A0A096NCI7_PAPAN Loading...

Myb/SANT-like DNA-binding domain-containing protein 4

AlphaFold DB (Q8NCY6), UniProt , Accession A0A096NCI7, Species PAPAN (Papio anubis, Olive baboon), Gene MSANTD4, Length 345 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.4	Very low	69	Low	232 Å²	232	170.4 Å²	170.4	100%	1.143	77%	0.774	S	S	*	*				0	114.9	0	-64.9	-81.7	-110.7	0	0	107.7	Q3	M1-Q3 PolarHBondContact O-N 2.91Å
2	K	50.5	Low	70.8	Confident	200 Å²	200	159.3 Å²	159.3	87%	0.87	72%	0.723	S	S	*	*			trans	-75.7	110.2	170.7	-75.7	-177.1	179.1	177.9	0	106.4	L4	K2-L4 WeakPolarHBondContact O-CD1 3.29Å; K2-L4 PolarHBondContact O-N 2.79Å
3	Q	50	Low	72.4	Confident	127 Å²	127	151.8 Å²	151.8	59%	0.593	70%	0.701	S	S	*	*			trans	-53.3	111.9	174.5	-73.2	-71.4	11.6	0	0	109.3	M1 K5 E160	M1-Q3 PolarHBondContact O-N 2.91Å; Q3-K5 PolarHBondContact O-N 3.38Å; Q3-E160 PolarHBondContact NE2-OE1 2.75Å; Q3-E160 PolarHBondContact NE2-OE2 3.35Å; Q3-E160 VanDerWaalsContact NE2-OE2 3.14Å
4	L	60.7	Low	73.8	Confident	159 Å²	159	145.7 Å²	145.7	83%	0.832	68%	0.68	S	S	*	*			trans	-70.4	96.3	172.9	-97.7	69.5	0	0	0	107.1	K2 R6	K2-L4 WeakPolarHBondContact O-CD1 3.29Å; K2-L4 PolarHBondContact O-N 2.79Å; L4-R6 PolarHBondContact O-N 3.38Å
5	K	67.4	Low	75.1	Confident	199 Å²	199	143.1 Å²	143.1	87%	0.865	67%	0.667	S	S	*	*			trans	-54.4	113.5	173.4	-70.6	-175.9	177.5	-177.8	0	108.6	Q3 K7	Q3-K5 PolarHBondContact O-N 3.38Å; K5-K7 PolarHBondContact O-N 3.1Å
6	R	71.9	Confident	76.3	Confident	245 Å²	245	134.8 Å²	134.8	93%	0.925	63%	0.629	S	S	*	*			trans	-55.1	114.3	171.2	-83.5	179.7	150	176.3	-4.2	108.6	L4 R8	L4-R6 PolarHBondContact O-N 3.38Å; R6-R8 PolarHBondContact O-N 3.46Å
7	K	78.6	Confident	77.3	Confident	203 Å²	203	127.5 Å²	127.5	88%	0.883	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-64.8	125	174.9	-167.2	173.3	-179	-179.9	0	107.5	K5 K9	K5-K7 PolarHBondContact O-N 3.1Å; K7-K9 PolarHBondContact O-N 2.91Å
8	R	81.1	Confident	78.3	Confident	213 Å²	213	125.1 Å²	125.1	80%	0.804	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-57.4	136.1	172.9	-69.5	176.8	64.4	-168.7	-0.7	108.1	R6	R6-R8 PolarHBondContact O-N 3.46Å
9	K	82.1	Confident	79.2	Confident	101 Å²	101	120 Å²	120	44%	0.439	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-61	147.9	168.5	-68.4	-165.7	174.6	-172.9	0	109.7	K7 E62 Q63 E68	K7-K9 PolarHBondContact O-N 2.91Å; K9-E62 WeakPolarHBondContact CB-OE2 3.4Å; K9-Q63 PolarHBondContact NZ-O 2.71Å; K9-E68 WeakPolarHBondContact CD-OE1 3.42Å; K9-E68 VanDerWaalsContact CE-OE1 3.29Å; K9-E68 WeakPolarHBondContact CE-OE1 3.42Å; K9-E68 VanDerWaalsContact NZ-CD 3.29Å; K9-E68 IonicContact NZ-OE1 3.9Å; K9-E68 PolarHBondContact NZ-OE1 2.98Å; K9-E68 IonicContact NZ-OE2 2.7Å; K9-E68 PolarHBondContact NZ-OE2 3.5Å; K9-E68 VanDerWaalsContact NZ-OE2 3.09Å
