1-CE2 3.86Å; L118-L217 HydrophobicContact CB-CD1 4.07Å
119	L	98.1	Very high	97.7	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-57.6	-36.4	174.4	-80.8	163.4	0	0	0	112	V115 L116 L121 K123 I179 Y182 F183 L217	V115-L119 HydrophobicContact CG1-CD1 3.95Å; V115-L119 HydrophobicContact CG1-CG 4.43Å; V115-L119 WeakPolarHBondContact O-CB 3.42Å; V115-L119 WeakPolarHBondContact O-CG 3.39Å; V115-L119 PolarHBondContact O-N 3.13Å; L116-L119 HydrophobicContact CD2-CD1 4.39Å; L116-L119 WeakPolarHBondContact O-CB 3.37Å; L116-L119 PolarHBondContact O-N 3.5Å; L119-L121 VanDerWaalsContact C-N 3.26Å; L119-L121 PolarHBondContact O-N 3.34Å; L119-K123 HydrophobicContact CD2-CG 4.4Å; L119-K123 WeakPolarHBondContact O-CB 3.48Å; L119-K123 WeakPolarHBondContact O-CE 3.45Å; L119-K123 WeakPolarHBondContact O-CG 3.26Å; L119-K123 PolarHBondContact O-N 3.02Å; L119-I179 HydrophobicContact CD2-CB 4.35Å; L119-I179 HydrophobicContact CD2-CG1 3.99Å; L119-I179 HydrophobicContact CD2-CG2 3.71Å; L119-Y182 HydrophobicContact CD1-CD1 3.91Å; L119-Y182 HydrophobicContact CD1-CE1 3.94Å; L119-F183 HydrophobicContact CD1-CE1 4.46Å; L119-F183 HydrophobicContact CD1-CE2 4.28Å; L119-F183 HydrophobicContact CD1-CZ 3.78Å; L119-L217 HydrophobicContact CD2-CD1 4.15Å; L119-L217 HydrophobicContact CD2-CD2 3.63Å; L119-L217 HydrophobicContact CD2-CG 4.47Å; L119-L217 HydrophobicContact CG-CD1 3.86Å; L119-L217 HydrophobicContact CG-CD2 4.2Å
120	A	97.9	Very high	97.9	Very high	60 Å²	60	45.6 Å²	45.6	50%	0.496	25%	0.245	S	C	.	.	H	α-helix	trans	-64.7	-30.9	176.6	0	0	0	0	0	112.6	L116 S117 L118 P124	L116-A120 PolarHBondContact O-N 2.65Å; S117-A120 WeakPolarHBondContact O-CB 3.27Å; S117-A120 PolarHBondContact O-N 3.34Å; L118-A120 PolarHBondContact O-N 3.32Å; A120-P124 WeakPolarHBondContact O-CD 3.19Å; A120-P124 WeakPolarHBondContact O-CG 3.49Å
121	L	97.2	Very high	98	Very high	70 Å²	70	48.4 Å²	48.4	37%	0.366	25%	0.254	S	S	.	.	H	α-helix	trans	-81.2	-41.6	175.7	-60.8	173.6	0	0	0	112.4	L46 S117 L118 L119	L46-L121 HydrophobicContact CD1-CD1 4.26Å; S117-L121 PolarHBondContact O-N 2.9Å; L118-L121 WeakPolarHBondContact O-CB 3.38Å; L118-L121 PolarHBondContact O-N 3.19Å; L119-L121 VanDerWaalsContact C-N 3.26Å; L119-L121 PolarHBondContact O-N 3.34Å
122	V	98.3	Very high	98.1	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.006	25%	0.246	C	C	.	.	H	α-helix	trans	-81.3	-38.9	-172.8	179.4	0	0	0	0	112.6	L118 E125 V126 L217 M220 V221	L118-V122 WeakPolarHBondContact O-CG2 3.41Å; L118-V122 PolarHBondContact O-N 2.97Å; V122-E125 PolarHBondContact O-N 3.49Å; V122-E125 VanDerWaalsContact O-N 3.15Å; V122-V126 HydrophobicContact CG1-CG2 4.14Å; V122-V126 PolarHBondContact O-N 3.47Å; V122-V126 VanDerWaalsContact O-N 3.17Å; V122-L217 HydrophobicContact CB-CD2 4Å; V122-L217 HydrophobicContact CG1-CD2 3.97Å; V122-L217 HydrophobicContact CG2-CB 4.39Å; V122-L217 HydrophobicContact CG2-CD2 4.24Å; V122-M220 HydrophobicContact CG1-CB 4.16Å; V122-M220 HydrophobicContact CG1-SD 4.36Å; V122-V221 HydrophobicContact CG1-CG2 4.37Å; V122-V221 HydrophobicContact CG2-CG2 3.62Å
123	K	98.3	Very high	98.2	Very high	77 Å²	77	48.3 Å²	48.3	34%	0.335	25%	0.245	S	C	.	.	H	α-helix	trans	-54.4	-49.3	-177.5	-79	180	-61.1	-178.3	0	112.9	L119 E125 V126 W127 I179	L119-K123 HydrophobicContact CD2-CG 4.4Å; L119-K123 WeakPolarHBondContact O-CB 3.48Å; L119-K123 WeakPolarHBondContact O-CE 3.45Å; L119-K123 WeakPolarHBondContact O-CG 3.26Å; L119-K123 PolarHBondContact O-N 3.02Å; K123-E125 VanDerWaalsContact C-N 3.28Å; K123-E125 PolarHBondContact O-N 3.4Å; K123-V126 PolarHBondContact O-N 3.15Å; K123-W127 PolarHBondContact O-N 3.43Å; K123-W127 VanDerWaalsContact O-N 3.13Å; K123-I179 HydrophobicContact CD-CG2 4.09Å; K123-I179 HydrophobicContact CG-CD1 4.16Å; K123-I179 HydrophobicContact CG-CG2 4.03Å
124	P	98.6	Very high	98.2	Very high	63 Å²	63	46.1 Å²	46.1	41%	0.409	24%	0.236	S	C	.	.	H	α-helix	trans	-56.6	-42.7	178.8	-25.3	35.4	0	0	0	112.4	A120 V126 W127 T128	A120-P124 WeakPolarHBondContact O-CD 3.19Å; A120-P124 WeakPolarHBondContact O-CG 3.49Å; P124-V126 PolarHBondContact O-N 3.45Å; P124-W127 PolarHBondContact O-N 3.06Å; P124-T128 WeakPolarHBondContact O-CB 3.16Å; P124-T128 PolarHBondContact O-N 3.44Å; P124-T128 PolarHBondContact O-OG1 2.97Å
125	E	98.6	Very high	98.3	Very high	11 Å²	11	41.8 Å²	41.8	5%	0.051	22%	0.218	C	C	.	.	H	α-helix	trans	-65.2	-37.7	-177.9	-59.7	-57.3	142.8	0	0	112.7	K39 Y42 L43 V122 K123 L129 L224	K39-E125 IonicContact NZ-OE1 3.56Å; K39-E125 PolarHBondContact NZ-OE1 2.85Å; K39-E125 IonicContact NZ-OE2 2.89Å; K39-E125 PolarHBondContact NZ-OE2 2.86Å; Y42-E125 HydrophobicContact CE1-CG 4.3Å; Y42-E125 VanDerWaalsContact CE1-OE1 3.27Å; Y42-E125 WeakPolarHBondContact CE1-OE1 3.39Å; L43-E125 HydrophobicContact CD2-CB 4.41Å; L43-E125 HydrophobicContact CD2-CG 4.03Å; V122-E125 PolarHBondContact O-N 3.49Å; V122-E125 VanDerWaalsContact O-N 3.15Å; K123-E125 VanDerWaalsContact C-N 3.28Å; K123-E125 PolarHBondContact O-N 3.4Å; E125-L129 PolarHBondContact O-N 3.04Å; E125-L224 HydrophobicContact CB-CD1 3.74Å
126	V	98.6	Very high	98.3	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.006	22%	0.218	C	C	.	.	H	α-helix	trans	-62.5	-47.1	172.7	175.5	0	0	0	0	111	V122 K123 P124 K130 V172 F175 Q176 I179 L224	V122-V126 HydrophobicContact CG1-CG2 4.14Å; V122-V126 PolarHBondContact O-N 3.47Å; V122-V126 VanDerWaalsContact O-N 3.17Å; K123-V126 PolarHBondContact O-N 3.15Å; P124-V126 PolarHBondContact O-N 3.45Å; V126-K130 PolarHBondContact O-N 2.94Å; V126-K130 VanDerWaalsContact O-N 3.14Å; V126-V172 HydrophobicContact CG1-CG1 3.78Å; V126-V172 VanDerWaalsContact O-CG1 3.24Å; V126-V172 WeakPolarHBondContact O-CG1 3.42Å; V126-F175 HydrophobicContact CG1-CB 4.09Å; V126-F175 HydrophobicContact CG2-CB 4.29Å; V126-F175 HydrophobicContact CG2-CD2 4.46Å; V126-Q176 HydrophobicContact CG1-CG 3.57Å; V126-I179 HydrophobicContact CG2-CD1 4.24Å; V126-L224 HydrophobicContact CG2-CD1 4.04Å
127	W	98.5	Very high	98.4	Very high	153 Å²	153	39.6 Å²	39.6	58%	0.58	21%	0.207	S	C	*	.	H	α-helix	trans	-62.9	-45	178.2	-77.1	110.6	0	0	0	112.1	K123 P124 K130 E131 Q176	K123-W127 PolarHBondContact O-N 3.43Å; K123-W127 VanDerWaalsContact O-N 3.13Å; P124-W127 PolarHBondContact O-N 3.06Å; W127-K130 WeakPolarHBondContact O-CB 3.14Å; W127-K130 PolarHBondContact O-N 3.14Å; W127-E131 PolarHBondContact O-N 3.45Å; W127-Q176 VanDerWaalsContact CD2-NE2 3.29Å
128	T	98.6	Very high	98.4	Very high	34 Å²	34	38 Å²	38	21%	0.209	19%	0.194	C	C	.	.	H	α-helix	trans	-62.3	-46.7	-180	-61.3	0	0	0	0	111.7	F35 P124 K130 E131 K132	F35-T128 HydrophobicContact CE1-CG2 4.15Å; F35-T128 HydrophobicContact CZ-CG2 3.52Å; P124-T128 WeakPolarHBondContact O-CB 3.16Å; P124-T128 PolarHBondContact O-N 3.44Å; P124-T128 PolarHBondContact O-OG1 2.97Å; T128-K130 VanDerWaalsContact C-N 3.3Å; T128-K130 PolarHBondContact O-N 3.47Å; T128-E131 WeakPolarHBondContact O-CB 3.47Å; T128-E131 PolarHBondContact O-N 2.81Å; T128-K132 WeakPolarHBondContact O-CG 3.34Å; T128-K132 PolarHBondContact O-N 3.37Å
129	L	98.6	Very high	98.5	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.7	-38.2	177.8	-180	59.7	0	0	0	111.4	E125 E131 K132 C133 V168 V172 L224 F227 Y228 L231	E125-L129 PolarHBondContact O-N 3.04Å; L129-E131 VanDerWaalsContact C-N 3.35Å; L129-E131 PolarHBondContact O-N 3.44Å; L129-K132 PolarHBondContact O-N 2.92Å; L129-C133 PolarHBondContact O-N 3.04Å; L129-C133 PolarHBondContact O-SG 3.31Å; L129-C133 VanDerWaalsContact O-SG 3.32Å; L129-V168 HydrophobicContact CD2-CG1 4.39Å; L129-V172 HydrophobicContact CD2-CG2 3.61Å; L129-V172 HydrophobicContact CG-CG2 4.02Å; L129-L224 HydrophobicContact CB-CD2 4.02Å; L129-L224 HydrophobicContact CD2-CD2 3.45Å; L129-L224 VanDerWaalsContact CD2-CD2 3.45Å; L129-L224 HydrophobicContact CG-CD2 4.36Å; L129-F227 HydrophobicContact CD2-CB 3.9Å; L129-F227 HydrophobicContact CD2-CD2 3.97Å; L129-F227 HydrophobicContact CD2-CG 4.45Å; L129-Y228 HydrophobicContact CB-CE2 4.37Å; L129-Y228 HydrophobicContact CD1-CD1 3.88Å; L129-Y228 HydrophobicContact CD1-CE1 3.47Å; L129-Y228 VanDerWaalsContact CD1-CE1 3.47Å; L129-Y228 HydrophobicContact CD1-CE2 4.19Å; L129-Y228 HydrophobicContact CD1-CG 4.43Å; L129-L231 HydrophobicContact CD1-CD1 4.06Å
130	K	98.6	Very high	98.5	Very high	40 Å²	40	38.4 Å²	38.4	17%	0.174	20%	0.195	C	C	.	.	H	α-helix	trans	-59	-46.1	175.1	-174.2	178.4	-176.5	173.2	0	111.8	V126 W127 T128 C133 I134 V172 E173	V126-K130 PolarHBondContact O-N 2.94Å; V126-K130 VanDerWaalsContact O-N 3.14Å; W127-K130 WeakPolarHBondContact O-CB 3.14Å; W127-K130 PolarHBondContact O-N 3.14Å; T128-K130 VanDerWaalsContact C-N 3.3Å; T128-K130 PolarHBondContact O-N 3.47Å; K130-C133 PolarHBondContact O-N 2.99Å; K130-I134 HydrophobicContact CG-CD1 4.48Å; K130-I134 WeakPolarHBondContact O-CG1 3.47Å; K130-I134 PolarHBondContact O-N 3.17Å; K130-I134 VanDerWaalsContact O-N 3.11Å; K130-V172 HydrophobicContact CB-CG1 3.88Å; K130-E173 HydrophobicContact CD-CG 4.21Å; K130-E173 WeakPolarHBondContact CE-OE1 3.13Å; K130-E173 IonicContact NZ-OE1 2.77Å; K130-E173 PolarHBondContact NZ-OE1 2.78Å
131	E	98.6	Very high	98.5	Very high	108 Å²	108	40.6 Å²	40.6	51%	0.505	20%	0.195	S	C	.	.	H	α-helix	trans	-60	-46	176.5	-171.4	-161.2	119	0	0	111.2	W127 T128 L129 C133 I134 L135	W127-E131 PolarHBondContact O-N 3.45Å; T128-E131 WeakPolarHBondContact O-CB 3.47Å; T128-E131 PolarHBondContact O-N 2.81Å; L129-E131 VanDerWaalsContact C-N 3.35Å; L129-E131 PolarHBondContact O-N 3.44Å; E131-C133 PolarHBondContact O-N 3.3Å; E131-I134 WeakPolarHBondContact O-CB 3.22Å; E131-I134 PolarHBondContact O-N 3.35Å; E131-I134 VanDerWaalsContact O-N 3.14Å; E131-L135 PolarHBondContact O-N 2.97Å
132	K	98.6	Very high	98.5	Very high	31 Å²	31	41.1 Å²	41.1	14%	0.135	20%	0.196	C	C	.	.	H	α-helix	trans	-68.6	-32.1	178.7	-60.8	-46.8	176.8	-157	0	113.2	F31 F35 T128 L129 I134 L135 V136	F31-K132 HydrophobicContact CD2-CB 3.97Å; F31-K132 HydrophobicContact CD2-CD 4.02Å; F31-K132 HydrophobicContact CD2-CG 3.85Å; F31-K132 HydrophobicContact CE2-CB 3.54Å; F31-K132 HydrophobicContact CE2-CD 4.43Å; F31-K132 HydrophobicContact CE2-CG 3.75Å; F31-K132 HydrophobicContact CZ-CB 4.03Å; F35-K132 HydrophobicContact CD1-CG 4.46Å; F35-K132 HydrophobicContact CE1-CG 3.93Å; F35-K132 HydrophobicContact CZ-CG 4.49Å; T128-K132 WeakPolarHBondContact O-CG 3.34Å; T128-K132 PolarHBondContact O-N 3.37Å; L129-K132 PolarHBondContact O-N 2.92Å; K132-I134 VanDerWaalsContact C-N 3.33Å; K132-I134 PolarHBondContact O-N 3.15Å; K132-L135 HydrophobicContact CD-CD2 4.04Å; K132-L135 WeakPolarHBondContact O-CB 3.45Å; K132-L135 PolarHBondContact O-N 3.01Å; K132-V136 WeakPolarHBondContact O-CG2 3.43Å; K132-V136 PolarHBondContact O-N 3.27Å
133	C	98.7	Very high	98.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.4	-42.6	169.5	-74.1	0	0	0	0	111.5	L129 K130 E131 V136 I137 V165 K169	L129-C133 PolarHBondContact O-N 3.04Å; L129-C133 PolarHBondContact O-SG 3.31Å; L129-C133 VanDerWaalsContact O-SG 3.32Å; K130-C133 PolarHBondContact O-N 2.99Å; E131-C133 PolarHBondContact O-N 3.3Å; C133-V136 PolarHBondContact O-N 3.45Å; C133-I137 WeakPolarHBondContact O-CB 3.11Å; C133-I137 WeakPolarHBondContact O-CD1 3.32Å; C133-I137 WeakPolarHBondContact O-CG1 3.2Å; C133-I137 PolarHBondContact O-N 3.44Å; C133-V165 HydrophobicContact CB-CG1 4.25Å; C133-K169 HydrophobicContact CB-CB 3.98Å; C133-K169 HydrophobicContact CB-CG 4.25Å
134	I	98.8	Very high	98.4	Very high	76 Å²	76	41.4 Å²	41.4	39%	0.39	20%	0.2	S	C	.	.	H	α-helix	trans	-62.3	-46.3	176.3	-65.8	164.4	0	0	0	110.2	K130 E131 K132 V136 I137 T138	K130-I134 HydrophobicContact CG-CD1 4.48Å; K130-I134 WeakPolarHBondContact O-CG1 3.47Å; K130-I134 PolarHBondContact O-N 3.17Å; K130-I134 VanDerWaalsContact O-N 3.11Å; E131-I134 WeakPolarHBondContact O-CB 3.22Å; E131-I134 PolarHBondContact O-N 3.35Å; E131-I134 VanDerWaalsContact O-N 3.14Å; K132-I134 VanDerWaalsContact C-N 3.33Å; K132-I134 PolarHBondContact O-N 3.15Å; I134-V136 PolarHBondContact O-N 3.14Å; I134-I137 PolarHBondContact O-N 3.44Å; I134-T138 WeakPolarHBondContact O-CB 3.46Å; I134-T138 PolarHBondContact O-N 2.94Å; I134-T138 PolarHBondContact O-OG1 3.13Å; I134-T138 VanDerWaalsContact O-OG1 3.05Å