10	S	85.6	Confident	80	Confident	71 Å²	71	114.1 Å²	114.1	50%	0.497	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-53.9	152.9	173.3	-174.7	0	0	0	0	110.3	E62 R64	S10-E62 WeakPolarHBondContact CA-OE1 3.42Å; S10-E62 WeakPolarHBondContact CB-OE1 3.47Å; S10-E62 WeakPolarHBondContact CB-OE2 3.45Å; S10-E62 PolarHBondContact N-OE1 3.39Å; S10-E62 PolarHBondContact N-OE2 3.38Å; S10-R64 VanDerWaalsContact O-CZ 3.26Å; S10-R64 PolarHBondContact O-NH1 2.9Å; S10-R64 PolarHBondContact O-NH2 3.18Å
11	N	88.9	Confident	80.8	Confident	124 Å²	124	108.8 Å²	108.8	66%	0.663	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-69.8	159.1	174	-67.7	-55.7	0	0	0	110.4	S13 R64	N11-S13 PolarHBondContact O-N 2.9Å; N11-R64 PolarHBondContact O-NH2 3.43Å
12	F	90.5	Very high	83.3	Confident	37 Å²	37	105 Å²	105	16%	0.162	49%	0.488	C	S	.	.	P	Polyproline II helix	trans	-67.9	124.2	172.8	-76.9	-99.6	0	0	0	110.1	E16 V55 R64 V69 R72	F12-E16 WeakPolarHBondContact CA-OE2 3.47Å; F12-E16 HydrophobicContact CD1-CB 4.21Å; F12-V55 HydrophobicContact CE1-CG1 4.32Å; F12-R64 HydrophobicContact CE1-CG 4.23Å; F12-R64 HydrophobicContact CZ-CG 4.28Å; F12-V69 HydrophobicContact CE1-CG2 4.26Å; F12-V69 HydrophobicContact CZ-CG2 4.42Å; F12-R72 HydrophobicContact CB-CG 4.44Å; F12-R72 HydrophobicContact CD1-CB 4.49Å; F12-R72 HydrophobicContact CD1-CG 3.87Å; F12-R72 HydrophobicContact CD2-CB 4.08Å; F12-R72 HydrophobicContact CD2-CG 3.72Å; F12-R72 HydrophobicContact CE1-CB 4.1Å; F12-R72 HydrophobicContact CE1-CG 3.97Å; F12-R72 HydrophobicContact CE2-CB 3.66Å; F12-R72 HydrophobicContact CE2-CG 3.83Å; F12-R72 HydrophobicContact CG-CB 4.47Å; F12-R72 HydrophobicContact CG-CG 3.73Å; F12-R72 HydrophobicContact CZ-CB 3.66Å; F12-R72 HydrophobicContact CZ-CG 3.95Å
13	S	91.4	Very high	85.5	Confident	63 Å²	63	96.4 Å²	96.4	44%	0.441	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-60.5	159.5	169.4	175.9	0	0	0	0	111	N11 Q15 E16 T17	N11-S13 PolarHBondContact O-N 2.9Å; S13-Q15 VanDerWaalsContact C-N 3.3Å; S13-Q15 PolarHBondContact O-N 2.71Å; S13-Q15 PolarHBondContact OG-N 3.19Å; S13-E16 PolarHBondContact N-OE2 2.92Å; S13-E16 PolarHBondContact O-N 3.02Å; S13-T17 WeakPolarHBondContact O-CB 3.21Å; S13-T17 PolarHBondContact O-N 2.77Å; S13-T17 PolarHBondContact O-OG1 2.97Å
14	V	91.8	Very high	87.7	Confident	66 Å²	66	90.3 Å²	90.3	40%	0.4	42%	0.422	S	S	.	.	H	α-helix	trans	-59.8	-43.7	173.9	177.6	0	0	0	0	110.1	T17 Q18 F131 L138	V14-T17 PolarHBondContact O-N 2.86Å; V14-Q18 HydrophobicContact CG1-CG 4.49Å; V14-Q18 WeakPolarHBondContact O-CG 3.43Å; V14-Q18 PolarHBondContact O-N 3.47Å; V14-F131 HydrophobicContact CG1-CE1 3.89Å; V14-F131 HydrophobicContact CG1-CZ 4.02Å; V14-L138 HydrophobicContact CG2-CD2 4.45Å
15	Q	94.1	Very high	89.3	Confident	106 Å²	106	84.9 Å²	84.9	50%	0.495	40%	0.396	S	S	.	.	H	α-helix	trans	-65.6	-41.6	178.7	-175.8	176.2	-2.9	0	0	112.2	S13 T17 Q18 T19 V58	S13-Q15 VanDerWaalsContact C-N 3.3Å; S13-Q15 PolarHBondContact O-N 2.71Å; S13-Q15 PolarHBondContact OG-N 3.19Å; Q15-T17 VanDerWaalsContact C-N 3.34Å; Q15-T17 PolarHBondContact O-N 3.23Å; Q15-Q18 PolarHBondContact O-N 2.98Å; Q15-T19 WeakPolarHBondContact O-CB 3.38Å; Q15-T19 PolarHBondContact O-N 3.5Å; Q15-T19 PolarHBondContact O-OG1 3.01Å; Q15-V58 HydrophobicContact CG-CB 4.32Å; Q15-V58 HydrophobicContact CG-CG2 4.44Å
16	E	93.9	Very high	90.6	Very high	11 Å²	11	82.6 Å²	82.6	5%	0.051	39%	0.386	C	S	.	.	H	α-helix	trans	-60.5	-44.8	173.8	-71.2	178.3	143.8	0	0	111	F12 S13 T19 L20 V55 V58 G59	F12-E16 WeakPolarHBondContact CA-OE2 3.47Å; F12-E16 HydrophobicContact CD1-CB 4.21Å; S13-E16 PolarHBondContact N-OE2 2.92Å; S13-E16 PolarHBondContact O-N 3.02Å; E16-T19 PolarHBondContact O-N 2.81Å; E16-L20 VanDerWaalsContact O-CB 3.29Å; E16-L20 WeakPolarHBondContact O-CB 3.5Å; E16-L20 PolarHBondContact O-N 3.01Å; E16-V55 HydrophobicContact CB-CG1 3.88Å; E16-V55 HydrophobicContact CG-CG1 4.02Å; E16-V58 HydrophobicContact CG-CG2 4.3Å; E16-G59 WeakPolarHBondContact OE1-CA 3.11Å
17	T	93.4	Very high	91.6	Very high	10 Å²	10	73 Å²	73	6%	0.061	35%	0.349	C	S	.	.	H	α-helix	trans	-66	-40.4	178.5	-56.2	0	0	0	0	111.4	S13 V14 Q15 L20 L21 R72	S13-T17 WeakPolarHBondContact O-CB 3.21Å; S13-T17 PolarHBondContact O-N 2.77Å; S13-T17 PolarHBondContact O-OG1 2.97Å; V14-T17 PolarHBondContact O-N 2.86Å; Q15-T17 VanDerWaalsContact C-N 3.34Å; Q15-T17 PolarHBondContact O-N 3.23Å; T17-L20 WeakPolarHBondContact O-CB 3.41Å; T17-L20 PolarHBondContact O-N 3.48Å; T17-L21 HydrophobicContact CG2-CD1 4.34Å; T17-L21 VanDerWaalsContact O-CG 3.28Å; T17-L21 WeakPolarHBondContact O-CG 3.49Å; T17-L21 PolarHBondContact O-N 2.91Å; T17-L21 VanDerWaalsContact O-N 3.13Å; T17-R72 PolarHBondContact OG1-NH2 2.92Å; T17-R72 VanDerWaalsContact OG1-NH2 3.16Å