135	L	98.7	Very high	98.2	Very high	18 Å²	18	40.4 Å²	40.4	9%	0.094	19%	0.193	C	C	.	.	H	α-helix	trans	-52.9	-52.8	175.6	177.3	72.2	0	0	0	111.7	L24 E27 F31 E131 K132 T138 W139	L24-L135 HydrophobicContact CD1-CD1 3.58Å; E27-L135 HydrophobicContact CB-CD1 3.96Å; E27-L135 HydrophobicContact CB-CD2 4.24Å; F31-L135 HydrophobicContact CB-CD2 4.11Å; F31-L135 HydrophobicContact CG-CD2 4.49Å; E131-L135 PolarHBondContact O-N 2.97Å; K132-L135 HydrophobicContact CD-CD2 4.04Å; K132-L135 WeakPolarHBondContact O-CB 3.45Å; K132-L135 PolarHBondContact O-N 3.01Å; L135-T138 PolarHBondContact O-N 3.32Å; L135-W139 WeakPolarHBondContact O-CB 3.24Å; L135-W139 PolarHBondContact O-N 2.83Å
136	V	98.6	Very high	98.1	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.006	23%	0.225	C	C	.	.	H	α-helix	trans	-64.8	-41.3	-178.8	174	0	0	0	0	111.6	F31 K132 C133 I134 W139 I140 V165 I235	F31-V136 HydrophobicContact CD1-CG2 3.69Å; F31-V136 HydrophobicContact CE1-CG2 3.43Å; F31-V136 VanDerWaalsContact CE1-CG2 3.43Å; F31-V136 HydrophobicContact CZ-CG2 4.32Å; K132-V136 WeakPolarHBondContact O-CG2 3.43Å; K132-V136 PolarHBondContact O-N 3.27Å; C133-V136 PolarHBondContact O-N 3.45Å; I134-V136 PolarHBondContact O-N 3.14Å; V136-W139 HydrophobicContact CG1-CE3 4.34Å; V136-W139 PolarHBondContact O-N 2.95Å; V136-I140 HydrophobicContact CG1-CD1 3.83Å; V136-I140 HydrophobicContact CG1-CG1 4.37Å; V136-I140 WeakPolarHBondContact O-CG1 3.37Å; V136-I140 PolarHBondContact O-N 3.29Å; V136-V165 HydrophobicContact CB-CG1 4.29Å; V136-V165 HydrophobicContact CG1-CG1 4.16Å; V136-V165 HydrophobicContact CG1-CG2 3.94Å; V136-I235 HydrophobicContact CG1-CD1 3.82Å
137	I	98.8	Very high	97.9	Very high	11 Å²	11	55.3 Å²	55.3	6%	0.056	26%	0.264	C	S	.	.	H	α-helix	trans	-59.1	-50	175.9	-72.1	161.5	0	0	0	110	C133 I134 W139 I140 Q141 L162 V165 N166 K169	C133-I137 WeakPolarHBondContact O-CB 3.11Å; C133-I137 WeakPolarHBondContact O-CD1 3.32Å; C133-I137 WeakPolarHBondContact O-CG1 3.2Å; C133-I137 PolarHBondContact O-N 3.44Å; I134-I137 PolarHBondContact O-N 3.44Å; I137-W139 VanDerWaalsContact C-N 3.33Å; I137-W139 PolarHBondContact O-N 3.34Å; I137-I140 PolarHBondContact O-N 2.9Å; I137-Q141 HydrophobicContact CG2-CG 4.47Å; I137-Q141 WeakPolarHBondContact O-CB 3.43Å; I137-Q141 VanDerWaalsContact O-CG 3.24Å; I137-Q141 WeakPolarHBondContact O-CG 3.46Å; I137-Q141 PolarHBondContact O-N 3.5Å; I137-L162 HydrophobicContact CB-CD2 4.19Å; I137-L162 HydrophobicContact CG1-CD2 4.2Å; I137-L162 HydrophobicContact CG2-CD2 3.99Å; I137-V165 HydrophobicContact CD1-CG1 4.09Å; I137-V165 HydrophobicContact CG1-CB 4.12Å; I137-V165 HydrophobicContact CG1-CG1 3.67Å; I137-N166 WeakPolarHBondContact CD1-OD1 3.32Å; I137-K169 HydrophobicContact CD1-CD 3.95Å
138	T	98.6	Very high	97.6	Very high	35 Å²	35	53.2 Å²	53.2	22%	0.215	26%	0.261	C	S	.	.	H	α-helix	trans	-64.4	-39.6	-179.7	-56.7	0	0	0	0	111.4	F20 L24 I134 L135 Q141 H142	F20-T138 HydrophobicContact CZ-CG2 4.39Å; L24-T138 HydrophobicContact CD1-CG2 4.28Å; L24-T138 HydrophobicContact CD2-CG2 3.86Å; I134-T138 WeakPolarHBondContact O-CB 3.46Å; I134-T138 PolarHBondContact O-N 2.94Å; I134-T138 PolarHBondContact O-OG1 3.13Å; I134-T138 VanDerWaalsContact O-OG1 3.05Å; L135-T138 PolarHBondContact O-N 3.32Å; T138-Q141 PolarHBondContact O-N 3.37Å; T138-H142 PolarHBondContact O-N 3.38Å; T138-H142 VanDerWaalsContact O-N 3.15Å; T138-H142 PolarHBondContact O-ND1 2.94Å
139	W	98.6	Very high	97.2	Very high	16 Å²	16	60 Å²	60	6%	0.061	30%	0.295	C	S	.	.	H	α-helix	trans	-60.4	-52.1	175.5	169.8	61.1	0	0	0	112.2	L24 F25 A28 L32 L135 V136 I137 Q141 H142 L143 I235 L239 I242 V243	L24-W139 HydrophobicContact CD1-CB 4.28Å; L24-W139 HydrophobicContact CG-CB 4.42Å; F25-W139 AromaticContact CD2-CD1 3.95Å; A28-W139 HydrophobicContact CB-CB 3.95Å; A28-W139 HydrophobicContact CB-CD2 3.75Å; A28-W139 HydrophobicContact CB-CE3 4.35Å; A28-W139 HydrophobicContact CB-CG 3.54Å; L32-W139 HydrophobicContact CD1-CH2 3.89Å; L32-W139 HydrophobicContact CD1-CZ3 4.08Å; L135-W139 WeakPolarHBondContact O-CB 3.24Å; L135-W139 PolarHBondContact O-N 2.83Å; V136-W139 HydrophobicContact CG1-CE3 4.34Å; V136-W139 PolarHBondContact O-N 2.95Å; I137-W139 VanDerWaalsContact C-N 3.33Å; I137-W139 PolarHBondContact O-N 3.34Å; W139-Q141 VanDerWaalsContact C-N 3.3Å; W139-Q141 PolarHBondContact O-N 2.96Å; W139-H142 PolarHBondContact O-N 3.42Å; W139-H142 VanDerWaalsContact O-N 3.1Å; W139-L143 HydrophobicContact CD2-CD1 4.13Å; W139-L143 HydrophobicContact CH2-CD1 4.35Å; W139-L143 HydrophobicContact CZ2-CD1 3.66Å; W139-L143 PolarHBondContact O-N 2.84Å; W139-I235 HydrophobicContact CH2-CG2 4.31Å; W139-I235 HydrophobicContact CZ3-CG2 4.15Å; W139-L239 HydrophobicContact CH2-CD1 4.09Å; W139-I242 HydrophobicContact CH2-CG2 3.95Å; W139-I242 HydrophobicContact CZ2-CG2 4.49Å; W139-I242 HydrophobicContact CZ3-CG2 4.23Å; W139-V243 HydrophobicContact CZ2-CG2 4.25Å
140	I	98.2	Very high	96.8	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-63.5	-38.3	179.4	-61.2	170.2	0	0	0	110.7	V136 I137 H142 L143 I144 Q158 V161 L162 I242	V136-I140 HydrophobicContact CG1-CD1 3.83Å; V136-I140 HydrophobicContact CG1-CG1 4.37Å; V136-I140 WeakPolarHBondContact O-CG1 3.37Å; V136-I140 PolarHBondContact O-N 3.29Å; I137-I140 PolarHBondContact O-N 2.9Å; I140-H142 VanDerWaalsContact C-N 3.26Å; I140-H142 PolarHBondContact O-N 3.04Å; I140-L143 WeakPolarHBondContact O-CA 3.43Å; I140-L143 WeakPolarHBondContact O-CB 3.49Å; I140-L143 PolarHBondContact O-N 3.49Å; I140-I144 PolarHBondContact O-N 3.36Å; I140-Q158 HydrophobicContact CG2-CB 4.11Å; I140-Q158 HydrophobicContact CG2-CG 4.42Å; I140-V161 HydrophobicContact CD1-CB 4.49Å; I140-V161 HydrophobicContact CD1-CG1 3.68Å; I140-L162 HydrophobicContact CB-CD1 4.46Å; I140-L162 HydrophobicContact CB-CD2 3.99Å; I140-L162 HydrophobicContact CB-CG 4.07Å; I140-L162 HydrophobicContact CD1-CD2 4.48Å; I140-L162 HydrophobicContact CG2-CD1 3.87Å; I140-L162 HydrophobicContact CG2-CD2 4.19Å; I140-L162 HydrophobicContact CG2-CG 3.69Å; I140-I242 HydrophobicContact CG1-CG2 4.18Å
141	Q	98.2	Very high	96.5	Very high	107 Å²	107	64.2 Å²	64.2	50%	0.5	33%	0.327	S	S	.	.	H	α-helix	trans	-59.2	-34.7	175.4	-77	174.4	-18.4	0	0	113.2	I137 T138 W139 L143 I144 L162	I137-Q141 HydrophobicContact CG2-CG 4.47Å; I137-Q141 WeakPolarHBondContact O-CB 3.43Å; I137-Q141 VanDerWaalsContact O-CG 3.24Å; I137-Q141 WeakPolarHBondContact O-CG 3.46Å; I137-Q141 PolarHBondContact O-N 3.5Å; T138-Q141 PolarHBondContact O-N 3.37Å; W139-Q141 VanDerWaalsContact C-N 3.3Å; W139-Q141 PolarHBondContact O-N 2.96Å; Q141-L143 VanDerWaalsContact C-N 3.29Å; Q141-I144 PolarHBondContact O-N 2.98Å; Q141-L162 HydrophobicContact CG-CD1 4.25Å; Q141-L162 HydrophobicContact CG-CD2 4.43Å
142	H	97.5	Very high	96.3	Very high	81 Å²	81	62.3 Å²	62.3	38%	0.375	32%	0.321	S	S	.	.	H	α-helix	trans	-75.8	-16.7	175.2	-75.6	75.7	0	0	0	113.3	F20 L24 F25 T138 W139 I140	F20-H142 AromaticContact CE1-CE1 3.96Å; F20-H142 AromaticContact CE1-NE2 3.86Å; L24-H142 HydrophobicContact CD2-CB 4.49Å; F25-H142 HydrophobicContact CE2-CB 3.9Å; F25-H142 HydrophobicContact CZ-CB 4.28Å; T138-H142 PolarHBondContact O-N 3.38Å; T138-H142 VanDerWaalsContact O-N 3.15Å; T138-H142 PolarHBondContact O-ND1 2.94Å; W139-H142 PolarHBondContact O-N 3.42Å; W139-H142 VanDerWaalsContact O-N 3.1Å; I140-H142 VanDerWaalsContact C-N 3.26Å; I140-H142 PolarHBondContact O-N 3.04Å
143	L	97.2	Very high	96.2	Very high	23 Å²	23	67.9 Å²	67.9	12%	0.12	35%	0.345	C	S	.	.	H	α-helix	trans	-88.1	-12.4	174.8	-68.5	173.2	0	0	0	113.1	F25 W139 I140 Q141 P145 Q158 I242 V243	F25-L143 HydrophobicContact CE1-CD2 3.6Å; F25-L143 HydrophobicContact CE1-CG 4.36Å; F25-L143 HydrophobicContact CZ-CD2 3.68Å; F25-L143 HydrophobicContact CZ-CG 4.11Å; W139-L143 HydrophobicContact CD2-CD1 4.13Å; W139-L143 HydrophobicContact CH2-CD1 4.35Å; W139-L143 HydrophobicContact CZ2-CD1 3.66Å; W139-L143 PolarHBondContact O-N 2.84Å; I140-L143 WeakPolarHBondContact O-CA 3.43Å; I140-L143 WeakPolarHBondContact O-CB 3.49Å; I140-L143 PolarHBondContact O-N 3.49Å; Q141-L143 VanDerWaalsContact C-N 3.29Å; L143-P145 WeakPolarHBondContact O-CD 3.44Å; L143-Q158 VanDerWaalsContact C-NE2 3.31Å; L143-Q158 PolarHBondContact O-NE2 3.17Å; L143-I242 HydrophobicContact CD1-CG2 3.82Å; L143-V243 HydrophobicContact CD1-CG2 4.34Å
144	I	96.8	Very high	96.2	Very high	60 Å²	60	67.9 Å²	67.9	31%	0.308	35%	0.346	S	S	.	.			trans	-67	119.7	175.2	-64.1	173.5	0	0	0	108.1	I140 Q141 V155 Q158 L162	I140-I144 PolarHBondContact O-N 3.36Å; Q141-I144 PolarHBondContact O-N 2.98Å; I144-V155 HydrophobicContact CG2-CG1 4.47Å; I144-Q158 HydrophobicContact CG1-CB 4.5Å; I144-L162 HydrophobicContact CD1-CD1 3.89Å
145	P	95.8	Very high	96.1	Very high	42 Å²	42	65.2 Å²	65.2	27%	0.273	33%	0.333	S	S	.	.			trans	-74.4	177.6	-176.8	33.3	-36.8	0	0	0	110.7	L143 I147 V155 P245 K246	L143-P145 WeakPolarHBondContact O-CD 3.44Å; P145-I147 PolarHBondContact O-N 2.86Å; P145-V155 HydrophobicContact CG-CG2 3.87Å; P145-P245 HydrophobicContact CG-CG 3.92Å; P145-K246 HydrophobicContact CB-CG 4.45Å; P145-K246 HydrophobicContact CG-CG 4.1Å
146	K	95.6	Very high	96.1	Very high	164 Å²	164	66.6 Å²	66.6	71%	0.713	35%	0.347	S	S	*	.			trans	-56.3	139.2	169.1	-173.1	-174.7	172.4	-161.3	0	109.9	E148	K146-E148 PolarHBondContact O-N 3.39Å
147	I	94.9	Very high	96.1	Very high	162 Å²	162	67.8 Å²	67.8	83%	0.831	35%	0.353	S	S	*	.			trans	-67.5	123.4	174.2	-57.7	173.1	0	0	0	108.5	P145	P145-I147 PolarHBondContact O-N 2.86Å
148	E	91.8	Very high	96	Very high	109 Å²	109	67.3 Å²	67.3	51%	0.509	35%	0.35	S	S	.	.			trans	-136.5	160.5	-179.5	-65.7	-175.6	160.4	0	0	108.9	K146 G150	K146-E148 PolarHBondContact O-N 3.39Å; E148-G150 PolarHBondContact O-N 2.91Å
149	D	91	Very high	96	Very high	175 Å²	175	71.3 Å²	71.3	94%	0.936	37%	0.367	S	S	*	.	S	Bend	trans	-83.9	112.7	178.9	-169.5	14.6	0	0	0	109.9
150	G	90.1	Very high	96	Very high	32 Å²	32	76.4 Å²	76.4	33%	0.33	39%	0.389	S	S	.	.	S	Bend	trans	92.3	168.5	178.2	0	0	0	0	0	114.7	E148 D152 K246	E148-G150 PolarHBondContact O-N 2.91Å; G150-D152 VanDerWaalsContact C-N 3.31Å; G150-D152 WeakPolarHBondContact CA-OD2 3.46Å; G150-D152 PolarHBondContact N-OD2 3.05Å; G150-D152 PolarHBondContact O-N 3.3Å; G150-K246 PolarHBondContact O-NZ 3.49Å
151	N	91.5	Very high	96	Very high	97 Å²	97	76.5 Å²	76.5	52%	0.519	39%	0.39	S	S	.	.			trans	58	38.8	-172.8	-167.1	21.8	0	0	0	113	K246	N151-K246 VanDerWaalsContact C-NZ 3.34Å; N151-K246 HydrophobicContact CB-CD 4.13Å; N151-K246 PolarHBondContact ND2-O 2.95Å; N151-K246 VanDerWaalsContact O-CD 3.32Å; N151-K246 WeakPolarHBondContact O-CD 3.09Å; N151-K246 PolarHBondContact O-NZ 3.04Å
152	D	94.9	Very high	96.1	Very high	68 Å²	68	72.2 Å²	72.2	36%	0.364	37%	0.37	S	S	.	.			trans	-94.7	1.7	-172.2	-58.4	-52.1	0	0	0	114.4	G150 G154 V155 A156 K246	G150-D152 VanDerWaalsContact C-N 3.31Å; G150-D152 WeakPolarHBondContact CA-OD2 3.46Å; G150-D152 PolarHBondContact N-OD2 3.05Å; G150-D152 PolarHBondContact O-N 3.3Å; D152-G154 VanDerWaalsContact C-N 3.33Å; D152-G154 PolarHBondContact O-N 3.26Å; D152-V155 PolarHBondContact O-N 3.08Å; D152-V155 VanDerWaalsContact O-N 3.1Å; D152-A156 PolarHBondContact O-N 2.86Å; D152-K246 IonicContact OD1-NZ 2.74Å; D152-K246 PolarHBondContact OD1-NZ 3.06Å
153	F	96.8	Very high	96.1	Very high	148 Å²	148	73.8 Å²	73.8	65%	0.649	38%	0.378	S	S	*	.	H	α-helix	trans	-60.7	-40.9	-179.6	-177.4	-104.7	0	0	0	112.6	V155 A156 I157	F153-V155 VanDerWaalsContact C-N 3.33Å; F153-V155 PolarHBondContact O-N 3.37Å; F153-A156 PolarHBondContact O-N 3.36Å; F153-I157 HydrophobicContact CD1-CD1 3.9Å; F153-I157 HydrophobicContact CE1-CD1 3.43Å; F153-I157 VanDerWaalsContact CE1-CD1 3.43Å; F153-I157 HydrophobicContact CE1-CG1 4.3Å; F153-I157 HydrophobicContact CZ-CD1 3.9Å; F153-I157 HydrophobicContact CZ-CG1 4.4Å; F153-I157 WeakPolarHBondContact O-CG1 3.4Å; F153-I157 PolarHBondContact O-N 3.45Å; F153-I157 VanDerWaalsContact O-N 3.08Å