18	Q	94.5	Very high	92.2	Very high	84 Å²	84	67.9 Å²	67.9	39%	0.393	33%	0.327	S	S	.	.	H	α-helix	trans	-62.1	-48.1	174.7	-77.1	175.1	-17.4	0	0	111.8	V14 Q15 L20 L21 K22 F131	V14-Q18 HydrophobicContact CG1-CG 4.49Å; V14-Q18 WeakPolarHBondContact O-CG 3.43Å; V14-Q18 PolarHBondContact O-N 3.47Å; Q15-Q18 PolarHBondContact O-N 2.98Å; Q18-L20 VanDerWaalsContact C-N 3.33Å; Q18-L20 PolarHBondContact O-N 3.46Å; Q18-L21 PolarHBondContact O-N 2.73Å; Q18-K22 WeakPolarHBondContact O-CB 3.44Å; Q18-K22 PolarHBondContact O-N 3.28Å; Q18-F131 HydrophobicContact CG-CD1 3.49Å; Q18-F131 VanDerWaalsContact CG-CD1 3.49Å; Q18-F131 HydrophobicContact CG-CE1 3.28Å; Q18-F131 HydrophobicContact CG-CZ 4.21Å
19	T	95.5	Very high	92.8	Very high	29 Å²	29	64.8 Å²	64.8	18%	0.178	32%	0.322	C	S	.	.	H	α-helix	trans	-60.9	-43.4	178.5	-63.5	0	0	0	0	111.1	Q15 E16 L21 K22 E23 C54 V55 V58	Q15-T19 WeakPolarHBondContact O-CB 3.38Å; Q15-T19 PolarHBondContact O-N 3.5Å; Q15-T19 PolarHBondContact O-OG1 3.01Å; E16-T19 PolarHBondContact O-N 2.81Å; T19-L21 PolarHBondContact O-N 3.44Å; T19-K22 PolarHBondContact O-N 3.42Å; T19-E23 WeakPolarHBondContact O-CB 3.49Å; T19-E23 PolarHBondContact O-N 3.4Å; T19-C54 HydrophobicContact CG2-CB 4.21Å; T19-V55 HydrophobicContact CG2-CG2 4.47Å; T19-V58 HydrophobicContact CG2-CG1 4.45Å; T19-V58 HydrophobicContact CG2-CG2 4.19Å
20	L	96.2	Very high	93.3	Very high	1 Å²	1	62.3 Å²	62.3	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-52.3	-52.7	173.1	169.5	54.7	0	0	0	111.7	E16 T17 Q18 E23 I24 W48 I51 V55 V69 R72	E16-L20 VanDerWaalsContact O-CB 3.29Å; E16-L20 WeakPolarHBondContact O-CB 3.5Å; E16-L20 PolarHBondContact O-N 3.01Å; T17-L20 WeakPolarHBondContact O-CB 3.41Å; T17-L20 PolarHBondContact O-N 3.48Å; Q18-L20 VanDerWaalsContact C-N 3.33Å; Q18-L20 PolarHBondContact O-N 3.46Å; L20-E23 PolarHBondContact O-N 3.48Å; L20-I24 HydrophobicContact CD1-CD1 3.45Å; L20-I24 VanDerWaalsContact CD1-CD1 3.45Å; L20-I24 HydrophobicContact CD1-CG1 3.95Å; L20-I24 HydrophobicContact CG-CD1 3.97Å; L20-I24 VanDerWaalsContact O-CG1 3.26Å; L20-I24 WeakPolarHBondContact O-CG1 3.42Å; L20-I24 PolarHBondContact O-N 2.88Å; L20-W48 HydrophobicContact CD1-CZ3 4.31Å; L20-I51 HydrophobicContact CD1-CG2 3.51Å; L20-V55 HydrophobicContact CB-CG2 3.97Å; L20-V69 HydrophobicContact CD1-CG1 3.16Å; L20-V69 HydrophobicContact CD2-CG1 4.16Å; L20-V69 HydrophobicContact CG-CG1 4.19Å; L20-R72 HydrophobicContact CD2-CB 4.09Å; L20-R72 HydrophobicContact CD2-CG 3.66Å
21	L	95.6	Very high	93.7	Very high	3 Å²	3	59.5 Å²	59.5	2%	0.016	29%	0.294	C	S	.	.	H	α-helix	trans	-67.1	-41.3	-176.9	-64.8	172.3	0	0	0	112.4	T17 Q18 T19 E23 T25 Y73 W76 V128	T17-L21 HydrophobicContact CG2-CD1 4.34Å; T17-L21 VanDerWaalsContact O-CG 3.28Å; T17-L21 WeakPolarHBondContact O-CG 3.49Å; T17-L21 PolarHBondContact O-N 2.91Å; T17-L21 VanDerWaalsContact O-N 3.13Å; Q18-L21 PolarHBondContact O-N 2.73Å; T19-L21 PolarHBondContact O-N 3.44Å; L21-E23 VanDerWaalsContact C-N 3.32Å; L21-E23 PolarHBondContact O-N 3.39Å; L21-T25 PolarHBondContact O-N 2.84Å; L21-T25 PolarHBondContact O-OG1 2.86Å; L21-Y73 HydrophobicContact CD2-CD2 4.14Å; L21-Y73 HydrophobicContact CD2-CE2 4.43Å; L21-W76 HydrophobicContact CD1-CD2 4.29Å; L21-W76 HydrophobicContact CD1-CH2 4.28Å; L21-W76 HydrophobicContact CD1-CZ2 3.6Å; L21-W76 HydrophobicContact CD2-CD2 3.66Å; L21-W76 HydrophobicContact CD2-CE3 3.57Å; L21-W76 HydrophobicContact CD2-CG 4.41Å; L21-W76 HydrophobicContact CD2-CH2 3.72Å; L21-W76 HydrophobicContact CD2-CZ2 3.8Å; L21-W76 HydrophobicContact CD2-CZ3 3.6Å; L21-W76 HydrophobicContact CG-CZ2 4.36Å; L21-V128 HydrophobicContact CB-CG1 4.43Å
22	K	96.2	Very high	93.8	Very high	153 Å²	153	58 Å²	58	67%	0.665	28%	0.282	S	S	*	.	H	α-helix	trans	-58.8	-45.6	176.1	-176.7	-179.2	177.6	-176.7	0	111.2	Q18 T19 T25 K26	Q18-K22 WeakPolarHBondContact O-CB 3.44Å; Q18-K22 PolarHBondContact O-N 3.28Å; T19-K22 PolarHBondContact O-N 3.42Å; K22-T25 WeakPolarHBondContact O-CB 2.8Å; K22-T25 PolarHBondContact O-N 3.47Å; K22-K26 PolarHBondContact O-N 3.4Å; K22-K26 VanDerWaalsContact O-N 3.14Å
23	E	96.9	Very high	93.8	Very high	19 Å²	19	57.4 Å²	57.4	9%	0.089	28%	0.282	C	S	.	.	H	α-helix	trans	-77.7	-32.2	-175.2	-161	62.2	-151.5	0	0	112.9	T19 L20 L21 T25 K26 R27 I51	T19-E23 WeakPolarHBondContact O-CB 3.49Å; T19-E23 PolarHBondContact O-N 3.4Å; L20-E23 PolarHBondContact O-N 3.48Å; L21-E23 VanDerWaalsContact C-N 3.32Å; L21-E23 PolarHBondContact O-N 3.39Å; E23-T25 VanDerWaalsContact C-N 3.29Å; E23-T25 PolarHBondContact O-N 3.3Å; E23-K26 PolarHBondContact O-N 3.16Å; E23-K26 WeakPolarHBondContact OE1-CD 3.42Å; E23-K26 IonicContact OE1-NZ 2.84Å; E23-K26 PolarHBondContact OE1-NZ 2.94Å; E23-K26 IonicContact OE2-NZ 3.8Å; E23-R27 PolarHBondContact O-N 3.27Å; E23-R27 IonicContact OE1-CZ 3.36Å; E23-R27 IonicContact OE1-NE 3.2Å; E23-R27 PolarHBondContact OE1-NE 3.26Å; E23-R27 IonicContact OE1-NH1 2.84Å; E23-R27 PolarHBondContact OE1-NH1 3.03Å; E23-R27 VanDerWaalsContact OE1-NH1 3.08Å; E23-R27 IonicContact OE1-NH2 2.95Å; E23-R27 PolarHBondContact OE1-NH2 3.43Å; E23-I51 HydrophobicContact CB-CG1 4.09Å; E23-I51 HydrophobicContact CB-CG2 4.37Å; E23-I51 HydrophobicContact CG-CG1 3.77Å