154	G	96.9	Very high	96.2	Very high	1 Å²	1	76.7 Å²	76.7	1%	0.01	39%	0.387	C	S	.	.	H	α-helix	trans	-64.4	-37.4	174.8	0	0	0	0	0	112.8	D152 I157 Q158	D152-G154 VanDerWaalsContact C-N 3.33Å; D152-G154 PolarHBondContact O-N 3.26Å; G154-I157 WeakPolarHBondContact O-CB 3.36Å; G154-I157 PolarHBondContact O-N 3.47Å; G154-Q158 PolarHBondContact O-N 3.34Å
155	V	97.6	Very high	96.3	Very high	19 Å²	19	73.8 Å²	73.8	12%	0.115	37%	0.372	C	S	.	.	H	α-helix	trans	-67	-42.2	176.2	-176.5	0	0	0	0	110.6	I144 P145 D152 F153 I157 Q158 E159 P245	I144-V155 HydrophobicContact CG2-CG1 4.47Å; P145-V155 HydrophobicContact CG-CG2 3.87Å; D152-V155 PolarHBondContact O-N 3.08Å; D152-V155 VanDerWaalsContact O-N 3.1Å; F153-V155 VanDerWaalsContact C-N 3.33Å; F153-V155 PolarHBondContact O-N 3.37Å; V155-I157 VanDerWaalsContact C-N 3.25Å; V155-I157 PolarHBondContact O-N 2.96Å; V155-Q158 WeakPolarHBondContact O-CA 3.32Å; V155-Q158 WeakPolarHBondContact O-CB 3.48Å; V155-Q158 PolarHBondContact O-N 2.95Å; V155-E159 WeakPolarHBondContact O-CG 3.21Å; V155-E159 PolarHBondContact O-N 3.14Å; V155-P245 HydrophobicContact CG2-CB 4.33Å
156	A	98.1	Very high	96.4	Very high	48 Å²	48	74.9 Å²	74.9	40%	0.397	38%	0.376	S	S	.	.	H	α-helix	trans	-60.6	-34.3	174.1	0	0	0	0	0	112.5	D152 F153 K160	D152-A156 PolarHBondContact O-N 2.86Å; F153-A156 PolarHBondContact O-N 3.36Å; A156-K160 WeakPolarHBondContact O-CB 3.24Å; A156-K160 PolarHBondContact O-N 2.85Å
157	I	98.3	Very high	96.6	Very high	26 Å²	26	69 Å²	69	13%	0.133	36%	0.358	C	S	.	.	H	α-helix	trans	-65.7	-46.3	171.4	-69.4	169.2	0	0	0	110.7	F153 G154 V155 E159 K160 V161 N238 K241	F153-I157 HydrophobicContact CD1-CD1 3.9Å; F153-I157 HydrophobicContact CE1-CD1 3.43Å; F153-I157 VanDerWaalsContact CE1-CD1 3.43Å; F153-I157 HydrophobicContact CE1-CG1 4.3Å; F153-I157 HydrophobicContact CZ-CD1 3.9Å; F153-I157 HydrophobicContact CZ-CG1 4.4Å; F153-I157 WeakPolarHBondContact O-CG1 3.4Å; F153-I157 PolarHBondContact O-N 3.45Å; F153-I157 VanDerWaalsContact O-N 3.08Å; G154-I157 WeakPolarHBondContact O-CB 3.36Å; G154-I157 PolarHBondContact O-N 3.47Å; V155-I157 VanDerWaalsContact C-N 3.25Å; V155-I157 PolarHBondContact O-N 2.96Å; I157-E159 VanDerWaalsContact C-N 3.3Å; I157-E159 PolarHBondContact O-N 3.12Å; I157-K160 PolarHBondContact O-N 3.23Å; I157-K160 VanDerWaalsContact O-N 3.17Å; I157-V161 HydrophobicContact CG2-CG2 4.33Å; I157-V161 VanDerWaalsContact O-CG2 3.32Å; I157-V161 WeakPolarHBondContact O-CG2 3.35Å; I157-V161 PolarHBondContact O-N 2.75Å; I157-N238 HydrophobicContact CG2-CB 3.89Å; I157-K241 HydrophobicContact CB-CB 4.37Å; I157-K241 HydrophobicContact CD1-CB 3.83Å; I157-K241 HydrophobicContact CD1-CG 3.79Å; I157-K241 HydrophobicContact CG2-CB 4.1Å
158	Q	98.4	Very high	96.7	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-56.2	-45.6	175.9	-70.4	175.1	-42.1	0	0	111.3	I140 L143 I144 G154 V155 K160 V161 L162 I242	I140-Q158 HydrophobicContact CG2-CB 4.11Å; I140-Q158 HydrophobicContact CG2-CG 4.42Å; L143-Q158 VanDerWaalsContact C-NE2 3.31Å; L143-Q158 PolarHBondContact O-NE2 3.17Å; I144-Q158 HydrophobicContact CG1-CB 4.5Å; G154-Q158 PolarHBondContact O-N 3.34Å; V155-Q158 WeakPolarHBondContact O-CA 3.32Å; V155-Q158 WeakPolarHBondContact O-CB 3.48Å; V155-Q158 PolarHBondContact O-N 2.95Å; Q158-K160 PolarHBondContact O-N 3.25Å; Q158-V161 PolarHBondContact O-N 3.46Å; Q158-L162 WeakPolarHBondContact O-CB 3.46Å; Q158-L162 PolarHBondContact O-N 3.07Å; Q158-I242 PolarHBondContact NE2-O 3.34Å
159	E	98.3	Very high	97.1	Very high	120 Å²	120	58.5 Å²	58.5	56%	0.561	31%	0.305	S	S	*	.	H	α-helix	trans	-60.9	-43.1	176.3	-70.4	178.4	171.2	0	0	112	V155 I157 V161 L162 E163	V155-E159 WeakPolarHBondContact O-CG 3.21Å; V155-E159 PolarHBondContact O-N 3.14Å; I157-E159 VanDerWaalsContact C-N 3.3Å; I157-E159 PolarHBondContact O-N 3.12Å; E159-V161 PolarHBondContact O-N 3.03Å; E159-L162 WeakPolarHBondContact O-CB 3.35Å; E159-L162 PolarHBondContact O-N 3.31Å; E159-E163 PolarHBondContact O-N 3.38Å
160	K	98.4	Very high	97.4	Very high	122 Å²	122	54.4 Å²	54.4	53%	0.53	29%	0.286	S	S	.	.	H	α-helix	trans	-67.2	-37.7	179.6	-166.9	63.2	-179.6	172.2	0	112.7	A156 I157 Q158 E163 R164	A156-K160 WeakPolarHBondContact O-CB 3.24Å; A156-K160 PolarHBondContact O-N 2.85Å; I157-K160 PolarHBondContact O-N 3.23Å; I157-K160 VanDerWaalsContact O-N 3.17Å; Q158-K160 PolarHBondContact O-N 3.25Å; K160-E163 VanDerWaalsContact CD-OE2 3.3Å; K160-E163 WeakPolarHBondContact CD-OE2 3.28Å; K160-E163 IonicContact NZ-OE1 3.17Å; K160-E163 PolarHBondContact NZ-OE1 3.3Å; K160-E163 IonicContact NZ-OE2 3.41Å; K160-E163 PolarHBondContact NZ-OE2 3.22Å; K160-E163 PolarHBondContact O-N 3.28Å; K160-R164 PolarHBondContact O-N 3.38Å
161	V	98.6	Very high	97.8	Very high	2 Å²	2	57.8 Å²	57.8	1%	0.012	29%	0.292	C	S	.	.	H	α-helix	trans	-66	-46.1	173.5	177.3	0	0	0	0	109.6	I140 I157 Q158 E159 E163 R164 V165 I234 I235 N238 I242	I140-V161 HydrophobicContact CD1-CB 4.49Å; I140-V161 HydrophobicContact CD1-CG1 3.68Å; I157-V161 HydrophobicContact CG2-CG2 4.33Å; I157-V161 VanDerWaalsContact O-CG2 3.32Å; I157-V161 WeakPolarHBondContact O-CG2 3.35Å; I157-V161 PolarHBondContact O-N 2.75Å; Q158-V161 PolarHBondContact O-N 3.46Å; E159-V161 PolarHBondContact O-N 3.03Å; V161-E163 VanDerWaalsContact C-N 3.31Å; V161-E163 PolarHBondContact O-N 2.75Å; V161-R164 WeakPolarHBondContact O-CB 3.49Å; V161-R164 PolarHBondContact O-N 2.9Å; V161-V165 HydrophobicContact CG1-CG2 4.33Å; V161-V165 WeakPolarHBondContact O-CG2 3.47Å; V161-V165 PolarHBondContact O-N 3.12Å; V161-I234 HydrophobicContact CG2-CD1 4.36Å; V161-I234 HydrophobicContact CG2-CG1 4.24Å; V161-I235 HydrophobicContact CG1-CG1 4.21Å; V161-N238 HydrophobicContact CG2-CB 4.41Å; V161-I242 HydrophobicContact CG1-CD1 4.13Å; V161-I242 HydrophobicContact CG2-CD1 4.06Å; V161-I242 HydrophobicContact CG2-CG1 4.31Å
162	L	98.6	Very high	98.2	Very high	17 Å²	17	53.2 Å²	53.2	9%	0.089	27%	0.267	C	S	.	.	H	α-helix	trans	-57.1	-41.6	175.1	-86.1	171.6	0	0	0	112.8	I137 I140 Q141 I144 Q158 E159 R164 V165 N166	I137-L162 HydrophobicContact CB-CD2 4.19Å; I137-L162 HydrophobicContact CG1-CD2 4.2Å; I137-L162 HydrophobicContact CG2-CD2 3.99Å; I140-L162 HydrophobicContact CB-CD1 4.46Å; I140-L162 HydrophobicContact CB-CD2 3.99Å; I140-L162 HydrophobicContact CB-CG 4.07Å; I140-L162 HydrophobicContact CD1-CD2 4.48Å; I140-L162 HydrophobicContact CG2-CD1 3.87Å; I140-L162 HydrophobicContact CG2-CD2 4.19Å; I140-L162 HydrophobicContact CG2-CG 3.69Å; Q141-L162 HydrophobicContact CG-CD1 4.25Å; Q141-L162 HydrophobicContact CG-CD2 4.43Å; I144-L162 HydrophobicContact CD1-CD1 3.89Å; Q158-L162 WeakPolarHBondContact O-CB 3.46Å; Q158-L162 PolarHBondContact O-N 3.07Å; E159-L162 WeakPolarHBondContact O-CB 3.35Å; E159-L162 PolarHBondContact O-N 3.31Å; L162-R164 VanDerWaalsContact C-N 3.29Å; L162-R164 PolarHBondContact O-N 3.38Å; L162-V165 PolarHBondContact O-N 3.36Å; L162-N166 WeakPolarHBondContact O-CB 3.31Å; L162-N166 PolarHBondContact O-N 3.28Å; L162-N166 PolarHBondContact O-ND2 2.91Å
163	E	98.7	Very high	98.3	Very high	115 Å²	115	53.1 Å²	53.1	54%	0.537	26%	0.264	S	S	.	.	H	α-helix	trans	-56.6	-45.7	174.5	-172.2	-166.1	153.5	0	0	110.4	E159 K160 V161 N166 A167	E159-E163 PolarHBondContact O-N 3.38Å; K160-E163 VanDerWaalsContact CD-OE2 3.3Å; K160-E163 WeakPolarHBondContact CD-OE2 3.28Å; K160-E163 IonicContact NZ-OE1 3.17Å; K160-E163 PolarHBondContact NZ-OE1 3.3Å; K160-E163 IonicContact NZ-OE2 3.41Å; K160-E163 PolarHBondContact NZ-OE2 3.22Å; K160-E163 PolarHBondContact O-N 3.28Å; V161-E163 VanDerWaalsContact C-N 3.31Å; V161-E163 PolarHBondContact O-N 2.75Å; E163-N166 PolarHBondContact O-N 3.43Å; E163-A167 WeakPolarHBondContact O-CB 3.39Å; E163-A167 PolarHBondContact O-N 2.77Å
164	R	98.6	Very high	98.4	Very high	83 Å²	83	48.4 Å²	48.4	31%	0.313	25%	0.253	S	S	.	.	H	α-helix	trans	-65.9	-44.7	178.7	-177.6	56.9	-176.9	-171.6	0.7	112.5	K160 V161 L162 N166 A167 V168 E230 I234	K160-R164 PolarHBondContact O-N 3.38Å; V161-R164 WeakPolarHBondContact O-CB 3.49Å; V161-R164 PolarHBondContact O-N 2.9Å; L162-R164 VanDerWaalsContact C-N 3.29Å; L162-R164 PolarHBondContact O-N 3.38Å; R164-N166 VanDerWaalsContact C-N 3.3Å; R164-N166 PolarHBondContact O-N 3.4Å; R164-A167 WeakPolarHBondContact O-CB 3.49Å; R164-A167 PolarHBondContact O-N 3.18Å; R164-V168 PolarHBondContact O-N 2.96Å; R164-E230 IonicContact CZ-OE2 2.73Å; R164-E230 IonicContact NE-OE2 2.63Å; R164-E230 VanDerWaalsContact NH2-CD 3.28Å; R164-E230 IonicContact NH2-OE1 3.74Å; R164-E230 PolarHBondContact NH2-OE1 3.08Å; R164-E230 IonicContact NH2-OE2 3.41Å; R164-E230 PolarHBondContact NH2-OE2 2.79Å; R164-I234 HydrophobicContact CB-CD1 3.8Å; R164-I234 HydrophobicContact CG-CD1 3.95Å
165	V	98.7	Very high	98.5	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.9	-40.3	179.2	-173.8	0	0	0	0	110.6	C133 V136 I137 V161 L162 V168 K169 L231	C133-V165 HydrophobicContact CB-CG1 4.25Å; V136-V165 HydrophobicContact CB-CG1 4.29Å; V136-V165 HydrophobicContact CG1-CG1 4.16Å; V136-V165 HydrophobicContact CG1-CG2 3.94Å; I137-V165 HydrophobicContact CD1-CG1 4.09Å; I137-V165 HydrophobicContact CG1-CB 4.12Å; I137-V165 HydrophobicContact CG1-CG1 3.67Å; V161-V165 HydrophobicContact CG1-CG2 4.33Å; V161-V165 WeakPolarHBondContact O-CG2 3.47Å; V161-V165 PolarHBondContact O-N 3.12Å; L162-V165 PolarHBondContact O-N 3.36Å; V165-V168 PolarHBondContact O-N 3.41Å; V165-K169 PolarHBondContact O-N 2.8Å; V165-L231 HydrophobicContact CB-CD2 4.27Å; V165-L231 HydrophobicContact CG1-CD2 4.23Å; V165-L231 HydrophobicContact CG2-CD2 3.78Å
166	N	98.8	Very high	98.4	Very high	64 Å²	64	49.7 Å²	49.7	34%	0.342	26%	0.257	S	S	.	.	H	α-helix	trans	-64.5	-41.2	174	-80.6	-70.8	0	0	0	112.2	I137 L162 E163 R164 V168 K169 T170	I137-N166 WeakPolarHBondContact CD1-OD1 3.32Å; L162-N166 WeakPolarHBondContact O-CB 3.31Å; L162-N166 PolarHBondContact O-N 3.28Å; L162-N166 PolarHBondContact O-ND2 2.91Å; E163-N166 PolarHBondContact O-N 3.43Å; R164-N166 VanDerWaalsContact C-N 3.3Å; R164-N166 PolarHBondContact O-N 3.4Å; N166-V168 VanDerWaalsContact C-N 3.32Å; N166-V168 PolarHBondContact O-N 3.39Å; N166-K169 WeakPolarHBondContact O-CB 3.15Å; N166-K169 PolarHBondContact O-N 3.34Å; N166-T170 PolarHBondContact O-N 3.47Å; N166-T170 PolarHBondContact O-OG1 3.36Å; N166-T170 VanDerWaalsContact O-OG1 3.09Å
167	A	98.8	Very high	98.4	Very high	40 Å²	40	50.9 Å²	50.9	33%	0.331	26%	0.259	S	S	.	.	H	α-helix	trans	-60.6	-41.1	176	0	0	0	0	0	112.2	E163 R164 K171	E163-A167 WeakPolarHBondContact O-CB 3.39Å; E163-A167 PolarHBondContact O-N 2.77Å; R164-A167 WeakPolarHBondContact O-CB 3.49Å; R164-A167 PolarHBondContact O-N 3.18Å; A167-K171 PolarHBondContact O-N 2.87Å
168	V	98.8	Very high	98.3	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.006	27%	0.269	C	S	.	.	H	α-helix	trans	-62.1	-48.9	172.6	171	0	0	0	0	110.6	L129 R164 V165 N166 T170 K171 V172 F227 L231	L129-V168 HydrophobicContact CD2-CG1 4.39Å; R164-V168 PolarHBondContact O-N 2.96Å; V165-V168 PolarHBondContact O-N 3.41Å; N166-V168 VanDerWaalsContact C-N 3.32Å; N166-V168 PolarHBondContact O-N 3.39Å; V168-T170 VanDerWaalsContact C-N 3.32Å; V168-T170 PolarHBondContact O-N 2.82Å; V168-K171 WeakPolarHBondContact O-CB 3.38Å; V168-K171 PolarHBondContact O-N 2.85Å; V168-K171 VanDerWaalsContact O-N 3.1Å; V168-V172 HydrophobicContact CG1-CG2 4.36Å; V168-V172 WeakPolarHBondContact O-CG2 3.26Å; V168-V172 PolarHBondContact O-N 3.32Å; V168-F227 HydrophobicContact CG1-CB 3.75Å; V168-F227 HydrophobicContact CG1-CD1 4.28Å; V168-F227 HydrophobicContact CG1-CD2 3.91Å; V168-F227 HydrophobicContact CG1-CG 3.72Å; V168-F227 HydrophobicContact CG2-CD1 4.09Å; V168-F227 HydrophobicContact CG2-CG 4.32Å; V168-L231 HydrophobicContact CG1-CD1 4.28Å; V168-L231 HydrophobicContact CG2-CD2 4.35Å
169	K	98.7	Very high	98.3	Very high	51 Å²	51	52.9 Å²	52.9	22%	0.222	27%	0.272	C	S	.	.	H	α-helix	trans	-54.3	-45.9	177.7	-175.4	-169.9	165.5	-168	0	112.1	C133 I137 V165 N166 K171 V172 E173	C133-K169 HydrophobicContact CB-CB 3.98Å; C133-K169 HydrophobicContact CB-CG 4.25Å; I137-K169 HydrophobicContact CD1-CD 3.95Å; V165-K169 PolarHBondContact O-N 2.8Å; N166-K169 WeakPolarHBondContact O-CB 3.15Å; N166-K169 PolarHBondContact O-N 3.34Å; K169-K171 VanDerWaalsContact C-N 3.32Å; K169-K171 PolarHBondContact O-N 2.63Å; K169-V172 PolarHBondContact O-N 3.28Å; K169-V172 VanDerWaalsContact O-N 3.15Å; K169-E173 VanDerWaalsContact CE-OE1 3.24Å; K169-E173 WeakPolarHBondContact CE-OE1 3.44Å; K169-E173 WeakPolarHBondContact O-CG 3.23Å; K169-E173 PolarHBondContact O-N 2.93Å