24	I	95.9	Very high	93.7	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-59.7	-43	167.8	-71.1	170.3	0	0	0	110.6	L20 K26 R27 K28 I31 F32 W48 I51 Y73 W125	L20-I24 HydrophobicContact CD1-CD1 3.45Å; L20-I24 VanDerWaalsContact CD1-CD1 3.45Å; L20-I24 HydrophobicContact CD1-CG1 3.95Å; L20-I24 HydrophobicContact CG-CD1 3.97Å; L20-I24 VanDerWaalsContact O-CG1 3.26Å; L20-I24 WeakPolarHBondContact O-CG1 3.42Å; L20-I24 PolarHBondContact O-N 2.88Å; I24-K26 VanDerWaalsContact C-N 3.3Å; I24-K26 PolarHBondContact O-N 3.48Å; I24-R27 CarbonylContact O-C 3.42Å; I24-R27 PolarHBondContact O-N 2.91Å; I24-K28 WeakPolarHBondContact O-CA 3.32Å; I24-K28 PolarHBondContact O-N 3.5Å; I24-I31 HydrophobicContact CB-CD1 4.47Å; I24-I31 HydrophobicContact CG1-CD1 4.28Å; I24-I31 HydrophobicContact CG2-CD1 4.35Å; I24-F32 HydrophobicContact CG2-CE2 3.87Å; I24-F32 HydrophobicContact CG2-CZ 4.17Å; I24-W48 HydrophobicContact CD1-CH2 3.66Å; I24-W48 HydrophobicContact CD1-CZ3 3.76Å; I24-W48 HydrophobicContact CG1-CH2 4.02Å; I24-W48 HydrophobicContact CG1-CZ3 3.99Å; I24-I51 HydrophobicContact CG1-CD1 3.67Å; I24-Y73 HydrophobicContact CD1-CD1 4.19Å; I24-Y73 HydrophobicContact CD1-CD2 3.28Å; I24-Y73 HydrophobicContact CD1-CE2 3.92Å; I24-Y73 HydrophobicContact CD1-CG 3.43Å; I24-Y73 VanDerWaalsContact CD1-CG 3.43Å; I24-Y73 HydrophobicContact CG2-CE2 4.35Å; I24-W125 HydrophobicContact CG2-CH2 3.62Å; I24-W125 HydrophobicContact CG2-CZ2 4.39Å; I24-W125 HydrophobicContact CG2-CZ3 4.34Å
25	T	93.2	Very high	93.4	Very high	45 Å²	45	66 Å²	66	28%	0.276	31%	0.308	S	S	.	.	H	α-helix	trans	-61.3	-41.7	179.5	-54.7	0	0	0	0	111	L21 K22 E23 K28 W125	L21-T25 PolarHBondContact O-N 2.84Å; L21-T25 PolarHBondContact O-OG1 2.86Å; K22-T25 WeakPolarHBondContact O-CB 2.8Å; K22-T25 PolarHBondContact O-N 3.47Å; E23-T25 VanDerWaalsContact C-N 3.29Å; E23-T25 PolarHBondContact O-N 3.3Å; T25-K28 WeakPolarHBondContact O-CB 3.38Å; T25-K28 WeakPolarHBondContact O-CG 3.39Å; T25-W125 HydrophobicContact CG2-CD2 4.38Å; T25-W125 HydrophobicContact CG2-CG 4.46Å; T25-W125 VanDerWaalsContact OG1-CE3 3.27Å; T25-W125 WeakPolarHBondContact OG1-CZ3 3.45Å
26	K	94.5	Very high	92.9	Very high	151 Å²	151	68.7 Å²	68.7	66%	0.657	33%	0.325	S	S	*	.	H	α-helix	trans	-65.7	-38	176.8	-178.9	175	156.1	-140.2	0	112.9	K22 E23 I24	K22-K26 PolarHBondContact O-N 3.4Å; K22-K26 VanDerWaalsContact O-N 3.14Å; E23-K26 PolarHBondContact O-N 3.16Å; E23-K26 WeakPolarHBondContact OE1-CD 3.42Å; E23-K26 IonicContact OE1-NZ 2.84Å; E23-K26 PolarHBondContact OE1-NZ 2.94Å; E23-K26 IonicContact OE2-NZ 3.8Å; I24-K26 VanDerWaalsContact C-N 3.3Å; I24-K26 PolarHBondContact O-N 3.48Å
27	R	93.5	Very high	92.5	Very high	43 Å²	43	71.8 Å²	71.8	16%	0.162	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	18.5	-178.5	-62.7	179.3	175.4	121.3	8.2	113.6	E23 I24 E29 V30 I31 E50	E23-R27 PolarHBondContact O-N 3.27Å; E23-R27 IonicContact OE1-CZ 3.36Å; E23-R27 IonicContact OE1-NE 3.2Å; E23-R27 PolarHBondContact OE1-NE 3.26Å; E23-R27 IonicContact OE1-NH1 2.84Å; E23-R27 PolarHBondContact OE1-NH1 3.03Å; E23-R27 VanDerWaalsContact OE1-NH1 3.08Å; E23-R27 IonicContact OE1-NH2 2.95Å; E23-R27 PolarHBondContact OE1-NH2 3.43Å; I24-R27 CarbonylContact O-C 3.42Å; I24-R27 PolarHBondContact O-N 2.91Å; R27-E29 VanDerWaalsContact C-N 3.31Å; R27-E29 PolarHBondContact O-N 2.96Å; R27-V30 PolarHBondContact O-N 3.41Å; R27-I31 HydrophobicContact CB-CD1 3.86Å; R27-I31 HydrophobicContact CB-CG1 4.33Å; R27-I31 WeakPolarHBondContact O-CG1 3.37Å; R27-I31 PolarHBondContact O-N 3.39Å; R27-I31 VanDerWaalsContact O-N 3.09Å; R27-E50 VanDerWaalsContact CZ-CB 3.42Å; R27-E50 IonicContact CZ-OE2 2.77Å; R27-E50 IonicContact NE-OE2 3.5Å; R27-E50 PolarHBondContact NE-OE2 3.27Å; R27-E50 VanDerWaalsContact NH1-C 3.31Å; R27-E50 PolarHBondContact NH1-O 3.48Å; R27-E50 IonicContact NH2-OE2 3.59Å; R27-E50 PolarHBondContact NH2-OE2 2.93Å
28	K	92.1	Very high	92.2	Very high	95 Å²	95	74.7 Å²	74.7	41%	0.413	36%	0.36	S	S	.	.	H	α-helix	trans	-55.9	-41	-171.6	69.6	178.6	-174.1	170.3	0	113.7	I24 T25 V30 I31 F32	I24-K28 WeakPolarHBondContact O-CA 3.32Å; I24-K28 PolarHBondContact O-N 3.5Å; T25-K28 WeakPolarHBondContact O-CB 3.38Å; T25-K28 WeakPolarHBondContact O-CG 3.39Å; K28-V30 VanDerWaalsContact C-N 3.26Å; K28-V30 PolarHBondContact O-N 3Å; K28-I31 PolarHBondContact O-N 3.13Å; K28-F32 HydrophobicContact CB-CD2 4.28Å; K28-F32 WeakPolarHBondContact O-CB 3.35Å; K28-F32 WeakPolarHBondContact O-CD2 3.33Å; K28-F32 PolarHBondContact O-N 3.49Å
29	E	92.1	Very high	92	Very high	149 Å²	149	74.7 Å²	74.7	70%	0.696	37%	0.366	S	S	*	.	H	α-helix	trans	-59.4	-40.1	-176.6	-63.6	-78.7	146.3	0	0	110.7	R27 S33	R27-E29 VanDerWaalsContact C-N 3.31Å; R27-E29 PolarHBondContact O-N 2.96Å; E29-S33 WeakPolarHBondContact O-CA 3.42Å; E29-S33 VanDerWaalsContact O-CB 3.3Å; E29-S33 WeakPolarHBondContact O-CB 3.49Å; E29-S33 PolarHBondContact O-N 3.49Å