170	T	98.7	Very high	98.2	Very high	89 Å²	89	50.9 Å²	50.9	55%	0.546	27%	0.272	S	S	.	.	H	α-helix	trans	-60	-40.6	178	-58.5	0	0	0	0	112.1	N166 V168 E173 A174	N166-T170 PolarHBondContact O-N 3.47Å; N166-T170 PolarHBondContact O-OG1 3.36Å; N166-T170 VanDerWaalsContact O-OG1 3.09Å; V168-T170 VanDerWaalsContact C-N 3.32Å; V168-T170 PolarHBondContact O-N 2.82Å; T170-E173 PolarHBondContact O-N 3.24Å; T170-A174 PolarHBondContact O-N 3.23Å
171	K	98.6	Very high	98.1	Very high	103 Å²	103	50.2 Å²	50.2	45%	0.448	27%	0.269	S	S	.	.	H	α-helix	trans	-64.9	-40.8	175.1	-69.1	-174	178.7	-171	0	112	A167 V168 K169 E173 A174 F175 F227	A167-K171 PolarHBondContact O-N 2.87Å; V168-K171 WeakPolarHBondContact O-CB 3.38Å; V168-K171 PolarHBondContact O-N 2.85Å; V168-K171 VanDerWaalsContact O-N 3.1Å; K169-K171 VanDerWaalsContact C-N 3.32Å; K169-K171 PolarHBondContact O-N 2.63Å; K171-E173 VanDerWaalsContact C-N 3.32Å; K171-E173 PolarHBondContact O-N 3.35Å; K171-A174 WeakPolarHBondContact O-CB 3.12Å; K171-A174 PolarHBondContact O-N 3.38Å; K171-A174 VanDerWaalsContact O-N 3.14Å; K171-F175 PolarHBondContact O-N 3.1Å; K171-F175 VanDerWaalsContact O-N 3.1Å; K171-F227 HydrophobicContact CB-CE2 4.09Å; K171-F227 HydrophobicContact CB-CZ 3.97Å; K171-F227 HydrophobicContact CD-CE1 3.91Å; K171-F227 HydrophobicContact CD-CE2 4.39Å; K171-F227 HydrophobicContact CD-CZ 3.47Å; K171-F227 VanDerWaalsContact CD-CZ 3.47Å; K171-F227 HydrophobicContact CG-CZ 4.39Å
172	V	98.5	Very high	98.1	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.4	-36.9	176.1	178.5	0	0	0	0	111.5	V126 L129 K130 V168 K169 A174 F175 Q176 L224 F227	V126-V172 HydrophobicContact CG1-CG1 3.78Å; V126-V172 VanDerWaalsContact O-CG1 3.24Å; V126-V172 WeakPolarHBondContact O-CG1 3.42Å; L129-V172 HydrophobicContact CD2-CG2 3.61Å; L129-V172 HydrophobicContact CG-CG2 4.02Å; K130-V172 HydrophobicContact CB-CG1 3.88Å; V168-V172 HydrophobicContact CG1-CG2 4.36Å; V168-V172 WeakPolarHBondContact O-CG2 3.26Å; V168-V172 PolarHBondContact O-N 3.32Å; K169-V172 PolarHBondContact O-N 3.28Å; K169-V172 VanDerWaalsContact O-N 3.15Å; V172-A174 VanDerWaalsContact C-N 3.33Å; V172-F175 WeakPolarHBondContact O-CB 3.35Å; V172-F175 PolarHBondContact O-N 3.45Å; V172-Q176 PolarHBondContact O-N 3.15Å; V172-L224 HydrophobicContact CG2-CD2 4.5Å; V172-F227 HydrophobicContact CG2-CD2 4.24Å; V172-F227 HydrophobicContact CG2-CE2 4.43Å
173	E	98.1	Very high	98.1	Very high	66 Å²	66	54.9 Å²	54.9	31%	0.308	29%	0.288	S	S	.	.	H	α-helix	trans	-65.7	-34.6	172.7	-71.5	177.3	161.6	0	0	112.5	K130 K169 T170 K171 F175 Q176 T177	K130-E173 HydrophobicContact CD-CG 4.21Å; K130-E173 WeakPolarHBondContact CE-OE1 3.13Å; K130-E173 IonicContact NZ-OE1 2.77Å; K130-E173 PolarHBondContact NZ-OE1 2.78Å; K169-E173 VanDerWaalsContact CE-OE1 3.24Å; K169-E173 WeakPolarHBondContact CE-OE1 3.44Å; K169-E173 WeakPolarHBondContact O-CG 3.23Å; K169-E173 PolarHBondContact O-N 2.93Å; T170-E173 PolarHBondContact O-N 3.24Å; K171-E173 VanDerWaalsContact C-N 3.32Å; K171-E173 PolarHBondContact O-N 3.35Å; E173-F175 VanDerWaalsContact C-N 3.34Å; E173-Q176 WeakPolarHBondContact O-CB 3.16Å; E173-Q176 PolarHBondContact O-N 3.02Å; E173-T177 PolarHBondContact O-N 3.1Å; E173-T177 PolarHBondContact O-OG1 3.19Å
174	A	98.5	Very high	98.1	Very high	50 Å²	50	52.5 Å²	52.5	41%	0.413	28%	0.284	S	S	.	.	H	α-helix	trans	-63.1	-39.9	171.9	0	0	0	0	0	111.5	T170 K171 V172 Q176 T177 T178	T170-A174 PolarHBondContact O-N 3.23Å; K171-A174 WeakPolarHBondContact O-CB 3.12Å; K171-A174 PolarHBondContact O-N 3.38Å; K171-A174 VanDerWaalsContact O-N 3.14Å; V172-A174 VanDerWaalsContact C-N 3.33Å; A174-Q176 VanDerWaalsContact C-N 3.32Å; A174-Q176 PolarHBondContact O-N 3.4Å; A174-T177 WeakPolarHBondContact O-CA 3.28Å; A174-T177 WeakPolarHBondContact O-CB 3.35Å; A174-T177 PolarHBondContact O-N 3.25Å; A174-T178 PolarHBondContact O-N 3.32Å; A174-T178 PolarHBondContact O-OG1 2.92Å
175	F	98.6	Very high	98.1	Very high	22 Å²	22	52 Å²	52	10%	0.096	29%	0.285	C	S	.	.	H	α-helix	trans	-59.1	-41.6	174.9	-60.3	-22.8	0	0	0	112.6	V126 K171 V172 E173 T177 T178 I179 M220 D223 L224 F227	V126-F175 HydrophobicContact CG1-CB 4.09Å; V126-F175 HydrophobicContact CG2-CB 4.29Å; V126-F175 HydrophobicContact CG2-CD2 4.46Å; K171-F175 PolarHBondContact O-N 3.1Å; K171-F175 VanDerWaalsContact O-N 3.1Å; V172-F175 WeakPolarHBondContact O-CB 3.35Å; V172-F175 PolarHBondContact O-N 3.45Å; E173-F175 VanDerWaalsContact C-N 3.34Å; F175-T177 VanDerWaalsContact C-N 3.25Å; F175-T177 PolarHBondContact O-N 3.34Å; F175-T178 PolarHBondContact O-N 2.92Å; F175-I179 WeakPolarHBondContact O-CG1 3.48Å; F175-I179 PolarHBondContact O-N 3.14Å; F175-M220 HydrophobicContact CB-CE 4.14Å; F175-M220 HydrophobicContact CB-CG 4.21Å; F175-M220 HydrophobicContact CB-SD 3.88Å; F175-M220 HydrophobicContact CD1-CE 4.2Å; F175-M220 HydrophobicContact CD1-CG 3.73Å; F175-M220 HydrophobicContact CD1-SD 4.37Å; F175-M220 HydrophobicContact CD2-CB 4.41Å; F175-M220 HydrophobicContact CD2-CG 4.07Å; F175-M220 HydrophobicContact CE1-CG 4.02Å; F175-M220 HydrophobicContact CE2-CB 4.46Å; F175-M220 HydrophobicContact CE2-CG 4.33Å; F175-M220 HydrophobicContact CG-CE 4.41Å; F175-M220 HydrophobicContact CG-CG 3.76Å; F175-M220 HydrophobicContact CG-SD 4.12Å; F175-M220 HydrophobicContact CZ-CG 4.32Å; F175-D223 HydrophobicContact CE2-CB 4.11Å; F175-D223 HydrophobicContact CZ-CB 3.69Å; F175-L224 HydrophobicContact CD2-CD2 4.49Å; F175-L224 HydrophobicContact CE2-CD2 4.43Å; F175-F227 AromaticContact CE2-CE2 3.84Å; F175-F227 HydrophobicContact CE2-CE2 3.84Å; F175-F227 AromaticContact CZ-CE2 3.99Å; F175-F227 HydrophobicContact CZ-CE2 3.99Å; F175-F227 HydrophobicContact CZ-CZ 4.48Å
176	Q	96.4	Very high	98.1	Very high	25 Å²	25	53.3 Å²	53.3	12%	0.117	29%	0.29	C	S	.	.	H	α-helix	trans	-59.7	-39	175.1	-61.7	-175.8	-36.8	0	0	111.8	V126 W127 V172 E173 A174 S180	V126-Q176 HydrophobicContact CG1-CG 3.57Å; W127-Q176 VanDerWaalsContact CD2-NE2 3.29Å; V172-Q176 PolarHBondContact O-N 3.15Å; E173-Q176 WeakPolarHBondContact O-CB 3.16Å; E173-Q176 PolarHBondContact O-N 3.02Å; A174-Q176 VanDerWaalsContact C-N 3.32Å; A174-Q176 PolarHBondContact O-N 3.4Å; Q176-S180 WeakPolarHBondContact O-CB 3.47Å; Q176-S180 PolarHBondContact O-N 3.21Å; Q176-S180 VanDerWaalsContact O-N 3.08Å; Q176-S180 PolarHBondContact O-OG 2.73Å
177	T	97.1	Very high	98	Very high	72 Å²	72	52.1 Å²	52.1	44%	0.442	29%	0.293	S	S	.	.	H	α-helix	trans	-67.1	-45.4	176.7	-54.8	0	0	0	0	111.1	E173 A174 F175 S180 K181	E173-T177 PolarHBondContact O-N 3.1Å; E173-T177 PolarHBondContact O-OG1 3.19Å; A174-T177 WeakPolarHBondContact O-CA 3.28Å; A174-T177 WeakPolarHBondContact O-CB 3.35Å; A174-T177 PolarHBondContact O-N 3.25Å; F175-T177 VanDerWaalsContact C-N 3.25Å; F175-T177 PolarHBondContact O-N 3.34Å; T177-S180 PolarHBondContact O-N 3.48Å; T177-K181 HydrophobicContact CG2-CD 4.24Å; T177-K181 HydrophobicContact CG2-CG 4.47Å; T177-K181 WeakPolarHBondContact O-CB 3.4Å; T177-K181 WeakPolarHBondContact O-CG 3.39Å; T177-K181 PolarHBondContact O-N 2.82Å
178	T	97.4	Very high	98	Very high	54 Å²	54	55.1 Å²	55.1	33%	0.331	30%	0.304	S	S	.	.	H	α-helix	trans	-59.6	-46.5	176.7	-58.7	0	0	0	0	111.6	A174 F175 S180 K181 Y182 E216 M220	A174-T178 PolarHBondContact O-N 3.32Å; A174-T178 PolarHBondContact O-OG1 2.92Å; F175-T178 PolarHBondContact O-N 2.92Å; T178-S180 VanDerWaalsContact C-N 3.32Å; T178-S180 PolarHBondContact O-N 3.01Å; T178-K181 PolarHBondContact O-N 3.41Å; T178-Y182 PolarHBondContact O-N 3.2Å; T178-Y182 VanDerWaalsContact O-N 3.13Å; T178-E216 HydrophobicContact CG2-CB 4.45Å; T178-E216 HydrophobicContact CG2-CG 4.43Å; T178-M220 HydrophobicContact CG2-CE 3.62Å
179	I	97.3	Very high	98	Very high	15 Å²	15	55.2 Å²	55.2	8%	0.077	31%	0.305	C	S	.	.	H	α-helix	trans	-58.4	-44.2	176.1	-73.1	160.7	0	0	0	111.3	L119 K123 V126 F175 F183 L217 M220	L119-I179 HydrophobicContact CD2-CB 4.35Å; L119-I179 HydrophobicContact CD2-CG1 3.99Å; L119-I179 HydrophobicContact CD2-CG2 3.71Å; K123-I179 HydrophobicContact CD-CG2 4.09Å; K123-I179 HydrophobicContact CG-CD1 4.16Å; K123-I179 HydrophobicContact CG-CG2 4.03Å; V126-I179 HydrophobicContact CG2-CD1 4.24Å; F175-I179 WeakPolarHBondContact O-CG1 3.48Å; F175-I179 PolarHBondContact O-N 3.14Å; I179-F183 HydrophobicContact CG2-CE2 4.31Å; I179-F183 VanDerWaalsContact O-CD2 3.27Å; I179-F183 WeakPolarHBondContact O-CD2 3.27Å; I179-L217 HydrophobicContact CG1-CD2 4.37Å; I179-M220 HydrophobicContact CD1-SD 4.07Å; I179-M220 HydrophobicContact CG1-CE 4.31Å; I179-M220 HydrophobicContact CG1-SD 4.15Å
180	S	95.9	Very high	97.9	Very high	78 Å²	78	53.9 Å²	53.9	55%	0.545	30%	0.3	S	S	.	.	H	α-helix	trans	-66.7	-41.2	-180	-56.4	0	0	0	0	111.7	Q176 T177 T178 Y182 F183	Q176-S180 WeakPolarHBondContact O-CB 3.47Å; Q176-S180 PolarHBondContact O-N 3.21Å; Q176-S180 VanDerWaalsContact O-N 3.08Å; Q176-S180 PolarHBondContact O-OG 2.73Å; T177-S180 PolarHBondContact O-N 3.48Å; T178-S180 VanDerWaalsContact C-N 3.32Å; T178-S180 PolarHBondContact O-N 3.01Å; S180-Y182 VanDerWaalsContact C-N 3.33Å; S180-Y182 PolarHBondContact O-N 3.08Å; S180-F183 PolarHBondContact O-N 3.06Å
181	K	97.8	Very high	97.8	Very high	107 Å²	107	51.2 Å²	51.2	47%	0.465	29%	0.287	S	S	.	.	H	α-helix	trans	-63.6	-34.3	179.4	-78.5	-179.9	176.8	-178.8	0	113.3	T177 T178 F183 S184 E185	T177-K181 HydrophobicContact CG2-CD 4.24Å; T177-K181 HydrophobicContact CG2-CG 4.47Å; T177-K181 WeakPolarHBondContact O-CB 3.4Å; T177-K181 WeakPolarHBondContact O-CG 3.39Å; T177-K181 PolarHBondContact O-N 2.82Å; T178-K181 PolarHBondContact O-N 3.41Å; K181-F183 VanDerWaalsContact C-N 3.27Å; K181-F183 PolarHBondContact O-N 3.22Å; K181-S184 WeakPolarHBondContact CA-OG 3.34Å; K181-S184 PolarHBondContact O-N 3.04Å; K181-S184 PolarHBondContact O-OG 3.25Å; K181-E185 WeakPolarHBondContact O-CB 3.5Å; K181-E185 VanDerWaalsContact O-CG 3.31Å; K181-E185 WeakPolarHBondContact O-CG 3.27Å; K181-E185 PolarHBondContact O-N 2.92Å
182	Y	98.4	Very high	97.7	Very high	19 Å²	19	51 Å²	51	8%	0.075	29%	0.287	C	S	.	.	H	α-helix	trans	-52.3	-46.8	176.9	167.8	-109	0	0	0	112	V115 L119 T178 S180 R186 D210 A213	V115-Y182 HydrophobicContact CG1-CD1 4.48Å; V115-Y182 HydrophobicContact CG1-CE1 3.71Å; V115-Y182 HydrophobicContact CG1-CE2 4.21Å; V115-Y182 WeakPolarHBondContact CG1-OH 3.44Å; L119-Y182 HydrophobicContact CD1-CD1 3.91Å; L119-Y182 HydrophobicContact CD1-CE1 3.94Å; T178-Y182 PolarHBondContact O-N 3.2Å; T178-Y182 VanDerWaalsContact O-N 3.13Å; S180-Y182 VanDerWaalsContact C-N 3.33Å; S180-Y182 PolarHBondContact O-N 3.08Å; Y182-R186 HydrophobicContact CE2-CB 4.27Å; Y182-R186 WeakPolarHBondContact O-CB 3.4Å; Y182-R186 PolarHBondContact O-N 3.2Å; Y182-R186 VanDerWaalsContact OH-CD 3.23Å; Y182-R186 WeakPolarHBondContact OH-CD 3.33Å; Y182-R186 PolarHBondContact OH-NE 3.07Å; Y182-D210 WeakPolarHBondContact CE2-OD1 3.4Å; Y182-D210 PolarHBondContact OH-OD1 2.91Å; Y182-A213 HydrophobicContact CD2-CB 3.41Å; Y182-A213 VanDerWaalsContact CD2-CB 3.41Å; Y182-A213 HydrophobicContact CE2-CB 3.53Å; Y182-A213 HydrophobicContact CG-CB 4.12Å
183	F	98.1	Very high	97.6	Very high	98 Å²	98	51 Å²	51	43%	0.43	29%	0.287	S	S	.	.	H	α-helix	trans	-63.9	-44.6	-178.7	-66.7	-77.9	0	0	0	112.6	L116 L119 I179 S180 K181 G187	L116-F183 HydrophobicContact CD2-CE1 3.74Å; L116-F183 HydrophobicContact CD2-CZ 4.24Å; L119-F183 HydrophobicContact CD1-CE1 4.46Å; L119-F183 HydrophobicContact CD1-CE2 4.28Å; L119-F183 HydrophobicContact CD1-CZ 3.78Å; I179-F183 HydrophobicContact CG2-CE2 4.31Å; I179-F183 VanDerWaalsContact O-CD2 3.27Å; I179-F183 WeakPolarHBondContact O-CD2 3.27Å; S180-F183 PolarHBondContact O-N 3.06Å; K181-F183 VanDerWaalsContact C-N 3.27Å; K181-F183 PolarHBondContact O-N 3.22Å; F183-G187 PolarHBondContact O-N 3.17Å
184	S	97.8	Very high	97.4	Very high	65 Å²	65	49.7 Å²	49.7	46%	0.455	29%	0.285	S	S	.	.	H	α-helix	trans	-68.2	-46.8	178.3	49.4	0	0	0	0	111.9	K181 G187 D188	K181-S184 WeakPolarHBondContact CA-OG 3.34Å; K181-S184 PolarHBondContact O-N 3.04Å; K181-S184 PolarHBondContact O-OG 3.25Å; S184-G187 PolarHBondContact O-N 3.5Å; S184-D188 PolarHBondContact O-N 3.09Å
185	E	98.4	Very high	97.1	Very high	74 Å²	74	55.2 Å²	55.2	35%	0.346	30%	0.299	S	S	.	.	H	α-helix	trans	-68.5	-40.3	-176	-69.7	178.5	179.5	0	0	111.9	K181 A189 R209	K181-E185 WeakPolarHBondContact O-CB 3.5Å; K181-E185 VanDerWaalsContact O-CG 3.31Å; K181-E185 WeakPolarHBondContact O-CG 3.27Å; K181-E185 PolarHBondContact O-N 2.92Å; E185-A189 WeakPolarHBondContact O-CB 3.5Å; E185-A189 PolarHBondContact O-N 2.82Å; E185-R209 IonicContact OE2-CZ 3.56Å; E185-R209 IonicContact OE2-NH1 3.02Å; E185-R209 PolarHBondContact OE2-NH1 2.77Å
186	R	98.5	Very high	96.8	Very high	26 Å²	26	57.8 Å²	57.8	10%	0.098	31%	0.312	C	S	.	.	H	α-helix	trans	-66	-42.7	172.9	-171.8	-177.7	-169.5	-83.1	-0.5	111	P110 Y182 D188 A189 V190 D210	P110-R186 PolarHBondContact O-NH1 3.29Å; Y182-R186 HydrophobicContact CE2-CB 4.27Å; Y182-R186 WeakPolarHBondContact O-CB 3.4Å; Y182-R186 PolarHBondContact O-N 3.2Å; Y182-R186 VanDerWaalsContact OH-CD 3.23Å; Y182-R186 WeakPolarHBondContact OH-CD 3.33Å; Y182-R186 PolarHBondContact OH-NE 3.07Å; R186-D188 VanDerWaalsContact C-N 3.33Å; R186-D188 PolarHBondContact O-N 2.68Å; R186-A189 PolarHBondContact O-N 3.11Å; R186-V190 HydrophobicContact CG-CG2 4.37Å; R186-V190 WeakPolarHBondContact O-CB 3.49Å; R186-V190 VanDerWaalsContact O-CG2 3.3Å; R186-V190 WeakPolarHBondContact O-CG2 3.45Å; R186-V190 PolarHBondContact O-N 3.43Å; R186-D210 VanDerWaalsContact CD-OD1 3.29Å; R186-D210 WeakPolarHBondContact CD-OD1 3.21Å; R186-D210 IonicContact CZ-OD1 2.77Å; R186-D210 IonicContact CZ-OD2 3.38Å; R186-D210 IonicContact NE-OD1 2.69Å; R186-D210 PolarHBondContact NE-OD1 3.2Å; R186-D210 IonicContact NE-OD2 3.93Å; R186-D210 PolarHBondContact NE-OD2 3.14Å; R186-D210 IonicContact NH2-OD1 3.6Å; R186-D210 IonicContact NH2-OD2 3.78Å; R186-D210 PolarHBondContact NH2-OD2 3.47Å
187	G	98.2	Very high	96.6	Very high	39 Å²	39	58.2 Å²	58.2	40%	0.402	32%	0.316	S	S	.	.	H	α-helix	trans	-57.2	-46.1	176.2	0	0	0	0	0	112.1	F183 S184 V190 A191	F183-G187 PolarHBondContact O-N 3.17Å; S184-G187 PolarHBondContact O-N 3.5Å; G187-V190 PolarHBondContact O-N 3.27Å; G187-A191 VanDerWaalsContact O-CB 3.32Å; G187-A191 WeakPolarHBondContact O-CB 3.39Å; G187-A191 PolarHBondContact O-N 3.23Å
188	D	98.2	Very high	96.3	Very high	104 Å²	104	61.3 Å²	61.3	56%	0.556	33%	0.325	S	S	*	.	H	α-helix	trans	-65.6	-41.1	176.7	-73.5	-19.4	0	0	0	112.3	S184 R186 A191 K192	S184-D188 PolarHBondContact O-N 3.09Å; R186-D188 VanDerWaalsContact C-N 3.33Å; R186-D188 PolarHBondContact O-N 2.68Å; D188-A191 PolarHBondContact O-N 3.39Å; D188-K192 WeakPolarHBondContact O-CG 3.44Å; D188-K192 PolarHBondContact O-N 3.18Å
189	A	98.2	Very high	96.2	Very high	3 Å²	3	60.4 Å²	60.4	3%	0.025	32%	0.32	C	S	.	.	H	α-helix	trans	-62.4	-45.8	176.1	0	0	0	0	0	111.8	E185 R186 K192 A193 L205 V206	E185-A189 WeakPolarHBondContact O-CB 3.5Å; E185-A189 PolarHBondContact O-N 2.82Å; R186-A189 PolarHBondContact O-N 3.11Å; A189-K192 PolarHBondContact O-N 3.21Å; A189-A193 WeakPolarHBondContact O-CB 3.49Å; A189-A193 PolarHBondContact O-N 3.39Å; A189-L205 HydrophobicContact CB-CD2 3.91Å; A189-L205 HydrophobicContact CB-CG 3.95Å; A189-V206 HydrophobicContact CB-CG2 3.86Å
190	V	97.9	Very high	96.1	Very high	22 Å²	22	64.2 Å²	64.2	13%	0.133	34%	0.338	C	S	.	.	H	α-helix	trans	-63	-43.3	175.6	171.5	0	0	0	0	110.7	L109 R186 G187 K192 A193 S194 V206	L109-V190 HydrophobicContact CB-CG1 4.23Å; L109-V190 HydrophobicContact CD1-CG1 3.51Å; R186-V190 HydrophobicContact CG-CG2 4.37Å; R186-V190 WeakPolarHBondContact O-CB 3.49Å; R186-V190 VanDerWaalsContact O-CG2 3.3Å; R186-V190 WeakPolarHBondContact O-CG2 3.45Å; R186-V190 PolarHBondContact O-N 3.43Å; G187-V190 PolarHBondContact O-N 3.27Å; V190-K192 PolarHBondContact O-N 2.96Å; V190-A193 PolarHBondContact O-N 2.94Å; V190-S194 WeakPolarHBondContact O-CB 3.48Å; V190-S194 PolarHBondContact O-N 3.23Å; V190-S194 PolarHBondContact O-OG 3.49Å; V190-V206 HydrophobicContact CB-CG2 4.4Å; V190-V206 HydrophobicContact CG2-CB 4.46Å; V190-V206 HydrophobicContact CG2-CG1 3.84Å; V190-V206 HydrophobicContact CG2-CG2 3.65Å
191	A	96.6	Very high	96.2	Very high	33 Å²	33	66.5 Å²	66.5	27%	0.273	34%	0.344	S	S	.	.	H	α-helix	trans	-60.6	-44.2	177.4	0	0	0	0	0	111.6	G187 D188 S194 K195	G187-A191 VanDerWaalsContact O-CB 3.32Å; G187-A191 WeakPolarHBondContact O-CB 3.39Å; G187-A191 PolarHBondContact O-N 3.23Å; D188-A191 PolarHBondContact O-N 3.39Å; A191-S194 PolarHBondContact O-N 2.89Å; A191-S194 PolarHBondContact O-OG 3.41Å; A191-K195 VanDerWaalsContact O-CG 3.29Å; A191-K195 WeakPolarHBondContact O-CG 3.3Å; A191-K195 PolarHBondContact O-N 3.4Å; A191-K195 VanDerWaalsContact O-N 3.15Å
192	K	96.4	Very high	96.2	Very high	99 Å²	99	64 Å²	64	43%	0.43	33%	0.332	S	S	.	.	H	α-helix	trans	-63.6	-46.8	174.8	-72.5	177.3	-177.4	-179	0	112.2	D188 A189 V190 S194 K195 E196 Y202	D188-K192 WeakPolarHBondContact O-CG 3.44Å; D188-K192 PolarHBondContact O-N 3.18Å; A189-K192 PolarHBondContact O-N 3.21Å; V190-K192 PolarHBondContact O-N 2.96Å; K192-S194 PolarHBondContact O-N 3.19Å; K192-K195 PolarHBondContact O-N 3.2Å; K192-K195 VanDerWaalsContact O-N 3.15Å; K192-E196 PolarHBondContact O-N 2.86Å; K192-Y202 HydrophobicContact CB-CD1 3.9Å; K192-Y202 HydrophobicContact CB-CD2 4Å; K192-Y202 HydrophobicContact CB-CE1 4.05Å; K192-Y202 HydrophobicContact CB-CE2 4.15Å; K192-Y202 HydrophobicContact CB-CG 3.89Å; K192-Y202 HydrophobicContact CD-CD1 4.16Å; K192-Y202 HydrophobicContact CD-CE1 3.69Å; K192-Y202 HydrophobicContact CG-CE1 4.44Å
193	A	95.8	Very high	96.2	Very high	1 Å²	1	64.2 Å²	64.2	1%	0.008	33%	0.333	C	S	.	.	H	α-helix	trans	-58.3	-37	177.7	0	0	0	0	0	112.4	I66 A189 V190 R203	I66-A193 HydrophobicContact CD1-CB 3.54Å; A189-A193 WeakPolarHBondContact O-CB 3.49Å; A189-A193 PolarHBondContact O-N 3.39Å; V190-A193 PolarHBondContact O-N 2.94Å; A193-R203 HydrophobicContact CB-CG 4.45Å
194	S	94	Very high	96.2	Very high	38 Å²	38	62.2 Å²	62.2	27%	0.266	34%	0.335	S	S	.	.	H	α-helix	trans	-75.4	-28.4	179.5	72.9	0	0	0	0	113.7	V190 A191 K192 T197	V190-S194 WeakPolarHBondContact O-CB 3.48Å; V190-S194 PolarHBondContact O-N 3.23Å; V190-S194 PolarHBondContact O-OG 3.49Å; A191-S194 PolarHBondContact O-N 2.89Å; A191-S194 PolarHBondContact O-OG 3.41Å; K192-S194 PolarHBondContact O-N 3.19Å; S194-T197 WeakPolarHBondContact O-CG2 3.36Å
195	K	92.2	Very high	96.2	Very high	165 Å²	165	61.6 Å²	61.6	72%	0.717	33%	0.326	S	S	*	.	H	α-helix	trans	-86.1	-42.6	179.1	-72	173.4	-178.1	176.6	0	112.5	A191 K192	A191-K195 VanDerWaalsContact O-CG 3.29Å; A191-K195 WeakPolarHBondContact O-CG 3.3Å; A191-K195 PolarHBondContact O-N 3.4Å; A191-K195 VanDerWaalsContact O-N 3.15Å; K192-K195 PolarHBondContact O-N 3.2Å; K192-K195 VanDerWaalsContact O-N 3.15Å
196	E	92.6	Very high	96.2	Very high	77 Å²	77	58.1 Å²	58.1	36%	0.36	31%	0.31	S	S	.	.	S	Bend	trans	-108.9	63	-176.6	-67.1	176	-139.8	0	0	109.1	K192 H198 V199 Y202	K192-E196 PolarHBondContact O-N 2.86Å; E196-H198 PolarHBondContact O-N 3.47Å; E196-V199 HydrophobicContact CB-CB 4.33Å; E196-V199 HydrophobicContact CB-CG2 4.01Å; E196-V199 PolarHBondContact O-N 2.91Å; E196-Y202 HydrophobicContact CB-CD2 4.1Å; E196-Y202 HydrophobicContact CB-CE2 3.9Å; E196-Y202 HydrophobicContact CG-CE2 4.43Å; E196-Y202 VanDerWaalsContact OE2-CE2 3.25Å; E196-Y202 WeakPolarHBondContact OE2-CE2 3.49Å; E196-Y202 PolarHBondContact OE2-OH 3.18Å
197	T	91.7	Very high	96.2	Very high	34 Å²	34	58.5 Å²	58.5	21%	0.209	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-19.1	-170.6	53.9	0	0	0	0	114.9	I66 P69 S194	I66-T197 HydrophobicContact CG2-CG2 3.69Å; P69-T197 WeakPolarHBondContact CD-O 3.21Å; P69-T197 WeakPolarHBondContact CG-OG1 3.36Å; S194-T197 WeakPolarHBondContact O-CG2 3.36Å
198	H	91.3	Very high	96.2	Very high	136 Å²	136	62.1 Å²	62.1	63%	0.63	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-16.2	175.8	60.6	-81.4	0	0	0	113.1	P69 E196 M200	P69-H198 HydrophobicContact CG-CB 4.28Å; E196-H198 PolarHBondContact O-N 3.47Å; H198-M200 PolarHBondContact O-N 3.44Å
199	V	95.1	Very high	96.2	Very high	35 Å²	35	61.6 Å²	61.6	21%	0.212	31%	0.309	C	S	.	.			trans	-91.7	96.4	179.1	-176.3	0	0	0	0	109.2	E196 D201 Y202	E196-V199 HydrophobicContact CB-CB 4.33Å; E196-V199 HydrophobicContact CB-CG2 4.01Å; E196-V199 PolarHBondContact O-N 2.91Å; V199-D201 VanDerWaalsContact C-N 3.26Å; V199-D201 HydrophobicContact CG1-CB 4.3Å; V199-D201 PolarHBondContact O-N 3.13Å; V199-Y202 HydrophobicContact CB-CD2 3.67Å; V199-Y202 HydrophobicContact CB-CE2 3.83Å; V199-Y202 HydrophobicContact CG1-CD2 3.63Å; V199-Y202 HydrophobicContact CG1-CE2 3.66Å; V199-Y202 HydrophobicContact CG1-CG 4.3Å; V199-Y202 HydrophobicContact CG2-CE2 4.24Å; V199-Y202 PolarHBondContact O-N 2.84Å
200	M	95.5	Very high	96.2	Very high	95 Å²	95	61.5 Å²	61.5	47%	0.468	31%	0.308	S	S	.	.	H	α-helix	trans	-68.9	-22.7	-175.3	-61.7	-56.3	-72.6	0	0	113.5	I68 H198 Y202 R203 A204	I68-M200 HydrophobicContact CD1-CE 4.3Å; H198-M200 PolarHBondContact O-N 3.44Å; M200-Y202 PolarHBondContact O-N 3.37Å; M200-R203 VanDerWaalsContact CE-CD 3.46Å; M200-R203 WeakPolarHBondContact O-CB 3.48Å; M200-R203 PolarHBondContact O-N 3.26Å; M200-A204 PolarHBondContact O-N 3.44Å
201	D	98.3	Very high	96.2	Very high	126 Å²	126	61.8 Å²	61.8	67%	0.674	31%	0.308	S	S	*	.	H	α-helix	trans	-60.6	-30.4	176	-65.7	-65	0	0	0	112.9	V199 R203 A204 L205	V199-D201 VanDerWaalsContact C-N 3.26Å; V199-D201 HydrophobicContact CG1-CB 4.3Å; V199-D201 PolarHBondContact O-N 3.13Å; D201-R203 VanDerWaalsContact C-N 3.31Å; D201-R203 PolarHBondContact O-N 3.39Å; D201-A204 PolarHBondContact O-N 2.99Å; D201-L205 WeakPolarHBondContact O-CB 3.49Å; D201-L205 PolarHBondContact O-N 2.85Å
202	Y	98	Very high	96.3	Very high	54 Å²	54	62.5 Å²	62.5	21%	0.212	31%	0.314	C	S	.	.	H	α-helix	trans	-70.1	-29.1	175.5	-65.7	-49	0	0	0	112.8	K192 E196 V199 M200 L205 V206	K192-Y202 HydrophobicContact CB-CD1 3.9Å; K192-Y202 HydrophobicContact CB-CD2 4Å; K192-Y202 HydrophobicContact CB-CE1 4.05Å; K192-Y202 HydrophobicContact CB-CE2 4.15Å; K192-Y202 HydrophobicContact CB-CG 3.89Å; K192-Y202 HydrophobicContact CD-CD1 4.16Å; K192-Y202 HydrophobicContact CD-CE1 3.69Å; K192-Y202 HydrophobicContact CG-CE1 4.44Å; E196-Y202 HydrophobicContact CB-CD2 4.1Å; E196-Y202 HydrophobicContact CB-CE2 3.9Å; E196-Y202 HydrophobicContact CG-CE2 4.43Å; E196-Y202 VanDerWaalsContact OE2-CE2 3.25Å; E196-Y202 WeakPolarHBondContact OE2-CE2 3.49Å; E196-Y202 PolarHBondContact OE2-OH 3.18Å; V199-Y202 HydrophobicContact CB-CD2 3.67Å; V199-Y202 HydrophobicContact CB-CE2 3.83Å; V199-Y202 HydrophobicContact CG1-CD2 3.63Å; V199-Y202 HydrophobicContact CG1-CE2 3.66Å; V199-Y202 HydrophobicContact CG1-CG 4.3Å; V199-Y202 HydrophobicContact CG2-CE2 4.24Å; V199-Y202 PolarHBondContact O-N 2.84Å; M200-Y202 PolarHBondContact O-N 3.37Å; Y202-L205 HydrophobicContact CD1-CD2 4.27Å; Y202-L205 PolarHBondContact O-N 3.23Å; Y202-V206 WeakPolarHBondContact O-CG2 3.42Å; Y202-V206 PolarHBondContact O-N 3.37Å; Y202-V206 VanDerWaalsContact O-N 3.14Å
203	R	97.5	Very high	96.4	Very high	25 Å²	25	58.4 Å²	58.4	9%	0.094	30%	0.299	C	S	.	.	H	α-helix	trans	-69.4	-44.5	172.7	-60.2	175.4	-177.8	-109.1	1.8	110.2	L64 I66 P67 A193 M200 D201 L205 V206 H207	L64-R203 HydrophobicContact CD2-CB 3.91Å; L64-R203 HydrophobicContact CD2-CG 3.96Å; I66-R203 VanDerWaalsContact O-CZ 3.25Å; I66-R203 PolarHBondContact O-NH1 3.24Å; I66-R203 PolarHBondContact O-NH2 3.41Å; P67-R203 PolarHBondContact O-NH2 3.26Å; P67-R203 VanDerWaalsContact O-NH2 3.08Å; A193-R203 HydrophobicContact CB-CG 4.45Å; M200-R203 VanDerWaalsContact CE-CD 3.46Å; M200-R203 WeakPolarHBondContact O-CB 3.48Å; M200-R203 PolarHBondContact O-N 3.26Å; D201-R203 VanDerWaalsContact C-N 3.31Å; D201-R203 PolarHBondContact O-N 3.39Å; R203-L205 VanDerWaalsContact C-N 3.29Å; R203-L205 PolarHBondContact O-N 3.29Å; R203-V206 PolarHBondContact O-N 2.9Å; R203-H207 PolarHBondContact O-CD2 2.68Å; R203-H207 PolarHBondContact O-N 2.92Å
204	A	97.8	Very high	96.5	Very high	56 Å²	56	58.8 Å²	58.8	46%	0.463	30%	0.3	S	S	.	.	H	α-helix	trans	-59.1	-42	173	0	0	0	0	0	111.3	M200 D201 V206 H207 E208	M200-A204 PolarHBondContact O-N 3.44Å; D201-A204 PolarHBondContact O-N 2.99Å; A204-V206 VanDerWaalsContact C-N 3.34Å; A204-V206 PolarHBondContact O-N 3.42Å; A204-H207 PolarHBondContact O-N 2.92Å; A204-H207 VanDerWaalsContact O-N 3.15Å; A204-E208 WeakPolarHBondContact O-CB 3.49Å; A204-E208 PolarHBondContact O-N 3.16Å
205	L	98.4	Very high	96.7	Very high	52 Å²	52	58.7 Å²	58.7	27%	0.272	31%	0.305	S	S	.	.	H	α-helix	trans	-59.7	-40	177.4	-179.7	62.8	0	0	0	112.6	A189 D201 Y202 R203 H207 E208 R209	A189-L205 HydrophobicContact CB-CD2 3.91Å; A189-L205 HydrophobicContact CB-CG 3.95Å; D201-L205 WeakPolarHBondContact O-CB 3.49Å; D201-L205 PolarHBondContact O-N 2.85Å; Y202-L205 HydrophobicContact CD1-CD2 4.27Å; Y202-L205 PolarHBondContact O-N 3.23Å; R203-L205 VanDerWaalsContact C-N 3.29Å; R203-L205 PolarHBondContact O-N 3.29Å; L205-H207 VanDerWaalsContact C-N 3.33Å; L205-H207 PolarHBondContact O-N 2.89Å; L205-E208 PolarHBondContact O-N 3.15Å; L205-R209 HydrophobicContact CD1-CG 4.22Å; L205-R209 HydrophobicContact CG-CG 4.46Å; L205-R209 WeakPolarHBondContact O-CB 3.49Å; L205-R209 WeakPolarHBondContact O-CG 3.44Å; L205-R209 PolarHBondContact O-N 3.26Å
206	V	98.5	Very high	97	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.006	29%	0.293	C	S	.	.	H	α-helix	trans	-60.3	-46.3	175.6	175.5	0	0	0	0	110.6	L64 A189 V190 Y202 R203 A204 R209 D210	L64-V206 HydrophobicContact CD1-CG1 4.43Å; L64-V206 HydrophobicContact CD2-CB 4.12Å; L64-V206 HydrophobicContact CD2-CG1 4.41Å; L64-V206 HydrophobicContact CD2-CG2 4.11Å; A189-V206 HydrophobicContact CB-CG2 3.86Å; V190-V206 HydrophobicContact CB-CG2 4.4Å; V190-V206 HydrophobicContact CG2-CB 4.46Å; V190-V206 HydrophobicContact CG2-CG1 3.84Å; V190-V206 HydrophobicContact CG2-CG2 3.65Å; Y202-V206 WeakPolarHBondContact O-CG2 3.42Å; Y202-V206 PolarHBondContact O-N 3.37Å; Y202-V206 VanDerWaalsContact O-N 3.14Å; R203-V206 PolarHBondContact O-N 2.9Å; A204-V206 VanDerWaalsContact C-N 3.34Å; A204-V206 PolarHBondContact O-N 3.42Å; V206-R209 PolarHBondContact O-N 2.92Å; V206-D210 PolarHBondContact O-N 2.94Å
207	H	98.3	Very high	97.3	Very high	34 Å²	34	52.1 Å²	52.1	16%	0.157	28%	0.277	C	S	.	.	H	α-helix	trans	-67.8	-42.1	179.5	-61.9	-44.3	0	0	0	112.2	R61 A62 R203 A204 L205 R209 D210 E211	R61-H207 HydrophobicContact CG-CB 4.14Å; A62-H207 PolarHBondContact O-CE1 3.39Å; R203-H207 PolarHBondContact O-CD2 2.68Å; R203-H207 PolarHBondContact O-N 2.92Å; A204-H207 PolarHBondContact O-N 2.92Å; A204-H207 VanDerWaalsContact O-N 3.15Å; L205-H207 VanDerWaalsContact C-N 3.33Å; L205-H207 PolarHBondContact O-N 2.89Å; H207-R209 VanDerWaalsContact C-N 3.28Å; H207-R209 PolarHBondContact O-N 3.24Å; H207-D210 WeakPolarHBondContact O-CB 3.16Å; H207-D210 PolarHBondContact O-N 3.12Å; H207-E211 WeakPolarHBondContact O-CG 3.25Å; H207-E211 PolarHBondContact O-N 3.21Å
208	E	98.3	Very high	97.6	Very high	114 Å²	114	54.5 Å²	54.5	53%	0.533	28%	0.282	S	S	.	.	H	α-helix	trans	-60.6	-38.2	176.2	-171.8	62.1	-152.3	0	0	111.5	A204 L205 D210 E211 A212	A204-E208 WeakPolarHBondContact O-CB 3.49Å; A204-E208 PolarHBondContact O-N 3.16Å; L205-E208 PolarHBondContact O-N 3.15Å; E208-D210 VanDerWaalsContact C-N 3.3Å; E208-D210 PolarHBondContact O-N 3.12Å; E208-E211 PolarHBondContact O-N 3.17Å; E208-A212 VanDerWaalsContact O-CB 3.25Å; E208-A212 WeakPolarHBondContact O-CB 3.23Å; E208-A212 PolarHBondContact O-N 3.39Å
209	R	98.3	Very high	98	Very high	94 Å²	94	49.9 Å²	49.9	36%	0.355	27%	0.268	S	S	.	.	H	α-helix	trans	-64.5	-34.9	174.6	-69	-73.7	167.1	-169.7	-12.2	112.3	E185 L205 V206 H207 A213	E185-R209 IonicContact OE2-CZ 3.56Å; E185-R209 IonicContact OE2-NH1 3.02Å; E185-R209 PolarHBondContact OE2-NH1 2.77Å; L205-R209 HydrophobicContact CD1-CG 4.22Å; L205-R209 HydrophobicContact CG-CG 4.46Å; L205-R209 WeakPolarHBondContact O-CB 3.49Å; L205-R209 WeakPolarHBondContact O-CG 3.44Å; L205-R209 PolarHBondContact O-N 3.26Å; V206-R209 PolarHBondContact O-N 2.92Å; H207-R209 VanDerWaalsContact C-N 3.28Å; H207-R209 PolarHBondContact O-N 3.24Å; R209-A213 WeakPolarHBondContact O-CB 3.37Å; R209-A213 PolarHBondContact O-N 2.65Å
210	D	98.4	Very high	98.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-71	-43.3	176.2	-72	-22.7	0	0	0	111.4	N112 V115 Y182 R186 V206 H207 E208 A213 Y214	N112-D210 PolarHBondContact ND2-OD2 3.1Å; V115-D210 HydrophobicContact CG2-CB 4.32Å; Y182-D210 WeakPolarHBondContact CE2-OD1 3.4Å; Y182-D210 PolarHBondContact OH-OD1 2.91Å; R186-D210 VanDerWaalsContact CD-OD1 3.29Å; R186-D210 WeakPolarHBondContact CD-OD1 3.21Å; R186-D210 IonicContact CZ-OD1 2.77Å; R186-D210 IonicContact CZ-OD2 3.38Å; R186-D210 IonicContact NE-OD1 2.69Å; R186-D210 PolarHBondContact NE-OD1 3.2Å; R186-D210 IonicContact NE-OD2 3.93Å; R186-D210 PolarHBondContact NE-OD2 3.14Å; R186-D210 IonicContact NH2-OD1 3.6Å; R186-D210 IonicContact NH2-OD2 3.78Å; R186-D210 PolarHBondContact NH2-OD2 3.47Å; V206-D210 PolarHBondContact O-N 2.94Å; H207-D210 WeakPolarHBondContact O-CB 3.16Å; H207-D210 PolarHBondContact O-N 3.12Å; E208-D210 VanDerWaalsContact C-N 3.3Å; E208-D210 PolarHBondContact O-N 3.12Å; D210-A213 PolarHBondContact O-N 2.75Å; D210-Y214 PolarHBondContact O-N 3.22Å
211	E	98.1	Very high	98.3	Very high	28 Å²	28	43.9 Å²	43.9	13%	0.131	24%	0.236	C	C	.	.	H	α-helix	trans	-65	-44.4	176.7	-65.4	-175.6	-146.5	0	0	111.4	L57 R61 H207 E208 Y214 G215	L57-E211 HydrophobicContact CB-CB 4.5Å; L57-E211 HydrophobicContact CB-CG 4.05Å; L57-E211 HydrophobicContact CD1-CB 4.45Å; R61-E211 IonicContact CZ-OE1 3.47Å; R61-E211 IonicContact NE-OE1 3.72Å; R61-E211 PolarHBondContact NE-OE1 2.85Å; R61-E211 IonicContact NH2-OE1 3.15Å; R61-E211 PolarHBondContact NH2-OE1 3.38Å; R61-E211 VanDerWaalsContact NH2-OE1 3.15Å; H207-E211 WeakPolarHBondContact O-CG 3.25Å; H207-E211 PolarHBondContact O-N 3.21Å; E208-E211 PolarHBondContact O-N 3.17Å; E211-Y214 WeakPolarHBondContact O-CB 3.31Å; E211-Y214 PolarHBondContact O-N 3.44Å; E211-G215 PolarHBondContact O-N 3.01Å; E211-G215 VanDerWaalsContact O-N 3.14Å
212	A	98.1	Very high	98.3	Very high	49 Å²	49	40.5 Å²	40.5	41%	0.405	22%	0.218	S	C	.	.	H	α-helix	trans	-62.1	-44.8	175	0	0	0	0	0	112	E208 Y214 G215 E216	E208-A212 VanDerWaalsContact O-CB 3.25Å; E208-A212 WeakPolarHBondContact O-CB 3.23Å; E208-A212 PolarHBondContact O-N 3.39Å; A212-Y214 VanDerWaalsContact C-N 3.31Å; A212-Y214 PolarHBondContact O-N 3.44Å; A212-G215 PolarHBondContact O-N 2.96Å; A212-E216 WeakPolarHBondContact O-CG 3.16Å; A212-E216 PolarHBondContact O-N 2.95Å
213	A	98.3	Very high	98.3	Very high	13 Å²	13	41 Å²	41	11%	0.107	22%	0.224	C	C	.	.	H	α-helix	trans	-61.6	-39	178	0	0	0	0	0	112.3	V115 Y182 R209 D210 E216 L217	V115-A213 HydrophobicContact CG1-CB 4.12Å; Y182-A213 HydrophobicContact CD2-CB 3.41Å; Y182-A213 VanDerWaalsContact CD2-CB 3.41Å; Y182-A213 HydrophobicContact CE2-CB 3.53Å; Y182-A213 HydrophobicContact CG-CB 4.12Å; R209-A213 WeakPolarHBondContact O-CB 3.37Å; R209-A213 PolarHBondContact O-N 2.65Å; D210-A213 PolarHBondContact O-N 2.75Å; A213-E216 PolarHBondContact O-N 2.77Å; A213-L217 WeakPolarHBondContact O-CB 3.49Å; A213-L217 WeakPolarHBondContact O-CD1 3.29Å; A213-L217 WeakPolarHBondContact O-CG 3.34Å; A213-L217 PolarHBondContact O-N 3.06Å
214	Y	98.6	Very high	98.4	Very high	8 Å²	8	39.9 Å²	39.9	3%	0.031	22%	0.22	C	C	.	.	H	α-helix	trans	-59.7	-49	173.2	168.3	-94.4	0	0	0	112.1	S51 L52 N53 V54 L57 L60 L118 D210 E211 A212 E216 L217 R218	S51-Y214 WeakPolarHBondContact O-CE2 3.34Å; L52-Y214 PolarHBondContact O-OH 3.4Å; N53-Y214 PolarHBondContact N-OH 3.34Å; V54-Y214 HydrophobicContact CB-CE1 4.35Å; V54-Y214 HydrophobicContact CB-CE2 4.14Å; V54-Y214 WeakPolarHBondContact CB-OH 3.28Å; V54-Y214 HydrophobicContact CG2-CE2 3.81Å; V54-Y214 PolarHBondContact N-OH 3.34Å; L57-Y214 HydrophobicContact CD2-CD1 3.5Å; L57-Y214 HydrophobicContact CD2-CE1 3.47Å; L57-Y214 VanDerWaalsContact CD2-CE1 3.47Å; L60-Y214 HydrophobicContact CD1-CD1 3.78Å; L60-Y214 HydrophobicContact CD1-CD2 3.83Å; L60-Y214 HydrophobicContact CD1-CE1 4.48Å; L60-Y214 HydrophobicContact CD1-CG 3.4Å; L60-Y214 VanDerWaalsContact CD1-CG 3.4Å; L60-Y214 HydrophobicContact CD2-CD2 4.15Å; L118-Y214 HydrophobicContact CD1-CD2 3.47Å; L118-Y214 VanDerWaalsContact CD1-CD2 3.47Å; L118-Y214 HydrophobicContact CD1-CE2 3.86Å; D210-Y214 PolarHBondContact O-N 3.22Å; E211-Y214 WeakPolarHBondContact O-CB 3.31Å; E211-Y214 PolarHBondContact O-N 3.44Å; A212-Y214 VanDerWaalsContact C-N 3.31Å; A212-Y214 PolarHBondContact O-N 3.44Å; Y214-E216 VanDerWaalsContact C-N 3.33Å; Y214-E216 PolarHBondContact O-N 3.05Å; Y214-L217 PolarHBondContact O-N 3.24Å; Y214-R218 PolarHBondContact O-N 3.39Å
215	G	97.9	Very high	98.4	Very high	36 Å²	36	40.4 Å²	40.4	37%	0.371	21%	0.21	S	C	.	.	H	α-helix	trans	-58.1	-45.9	178.4	0	0	0	0	0	112.2	E211 A212 R218 A219	E211-G215 PolarHBondContact O-N 3.01Å; E211-G215 VanDerWaalsContact O-N 3.14Å; A212-G215 PolarHBondContact O-N 2.96Å; G215-R218 PolarHBondContact O-N 2.83Å; G215-A219 WeakPolarHBondContact O-CB 3.35Å; G215-A219 PolarHBondContact O-N 3.37Å
216	E	98.3	Very high	98.4	Very high	99 Å²	99	39.7 Å²	39.7	46%	0.463	21%	0.212	S	C	.	.	H	α-helix	trans	-61.2	-46.6	175.9	-72	-65.1	151.9	0	0	112	T178 A212 A213 Y214 R218 A219 M220	T178-E216 HydrophobicContact CG2-CB 4.45Å; T178-E216 HydrophobicContact CG2-CG 4.43Å; A212-E216 WeakPolarHBondContact O-CG 3.16Å; A212-E216 PolarHBondContact O-N 2.95Å; A213-E216 PolarHBondContact O-N 2.77Å; Y214-E216 VanDerWaalsContact C-N 3.33Å; Y214-E216 PolarHBondContact O-N 3.05Å; E216-R218 VanDerWaalsContact C-N 3.33Å; E216-R218 PolarHBondContact O-N 3.41Å; E216-A219 PolarHBondContact O-N 2.88Å; E216-M220 HydrophobicContact CB-CE 4.33Å; E216-M220 VanDerWaalsContact O-CG 3.25Å; E216-M220 WeakPolarHBondContact O-CG 3.21Å; E216-M220 PolarHBondContact O-N 2.94Å
217	L	98.6	Very high	98.5	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.026	21%	0.212	C	C	.	.	H	α-helix	trans	-62.6	-40.2	178.8	-71.8	166.5	0	0	0	112	V115 L118 L119 V122 I179 A213 Y214 M220 V221	V115-L217 HydrophobicContact CG1-CD1 4.06Å; L118-L217 HydrophobicContact CB-CD1 4.07Å; L119-L217 HydrophobicContact CD2-CD1 4.15Å; L119-L217 HydrophobicContact CD2-CD2 3.63Å; L119-L217 HydrophobicContact CD2-CG 4.47Å; L119-L217 HydrophobicContact CG-CD1 3.86Å; L119-L217 HydrophobicContact CG-CD2 4.2Å; V122-L217 HydrophobicContact CB-CD2 4Å; V122-L217 HydrophobicContact CG1-CD2 3.97Å; V122-L217 HydrophobicContact CG2-CB 4.39Å; V122-L217 HydrophobicContact CG2-CD2 4.24Å; I179-L217 HydrophobicContact CG1-CD2 4.37Å; A213-L217 WeakPolarHBondContact O-CB 3.49Å; A213-L217 WeakPolarHBondContact O-CD1 3.29Å; A213-L217 WeakPolarHBondContact O-CG 3.34Å; A213-L217 PolarHBondContact O-N 3.06Å; Y214-L217 PolarHBondContact O-N 3.24Å; L217-M220 HydrophobicContact CD2-SD 4.25Å; L217-M220 WeakPolarHBondContact O-CB 3.5Å; L217-M220 PolarHBondContact O-N 2.86Å; L217-V221 WeakPolarHBondContact O-CG2 3.42Å; L217-V221 PolarHBondContact O-N 3.37Å
218	R	98.3	Very high	98.5	Very high	85 Å²	85	38.2 Å²	38.2	32%	0.321	21%	0.205	S	C	.	.	H	α-helix	trans	-65.2	-43.7	175.3	-172.8	-179.8	-175.6	-82.8	-1.5	111.6	L52 Y214 G215 E216 M220 V221 L222	L52-R218 HydrophobicContact CD2-CB 4.03Å; L52-R218 HydrophobicContact CD2-CG 4.17Å; L52-R218 WeakPolarHBondContact O-CD 3.36Å; L52-R218 PolarHBondContact O-NE 3.28Å; Y214-R218 PolarHBondContact O-N 3.39Å; G215-R218 PolarHBondContact O-N 2.83Å; E216-R218 VanDerWaalsContact C-N 3.33Å; E216-R218 PolarHBondContact O-N 3.41Å; R218-M220 VanDerWaalsContact C-N 3.32Å; R218-M220 PolarHBondContact O-N 3.39Å; R218-V221 PolarHBondContact O-N 3.45Å; R218-L222 PolarHBondContact O-N 2.93Å
219	A	98.5	Very high	98.5	Very high	39 Å²	39	34.9 Å²	34.9	32%	0.322	20%	0.196	S	C	.	.	H	α-helix	trans	-61.1	-41.1	175.3	0	0	0	0	0	111.7	G215 E216 V221 L222 D223	G215-A219 WeakPolarHBondContact O-CB 3.35Å; G215-A219 PolarHBondContact O-N 3.37Å; E216-A219 PolarHBondContact O-N 2.88Å; A219-V221 PolarHBondContact O-N 2.89Å; A219-L222 WeakPolarHBondContact O-CB 3.32Å; A219-L222 PolarHBondContact O-N 3.27Å; A219-D223 PolarHBondContact O-N 2.97Å
220	M	98.7	Very high	98.5	Very high	3 Å²	3	33.7 Å²	33.7	2%	0.015	20%	0.195	C	C	.	.	H	α-helix	trans	-57.2	-45.2	175.1	-71.5	174.8	-163.3	0	0	111.8	V122 F175 T178 I179 E216 L217 R218 L222 D223 L224	V122-M220 HydrophobicContact CG1-CB 4.16Å; V122-M220 HydrophobicContact CG1-SD 4.36Å; F175-M220 HydrophobicContact CB-CE 4.14Å; F175-M220 HydrophobicContact CB-CG 4.21Å; F175-M220 HydrophobicContact CB-SD 3.88Å; F175-M220 HydrophobicContact CD1-CE 4.2Å; F175-M220 HydrophobicContact CD1-CG 3.73Å; F175-M220 HydrophobicContact CD1-SD 4.37Å; F175-M220 HydrophobicContact CD2-CB 4.41Å; F175-M220 HydrophobicContact CD2-CG 4.07Å; F175-M220 HydrophobicContact CE1-CG 4.02Å; F175-M220 HydrophobicContact CE2-CB 4.46Å; F175-M220 HydrophobicContact CE2-CG 4.33Å; F175-M220 HydrophobicContact CG-CE 4.41Å; F175-M220 HydrophobicContact CG-CG 3.76Å; F175-M220 HydrophobicContact CG-SD 4.12Å; F175-M220 HydrophobicContact CZ-CG 4.32Å; T178-M220 HydrophobicContact CG2-CE 3.62Å; I179-M220 HydrophobicContact CD1-SD 4.07Å; I179-M220 HydrophobicContact CG1-CE 4.31Å; I179-M220 HydrophobicContact CG1-SD 4.15Å; E216-M220 HydrophobicContact CB-CE 4.33Å; E216-M220 VanDerWaalsContact O-CG 3.25Å; E216-M220 WeakPolarHBondContact O-CG 3.21Å; E216-M220 PolarHBondContact O-N 2.94Å; L217-M220 HydrophobicContact CD2-SD 4.25Å; L217-M220 WeakPolarHBondContact O-CB 3.5Å; L217-M220 PolarHBondContact O-N 2.86Å; R218-M220 VanDerWaalsContact C-N 3.32Å; R218-M220 PolarHBondContact O-N 3.39Å; M220-L222 VanDerWaalsContact C-N 3.33Å; M220-L222 PolarHBondContact O-N 3.32Å; M220-D223 PolarHBondContact O-N 3.45Å; M220-L224 WeakPolarHBondContact O-CB 3.29Å; M220-L224 WeakPolarHBondContact O-CG 3.3Å; M220-L224 PolarHBondContact O-N 3.46Å
221	V	98.7	Very high	98.5	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.006	20%	0.195	C	C	.	.	H	α-helix	trans	-64	-39.4	179.1	-177.9	0	0	0	0	111.6	L43 L46 L47 L52 V122 L217 R218 A219 R225	L43-V221 HydrophobicContact CD2-CG1 4.2Å; L46-V221 HydrophobicContact CD2-CG1 4.12Å; L46-V221 HydrophobicContact CD2-CG2 4.47Å; L46-V221 HydrophobicContact CG-CG1 4.48Å; L47-V221 HydrophobicContact CD1-CG1 4.19Å; L47-V221 HydrophobicContact CD2-CB 3.96Å; L47-V221 HydrophobicContact CD2-CG1 3.7Å; L47-V221 HydrophobicContact CG-CB 4.43Å; L47-V221 HydrophobicContact CG-CG1 3.62Å; L52-V221 HydrophobicContact CD1-CG2 4.3Å; V122-V221 HydrophobicContact CG1-CG2 4.37Å; V122-V221 HydrophobicContact CG2-CG2 3.62Å; L217-V221 WeakPolarHBondContact O-CG2 3.42Å; L217-V221 PolarHBondContact O-N 3.37Å; R218-V221 PolarHBondContact O-N 3.45Å; A219-V221 PolarHBondContact O-N 2.89Å; V221-R225 PolarHBondContact O-N 2.69Å; V221-R225 VanDerWaalsContact O-N 3.12Å
222	L	98.7	Very high	98.5	Very high	55 Å²	55	37.1 Å²	37.1	29%	0.288	21%	0.208	S	C	.	.	H	α-helix	trans	-60.8	-48	174.1	-71.9	165.9	0	0	0	111.5	L47 R218 A219 M220 R225 A226	L47-L222 HydrophobicContact CD1-CD2 3.66Å; L47-L222 HydrophobicContact CD1-CG 4.32Å; L47-L222 HydrophobicContact CD2-CD2 3.94Å; L47-L222 HydrophobicContact CD2-CG 3.94Å; L47-L222 HydrophobicContact CG-CD2 4.46Å; R218-L222 PolarHBondContact O-N 2.93Å; A219-L222 WeakPolarHBondContact O-CB 3.32Å; A219-L222 PolarHBondContact O-N 3.27Å; M220-L222 VanDerWaalsContact C-N 3.33Å; M220-L222 PolarHBondContact O-N 3.32Å; L222-R225 PolarHBondContact O-N 2.94Å; L222-A226 WeakPolarHBondContact O-CB 3.22Å; L222-A226 PolarHBondContact O-N 3.15Å
223	D	98.8	Very high	98.5	Very high	65 Å²	65	40.8 Å²	40.8	35%	0.348	22%	0.216	S	C	.	.	H	α-helix	trans	-66.2	-41.2	179.7	-81.4	-11.7	0	0	0	112	F175 A219 M220 R225 A226 F227	F175-D223 HydrophobicContact CE2-CB 4.11Å; F175-D223 HydrophobicContact CZ-CB 3.69Å; A219-D223 PolarHBondContact O-N 2.97Å; M220-D223 PolarHBondContact O-N 3.45Å; D223-R225 VanDerWaalsContact C-N 3.32Å; D223-R225 PolarHBondContact O-N 2.84Å; D223-A226 CarbonylContact O-C 3.6Å; D223-A226 PolarHBondContact O-N 2.92Å; D223-F227 HydrophobicContact CB-CE2 3.93Å; D223-F227 HydrophobicContact CB-CZ 4Å; D223-F227 WeakPolarHBondContact O-CB 3.48Å; D223-F227 VanDerWaalsContact O-CD2 3.23Å; D223-F227 WeakPolarHBondContact O-CD2 3.5Å; D223-F227 WeakPolarHBondContact O-CG 3.42Å; D223-F227 PolarHBondContact O-N 2.88Å
224	L	98.8	Very high	98.5	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-57.9	-46	175.1	-72	172	0	0	0	110.8	L43 E125 V126 L129 V172 F175 M220 F227 Y228	L43-L224 HydrophobicContact CD1-CB 4.03Å; E125-L224 HydrophobicContact CB-CD1 3.74Å; V126-L224 HydrophobicContact CG2-CD1 4.04Å; L129-L224 HydrophobicContact CB-CD2 4.02Å; L129-L224 HydrophobicContact CD2-CD2 3.45Å; L129-L224 VanDerWaalsContact CD2-CD2 3.45Å; L129-L224 HydrophobicContact CG-CD2 4.36Å; V172-L224 HydrophobicContact CG2-CD2 4.5Å; F175-L224 HydrophobicContact CD2-CD2 4.49Å; F175-L224 HydrophobicContact CE2-CD2 4.43Å; M220-L224 WeakPolarHBondContact O-CB 3.29Å; M220-L224 WeakPolarHBondContact O-CG 3.3Å; M220-L224 PolarHBondContact O-N 3.46Å; L224-F227 PolarHBondContact O-N 2.76Å; L224-Y228 WeakPolarHBondContact O-CD2 3.25Å; L224-Y228 PolarHBondContact O-N 2.94Å
225	R	98.7	Very high	98.5	Very high	68 Å²	68	41.6 Å²	41.6	26%	0.257	22%	0.219	S	C	.	.	H	α-helix	trans	-62.7	-43.9	176	-174.6	-174.3	63.3	-178.5	-5	111.2	I40 L43 N44 V221 L222 D223 Y228 A229	I40-R225 HydrophobicContact CG2-CG 4.26Å; L43-R225 HydrophobicContact CB-CB 3.97Å; L43-R225 HydrophobicContact CB-CG 4.25Å; L43-R225 HydrophobicContact CD1-CB 4.09Å; N44-R225 PolarHBondContact OD1-NH1 2.97Å; V221-R225 PolarHBondContact O-N 2.69Å; V221-R225 VanDerWaalsContact O-N 3.12Å; L222-R225 PolarHBondContact O-N 2.94Å; D223-R225 VanDerWaalsContact C-N 3.32Å; D223-R225 PolarHBondContact O-N 2.84Å; R225-Y228 PolarHBondContact O-N 3.02Å; R225-A229 PolarHBondContact O-N 3.47Å; R225-A229 VanDerWaalsContact O-N 3.14Å
226	A	98.7	Very high	98.4	Very high	37 Å²	37	42.5 Å²	42.5	31%	0.306	22%	0.219	S	C	.	.	H	α-helix	trans	-61.5	-45.7	177.4	0	0	0	0	0	111.4	L222 D223 Y228 A229 E230	L222-A226 WeakPolarHBondContact O-CB 3.22Å; L222-A226 PolarHBondContact O-N 3.15Å; D223-A226 CarbonylContact O-C 3.6Å; D223-A226 PolarHBondContact O-N 2.92Å; A226-Y228 PolarHBondContact O-N 3.15Å; A226-A229 PolarHBondContact O-N 2.82Å; A226-A229 VanDerWaalsContact O-N 3.15Å; A226-E230 WeakPolarHBondContact O-CB 3.14Å; A226-E230 VanDerWaalsContact O-CG 3.26Å; A226-E230 WeakPolarHBondContact O-CG 3.44Å; A226-E230 PolarHBondContact O-N 3.45Å
227	F	98.8	Very high	98.4	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.018	22%	0.221	C	C	.	.	H	α-helix	trans	-61.8	-42.4	178.3	-64.8	-26.8	0	0	0	112.4	L129 V168 K171 V172 F175 D223 L224 A229 E230 L231	L129-F227 HydrophobicContact CD2-CB 3.9Å; L129-F227 HydrophobicContact CD2-CD2 3.97Å; L129-F227 HydrophobicContact CD2-CG 4.45Å; V168-F227 HydrophobicContact CG1-CB 3.75Å; V168-F227 HydrophobicContact CG1-CD1 4.28Å; V168-F227 HydrophobicContact CG1-CD2 3.91Å; V168-F227 HydrophobicContact CG1-CG 3.72Å; V168-F227 HydrophobicContact CG2-CD1 4.09Å; V168-F227 HydrophobicContact CG2-CG 4.32Å; K171-F227 HydrophobicContact CB-CE2 4.09Å; K171-F227 HydrophobicContact CB-CZ 3.97Å; K171-F227 HydrophobicContact CD-CE1 3.91Å; K171-F227 HydrophobicContact CD-CE2 4.39Å; K171-F227 HydrophobicContact CD-CZ 3.47Å; K171-F227 VanDerWaalsContact CD-CZ 3.47Å; K171-F227 HydrophobicContact CG-CZ 4.39Å; V172-F227 HydrophobicContact CG2-CD2 4.24Å; V172-F227 HydrophobicContact CG2-CE2 4.43Å; F175-F227 AromaticContact CE2-CE2 3.84Å; F175-F227 HydrophobicContact CE2-CE2 3.84Å; F175-F227 AromaticContact CZ-CE2 3.99Å; F175-F227 HydrophobicContact CZ-CE2 3.99Å; F175-F227 HydrophobicContact CZ-CZ 4.48Å; D223-F227 HydrophobicContact CB-CE2 3.93Å; D223-F227 HydrophobicContact CB-CZ 4Å; D223-F227 WeakPolarHBondContact O-CB 3.48Å; D223-F227 VanDerWaalsContact O-CD2 3.23Å; D223-F227 WeakPolarHBondContact O-CD2 3.5Å; D223-F227 WeakPolarHBondContact O-CG 3.42Å; D223-F227 PolarHBondContact O-N 2.88Å; L224-F227 PolarHBondContact O-N 2.76Å; F227-A229 VanDerWaalsContact C-N 3.34Å; F227-A229 PolarHBondContact O-N 3.36Å; F227-E230 PolarHBondContact O-N 2.82Å; F227-L231 VanDerWaalsContact O-CB 3.28Å; F227-L231 WeakPolarHBondContact O-CB 3.43Å; F227-L231 WeakPolarHBondContact O-CG 3.36Å; F227-L231 PolarHBondContact O-N 3.03Å
228	Y	98.8	Very high	98.3	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-58.9	-47	173.1	-78.9	-62.5	0	0	0	111.4	F31 F35 L36 K39 L43 L129 L224 R225 A226 E230 L231 Y232	F31-Y228 HydrophobicContact CE2-CD1 4.47Å; F31-Y228 HydrophobicContact CE2-CE1 4.05Å; F31-Y228 HydrophobicContact CZ-CD1 4.48Å; F31-Y228 HydrophobicContact CZ-CE1 4.4Å; F35-Y228 HydrophobicContact CE1-CE1 4.27Å; L36-Y228 HydrophobicContact CD1-CD1 4.41Å; L36-Y228 WeakPolarHBondContact CD2-O 3.36Å; L36-Y228 HydrophobicContact CG-CD1 3.88Å; L36-Y228 HydrophobicContact CG-CG 4.45Å; K39-Y228 HydrophobicContact CB-CD2 4.2Å; K39-Y228 HydrophobicContact CB-CE1 4.45Å; K39-Y228 HydrophobicContact CB-CE2 4.05Å; K39-Y228 HydrophobicContact CB-CG 4.48Å; K39-Y228 HydrophobicContact CG-CE2 4.41Å; L43-Y228 HydrophobicContact CD1-CD2 3.67Å; L43-Y228 HydrophobicContact CD1-CE2 3.83Å; L129-Y228 HydrophobicContact CB-CE2 4.37Å; L129-Y228 HydrophobicContact CD1-CD1 3.88Å; L129-Y228 HydrophobicContact CD1-CE1 3.47Å; L129-Y228 VanDerWaalsContact CD1-CE1 3.47Å; L129-Y228 HydrophobicContact CD1-CE2 4.19Å; L129-Y228 HydrophobicContact CD1-CG 4.43Å; L224-Y228 WeakPolarHBondContact O-CD2 3.25Å; L224-Y228 PolarHBondContact O-N 2.94Å; R225-Y228 PolarHBondContact O-N 3.02Å; A226-Y228 PolarHBondContact O-N 3.15Å; Y228-E230 PolarHBondContact O-N 3.21Å; Y228-L231 PolarHBondContact O-N 3.46Å; Y228-Y232 WeakPolarHBondContact O-CB 3.32Å; Y228-Y232 PolarHBondContact O-N 3.15Å
229	A	98.4	Very high	98.3	Very high	43 Å²	43	42 Å²	42	36%	0.355	23%	0.232	S	C	.	.	H	α-helix	trans	-62.5	-42.5	178.6	0	0	0	0	0	112.8	I40 R225 A226 F227 Y232 H233	I40-A229 HydrophobicContact CD1-CB 4.01Å; R225-A229 PolarHBondContact O-N 3.47Å; R225-A229 VanDerWaalsContact O-N 3.14Å; A226-A229 PolarHBondContact O-N 2.82Å; A226-A229 VanDerWaalsContact O-N 3.15Å; F227-A229 VanDerWaalsContact C-N 3.34Å; F227-A229 PolarHBondContact O-N 3.36Å; A229-Y232 PolarHBondContact O-N 3.35Å; A229-H233 WeakPolarHBondContact O-CB 3.42Å; A229-H233 PolarHBondContact O-N 3.49Å
230	E	98.3	Very high	98.2	Very high	70 Å²	70	45.4 Å²	45.4	33%	0.327	24%	0.241	S	C	.	.	H	α-helix	trans	-64.5	-45.1	176.7	-72.5	174	174.9	0	0	112.3	R164 A226 F227 Y228 Y232 H233 I234	R164-E230 IonicContact CZ-OE2 2.73Å; R164-E230 IonicContact NE-OE2 2.63Å; R164-E230 VanDerWaalsContact NH2-CD 3.28Å; R164-E230 IonicContact NH2-OE1 3.74Å; R164-E230 PolarHBondContact NH2-OE1 3.08Å; R164-E230 IonicContact NH2-OE2 3.41Å; R164-E230 PolarHBondContact NH2-OE2 2.79Å; A226-E230 WeakPolarHBondContact O-CB 3.14Å; A226-E230 VanDerWaalsContact O-CG 3.26Å; A226-E230 WeakPolarHBondContact O-CG 3.44Å; A226-E230 PolarHBondContact O-N 3.45Å; F227-E230 PolarHBondContact O-N 2.82Å; Y228-E230 PolarHBondContact O-N 3.21Å; E230-Y232 VanDerWaalsContact C-N 3.35Å; E230-H233 PolarHBondContact O-N 3.38Å; E230-I234 WeakPolarHBondContact O-CG2 3.47Å; E230-I234 PolarHBondContact O-N 3.14Å
231	L	98.4	Very high	98.1	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-61.5	-44.9	177.7	-74.2	174.4	0	0	0	110.7	L36 L129 V165 V168 F227 Y228 I234 I235	L36-L231 HydrophobicContact CD1-CB 4.47Å; L129-L231 HydrophobicContact CD1-CD1 4.06Å; V165-L231 HydrophobicContact CB-CD2 4.27Å; V165-L231 HydrophobicContact CG1-CD2 4.23Å; V165-L231 HydrophobicContact CG2-CD2 3.78Å; V168-L231 HydrophobicContact CG1-CD1 4.28Å; V168-L231 HydrophobicContact CG2-CD2 4.35Å; F227-L231 VanDerWaalsContact O-CB 3.28Å; F227-L231 WeakPolarHBondContact O-CB 3.43Å; F227-L231 WeakPolarHBondContact O-CG 3.36Å; F227-L231 PolarHBondContact O-N 3.03Å; Y228-L231 PolarHBondContact O-N 3.46Å; L231-I234 WeakPolarHBondContact O-CG2 3.48Å; L231-I235 VanDerWaalsContact O-CB 3.28Å; L231-I235 WeakPolarHBondContact O-CB 3.36Å; L231-I235 WeakPolarHBondContact O-CD1 3.38Å; L231-I235 WeakPolarHBondContact O-CG1 3.3Å; L231-I235 PolarHBondContact O-N 3.45Å
232	Y	97.8	Very high	98	Very high	99 Å²	99	49 Å²	49	39%	0.388	26%	0.256	S	S	.	.	H	α-helix	trans	-59.6	-50.7	174.7	-175.5	-94.2	0	0	0	111.2	L36 P37 Y228 A229 E230 I234 I235 S236	L36-Y232 HydrophobicContact CD1-CD2 4.28Å; L36-Y232 HydrophobicContact CD2-CD2 3.93Å; L36-Y232 HydrophobicContact CD2-CG 4.02Å; P37-Y232 HydrophobicContact CG-CE2 4.33Å; Y228-Y232 WeakPolarHBondContact O-CB 3.32Å; Y228-Y232 PolarHBondContact O-N 3.15Å; A229-Y232 PolarHBondContact O-N 3.35Å; E230-Y232 VanDerWaalsContact C-N 3.35Å; Y232-I234 PolarHBondContact O-N 3.43Å; Y232-I235 PolarHBondContact O-N 2.79Å; Y232-S236 WeakPolarHBondContact O-CB 3.35Å; Y232-S236 PolarHBondContact O-N 3.26Å; Y232-S236 PolarHBondContact O-OG 2.91Å
233	H	98.2	Very high	97.9	Very high	126 Å²	126	50 Å²	50	58%	0.583	26%	0.264	S	S	*	.	H	α-helix	trans	-59.4	-48.2	-177.4	176.8	62.4	0	0	0	112.5	A229 E230 S236 S237	A229-H233 WeakPolarHBondContact O-CB 3.42Å; A229-H233 PolarHBondContact O-N 3.49Å; E230-H233 PolarHBondContact O-N 3.38Å; H233-S236 PolarHBondContact O-OG 3.35Å; H233-S237 WeakPolarHBondContact O-CB 3.29Å; H233-S237 PolarHBondContact O-N 3.26Å; H233-S237 PolarHBondContact O-OG 2.79Å
234	I	98.4	Very high	97.8	Very high	37 Å²	37	48.1 Å²	48.1	19%	0.19	25%	0.254	C	S	.	.	H	α-helix	trans	-69.9	-37	-177.8	-163.7	177.3	0	0	0	111.6	V161 R164 E230 L231 Y232 N238	V161-I234 HydrophobicContact CG2-CD1 4.36Å; V161-I234 HydrophobicContact CG2-CG1 4.24Å; R164-I234 HydrophobicContact CB-CD1 3.8Å; R164-I234 HydrophobicContact CG-CD1 3.95Å; E230-I234 WeakPolarHBondContact O-CG2 3.47Å; E230-I234 PolarHBondContact O-N 3.14Å; L231-I234 WeakPolarHBondContact O-CG2 3.48Å; Y232-I234 PolarHBondContact O-N 3.43Å; I234-N238 WeakPolarHBondContact O-CB 3.35Å; I234-N238 PolarHBondContact O-N 2.82Å; I234-N238 PolarHBondContact O-ND2 3.27Å
235	I	97.9	Very high	97.6	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-72	-49.4	178.7	-65.6	167.5	0	0	0	110	L32 V136 W139 V161 L231 Y232 S237 N238 L239 I242	L32-I235 HydrophobicContact CD1-CG2 3.84Å; L32-I235 HydrophobicContact CD2-CB 4.32Å; L32-I235 HydrophobicContact CD2-CD1 3.89Å; L32-I235 HydrophobicContact CD2-CG2 3.87Å; V136-I235 HydrophobicContact CG1-CD1 3.82Å; W139-I235 HydrophobicContact CH2-CG2 4.31Å; W139-I235 HydrophobicContact CZ3-CG2 4.15Å; V161-I235 HydrophobicContact CG1-CG1 4.21Å; L231-I235 VanDerWaalsContact O-CB 3.28Å; L231-I235 WeakPolarHBondContact O-CB 3.36Å; L231-I235 WeakPolarHBondContact O-CD1 3.38Å; L231-I235 WeakPolarHBondContact O-CG1 3.3Å; L231-I235 PolarHBondContact O-N 3.45Å; Y232-I235 PolarHBondContact O-N 2.79Å; I235-S237 VanDerWaalsContact C-N 3.34Å; I235-S237 PolarHBondContact O-N 2.96Å; I235-N238 CarbonylContact O-C 3.49Å; I235-N238 PolarHBondContact O-N 3.24Å; I235-L239 HydrophobicContact CG2-CD1 4.27Å; I235-L239 WeakPolarHBondContact O-CA 3.29Å; I235-L239 WeakPolarHBondContact O-CB 3.48Å; I235-L239 PolarHBondContact O-N 3.19Å; I235-I242 HydrophobicContact CB-CD1 4.43Å; I235-I242 HydrophobicContact CG2-CD1 4.13Å
236	S	96.7	Very high	97.4	Very high	54 Å²	54	46.6 Å²	46.6	38%	0.378	25%	0.25	S	S	.	.	H	α-helix	trans	-63.3	-40.2	-177.4	71.1	0	0	0	0	112	Y232 H233 N238	Y232-S236 WeakPolarHBondContact O-CB 3.35Å; Y232-S236 PolarHBondContact O-N 3.26Å; Y232-S236 PolarHBondContact O-OG 2.91Å; H233-S236 PolarHBondContact O-OG 3.35Å; S236-N238 PolarHBondContact O-N 3.42Å
237	S	97.8	Very high	97	Very high	73 Å²	73	47.1 Å²	47.1	51%	0.51	26%	0.259	S	S	.	.	H	α-helix	trans	-68.3	-22.6	-180	-55.5	0	0	0	0	113	H233 I235	H233-S237 WeakPolarHBondContact O-CB 3.29Å; H233-S237 PolarHBondContact O-N 3.26Å; H233-S237 PolarHBondContact O-OG 2.79Å; I235-S237 VanDerWaalsContact C-N 3.34Å; I235-S237 PolarHBondContact O-N 2.96Å
238	N	97.9	Very high	96.4	Very high	52 Å²	52	53.6 Å²	53.6	28%	0.278	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.3	10.4	-176.7	-62.8	-76.2	0	0	0	113	I157 V161 I234 I235 S236 E240 K241 I242	I157-N238 HydrophobicContact CG2-CB 3.89Å; V161-N238 HydrophobicContact CG2-CB 4.41Å; I234-N238 WeakPolarHBondContact O-CB 3.35Å; I234-N238 PolarHBondContact O-N 2.82Å; I234-N238 PolarHBondContact O-ND2 3.27Å; I235-N238 CarbonylContact O-C 3.49Å; I235-N238 PolarHBondContact O-N 3.24Å; S236-N238 PolarHBondContact O-N 3.42Å; N238-E240 VanDerWaalsContact C-N 3.33Å; N238-E240 PolarHBondContact O-N 3.41Å; N238-K241 PolarHBondContact O-N 2.86Å; N238-I242 HydrophobicContact CB-CD1 4Å; N238-I242 HydrophobicContact CB-CG1 4.25Å; N238-I242 WeakPolarHBondContact O-CG1 3.38Å; N238-I242 PolarHBondContact O-N 3.15Å
239	L	96.7	Very high	95.5	Very high	54 Å²	54	62.5 Å²	62.5	28%	0.283	33%	0.331	S	S	.	.	H	α-helix	trans	-57.4	-42.1	-166.2	-172.8	63.2	0	0	0	113.3	W139 I235 K241 I242 V243	W139-L239 HydrophobicContact CH2-CD1 4.09Å; I235-L239 HydrophobicContact CG2-CD1 4.27Å; I235-L239 WeakPolarHBondContact O-CA 3.29Å; I235-L239 WeakPolarHBondContact O-CB 3.48Å; I235-L239 PolarHBondContact O-N 3.19Å; L239-K241 VanDerWaalsContact C-N 3.31Å; L239-K241 PolarHBondContact O-N 3.35Å; L239-I242 PolarHBondContact O-N 3.32Å; L239-V243 HydrophobicContact CD1-CG2 4Å; L239-V243 HydrophobicContact CG-CG2 4.41Å; L239-V243 WeakPolarHBondContact O-CG2 3.39Å; L239-V243 PolarHBondContact O-N 3.06Å
240	E	96.3	Very high	93.7	Very high	110 Å²	110	67.9 Å²	67.9	51%	0.514	35%	0.347	S	S	.	.	H	α-helix	trans	-61.1	-40.7	179	-175.5	60.4	-159.6	0	0	111.7	N238 N244	N238-E240 VanDerWaalsContact C-N 3.33Å; N238-E240 PolarHBondContact O-N 3.41Å; E240-N244 CarbonylContact O-C 3.5Å; E240-N244 WeakPolarHBondContact O-CA 3.42Å; E240-N244 PolarHBondContact O-N 2.93Å
241	K	97.1	Very high	91.2	Very high	81 Å²	81	69.9 Å²	69.9	35%	0.352	37%	0.366	S	S	.	.	H	α-helix	trans	-78.7	-25.9	178	-66.1	-60.4	-175.1	-173.9	0	112.9	I157 N238 L239 P245	I157-K241 HydrophobicContact CB-CB 4.37Å; I157-K241 HydrophobicContact CD1-CB 3.83Å; I157-K241 HydrophobicContact CD1-CG 3.79Å; I157-K241 HydrophobicContact CG2-CB 4.1Å; N238-K241 PolarHBondContact O-N 2.86Å; L239-K241 VanDerWaalsContact C-N 3.31Å; L239-K241 PolarHBondContact O-N 3.35Å; K241-P245 VanDerWaalsContact O-CA 3.28Å; K241-P245 WeakPolarHBondContact O-CA 3.33Å; K241-P245 WeakPolarHBondContact O-CB 3.41Å
242	I	97.2	Very high	88.2	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-68.5	-45.2	172.3	-67.9	165.9	0	0	0	110.4	W139 I140 L143 Q158 V161 I235 N238 L239	W139-I242 HydrophobicContact CH2-CG2 3.95Å; W139-I242 HydrophobicContact CZ2-CG2 4.49Å; W139-I242 HydrophobicContact CZ3-CG2 4.23Å; I140-I242 HydrophobicContact CG1-CG2 4.18Å; L143-I242 HydrophobicContact CD1-CG2 3.82Å; Q158-I242 PolarHBondContact NE2-O 3.34Å; V161-I242 HydrophobicContact CG1-CD1 4.13Å; V161-I242 HydrophobicContact CG2-CD1 4.06Å; V161-I242 HydrophobicContact CG2-CG1 4.31Å; I235-I242 HydrophobicContact CB-CD1 4.43Å; I235-I242 HydrophobicContact CG2-CD1 4.13Å; N238-I242 HydrophobicContact CB-CD1 4Å; N238-I242 HydrophobicContact CB-CG1 4.25Å; N238-I242 WeakPolarHBondContact O-CG1 3.38Å; N238-I242 PolarHBondContact O-N 3.15Å; L239-I242 PolarHBondContact O-N 3.32Å
243	V	96.6	Very high	85.5	Confident	75 Å²	75	78.2 Å²	78.2	46%	0.455	42%	0.42	S	S	.	.	H	α-helix	trans	-85.4	-36.8	-175	177.3	0	0	0	0	112.4	W139 L143 L239	W139-V243 HydrophobicContact CZ2-CG2 4.25Å; L143-V243 HydrophobicContact CD1-CG2 4.34Å; L239-V243 HydrophobicContact CD1-CG2 4Å; L239-V243 HydrophobicContact CG-CG2 4.41Å; L239-V243 WeakPolarHBondContact O-CG2 3.39Å; L239-V243 PolarHBondContact O-N 3.06Å
244	N	96.1	Very high	82.5	Confident	26 Å²	26	85.6 Å²	85.6	14%	0.139	45%	0.445	C	S	.	.			trans	-128.5	68	-178.3	-171	12.3	0	0	0	111.5	E240 K246 G247 E248	E240-N244 CarbonylContact O-C 3.5Å; E240-N244 WeakPolarHBondContact O-CA 3.42Å; E240-N244 PolarHBondContact O-N 2.93Å; N244-K246 VanDerWaalsContact C-N 3.27Å; N244-K246 PolarHBondContact O-N 3.47Å; N244-G247 PolarHBondContact O-N 3.34Å; N244-G247 WeakPolarHBondContact OD1-CA 3.42Å; N244-G247 PolarHBondContact OD1-N 3.38Å; N244-G247 VanDerWaalsContact OD1-N 3.13Å; N244-E248 PolarHBondContact ND2-N 3.32Å; N244-E248 PolarHBondContact ND2-O 2.87Å; N244-E248 PolarHBondContact OD1-N 3.4Å
245	P	95.5	Very high	81.7	Confident	8 Å²	8	88 Å²	88	5%	0.052	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-30.5	-173.5	24.8	-35	0	0	0	113.4	P145 V155 K241	P145-P245 HydrophobicContact CG-CG 3.92Å; V155-P245 HydrophobicContact CG2-CB 4.33Å; K241-P245 VanDerWaalsContact O-CA 3.28Å; K241-P245 WeakPolarHBondContact O-CA 3.33Å; K241-P245 WeakPolarHBondContact O-CB 3.41Å
246	K	94.4	Very high	80.8	Confident	27 Å²	27	92.6 Å²	92.6	12%	0.117	48%	0.482	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-8.7	-179.2	-63.9	-66.2	-176.7	-178.7	0	113.6	P145 G150 N151 D152 N244 E248	P145-K246 HydrophobicContact CB-CG 4.45Å; P145-K246 HydrophobicContact CG-CG 4.1Å; G150-K246 PolarHBondContact O-NZ 3.49Å; N151-K246 VanDerWaalsContact C-NZ 3.34Å; N151-K246 HydrophobicContact CB-CD 4.13Å; N151-K246 PolarHBondContact ND2-O 2.95Å; N151-K246 VanDerWaalsContact O-CD 3.32Å; N151-K246 WeakPolarHBondContact O-CD 3.09Å; N151-K246 PolarHBondContact O-NZ 3.04Å; D152-K246 IonicContact OD1-NZ 2.74Å; D152-K246 PolarHBondContact OD1-NZ 3.06Å; N244-K246 VanDerWaalsContact C-N 3.27Å; N244-K246 PolarHBondContact O-N 3.47Å; K246-E248 HydrophobicContact CB-CG 4.42Å
247	G	90.1	Very high	80	Confident	48 Å²	48	94.7 Å²	94.7	50%	0.495	49%	0.487	S	S	.	.			trans	71.9	32.9	178.7	0	0	0	0	0	113.3	N244	N244-G247 PolarHBondContact O-N 3.34Å; N244-G247 WeakPolarHBondContact OD1-CA 3.42Å; N244-G247 PolarHBondContact OD1-N 3.38Å; N244-G247 VanDerWaalsContact OD1-N 3.13Å
248	E	86.1	Confident	78.9	Confident	141 Å²	141	96 Å²	96	66%	0.659	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-61.3	136.4	175.1	-64.1	-179.8	-176.8	0	0	109.2	N244 K246 K250	N244-E248 PolarHBondContact ND2-N 3.32Å; N244-E248 PolarHBondContact ND2-O 2.87Å; N244-E248 PolarHBondContact OD1-N 3.4Å; K246-E248 HydrophobicContact CB-CG 4.42Å; E248-K250 PolarHBondContact O-N 2.77Å
249	E	79.9	Confident	77.7	Confident	186 Å²	186	98.8 Å²	98.8	87%	0.869	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-60	123.6	173.9	-68.4	-174.1	170	0	0	108.2	P251	E249-P251 VanDerWaalsContact O-N 3.13Å
250	K	60.2	Low	76.5	Confident	157 Å²	157	101.7 Å²	101.7	68%	0.683	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-53.4	125.5	169.4	-75.2	-179.8	-179.4	171.8	0	106.3	E248 S252	E248-K250 PolarHBondContact O-N 2.77Å; K250-S252 PolarHBondContact O-N 3.1Å
251	P	45.9	Very low	75	Confident	112 Å²	112	101.1 Å²	101.1	73%	0.727	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-52.8	123	174.5	19.2	-28.8	0	0	0	107.1	E249 M253	E249-P251 VanDerWaalsContact O-N 3.13Å; P251-M253 VanDerWaalsContact C-N 3.32Å; P251-M253 PolarHBondContact O-N 3.19Å
252	S	36	Very low	73.3	Confident	90 Å²	90	102.7 Å²	102.7	63%	0.629	53%	0.526	S	S	*	.			trans	-54.8	97.5	178.6	176.9	0	0	0	0	108.1	K250 Y254	K250-S252 PolarHBondContact O-N 3.1Å; S252-Y254 VanDerWaalsContact C-N 3.26Å; S252-Y254 PolarHBondContact O-N 3.03Å; S252-Y254 VanDerWaalsContact OG-CD2 3.3Å; S252-Y254 WeakPolarHBondContact OG-CD2 3.25Å; S252-Y254 VanDerWaalsContact OG-CE2 3.27Å; S252-Y254 WeakPolarHBondContact OG-CE2 3.17Å
253	M	39.7	Very low	71.4	Confident	184 Å²	184	111.3 Å²	111.3	91%	0.906	57%	0.569	S	S	*	*			trans	-72.3	89	171.5	-71.2	-85.2	-98.3	0	0	106.6	P251	P251-M253 VanDerWaalsContact C-N 3.32Å; P251-M253 PolarHBondContact O-N 3.19Å
254	Y	35.8	Very low	69.1	Low	281 Å²	281	114.5 Å²	114.5	100%	1.102	58%	0.58	S	S	*	*			trans	-76.9	0	153.9	-81.5	-79.1	0	0	0	109.3	S252	S252-Y254 VanDerWaalsContact C-N 3.26Å; S252-Y254 PolarHBondContact O-N 3.03Å; S252-Y254 VanDerWaalsContact OG-CD2 3.3Å; S252-Y254 WeakPolarHBondContact OG-CD2 3.25Å; S252-Y254 VanDerWaalsContact OG-CE2 3.27Å; S252-Y254 WeakPolarHBondContact OG-CE2 3.17Å

Retrieved 254 of 254 residues in 170.4 ms (Link to these results)

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