30	V	93.2	Very high	91.7	Very high	49 Å²	49	74.7 Å²	74.7	30%	0.297	36%	0.364	S	S	.	.	H	α-helix	trans	-81	-48.4	-178.3	-179.4	0	0	0	0	110.6	R27 K28 F32 S33 M43 K44 A47	R27-V30 PolarHBondContact O-N 3.41Å; K28-V30 VanDerWaalsContact C-N 3.26Å; K28-V30 PolarHBondContact O-N 3Å; V30-F32 VanDerWaalsContact C-N 3.35Å; V30-F32 PolarHBondContact O-N 2.95Å; V30-S33 WeakPolarHBondContact O-CB 3.31Å; V30-S33 PolarHBondContact O-N 3.04Å; V30-M43 HydrophobicContact CG1-CB 3.82Å; V30-K44 WeakPolarHBondContact O-CE 3.44Å; V30-K44 VanDerWaalsContact O-CG 3.29Å; V30-K44 WeakPolarHBondContact O-CG 3.32Å; V30-A47 HydrophobicContact CG1-CB 4.17Å
31	I	93.9	Very high	91.5	Very high	12 Å²	12	78.2 Å²	78.2	6%	0.062	38%	0.383	C	S	.	.	H	α-helix	trans	-62.9	-42.8	-175.2	-68.1	170.4	0	0	0	111.3	I24 R27 K28 K44 A47 W48 I51	I24-I31 HydrophobicContact CB-CD1 4.47Å; I24-I31 HydrophobicContact CG1-CD1 4.28Å; I24-I31 HydrophobicContact CG2-CD1 4.35Å; R27-I31 HydrophobicContact CB-CD1 3.86Å; R27-I31 HydrophobicContact CB-CG1 4.33Å; R27-I31 WeakPolarHBondContact O-CG1 3.37Å; R27-I31 PolarHBondContact O-N 3.39Å; R27-I31 VanDerWaalsContact O-N 3.09Å; K28-I31 PolarHBondContact O-N 3.13Å; I31-K44 WeakPolarHBondContact O-CE 3.39Å; I31-A47 HydrophobicContact CG1-CB 3.98Å; I31-W48 HydrophobicContact CG2-CH2 4.42Å; I31-W48 HydrophobicContact CG2-CZ2 3.55Å; I31-I51 HydrophobicContact CD1-CD1 3.36Å
32	F	92.3	Very high	91.5	Very high	93 Å²	93	80.9 Å²	80.9	41%	0.408	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	17.2	-179.2	-56.2	-65.9	0	0	0	113.1	I24 K28 V30 K34 Y73 W125	I24-F32 HydrophobicContact CG2-CE2 3.87Å; I24-F32 HydrophobicContact CG2-CZ 4.17Å; K28-F32 HydrophobicContact CB-CD2 4.28Å; K28-F32 WeakPolarHBondContact O-CB 3.35Å; K28-F32 WeakPolarHBondContact O-CD2 3.33Å; K28-F32 PolarHBondContact O-N 3.49Å; V30-F32 VanDerWaalsContact C-N 3.35Å; V30-F32 PolarHBondContact O-N 2.95Å; F32-K34 PolarHBondContact O-N 2.82Å; F32-Y73 HydrophobicContact CE1-CE1 4.1Å; F32-Y73 AromaticContact CZ-CE1 3.71Å; F32-Y73 HydrophobicContact CZ-CE1 3.71Å; F32-Y73 AromaticContact CZ-CZ 3.72Å; F32-Y73 VanDerWaalsContact CZ-OH 3.28Å; F32-Y73 WeakPolarHBondContact CZ-OH 3.37Å; F32-W125 HydrophobicContact CE2-CH2 4.36Å; F32-W125 HydrophobicContact CE2-CZ2 4.03Å
33	S	90.2	Very high	91.4	Very high	23 Å²	23	77.8 Å²	77.8	16%	0.161	39%	0.388	C	S	.	.			trans	-54.8	126.6	173.7	178.8	0	0	0	0	110.3	E29 V30 Q35 K44	E29-S33 WeakPolarHBondContact O-CA 3.42Å; E29-S33 VanDerWaalsContact O-CB 3.3Å; E29-S33 WeakPolarHBondContact O-CB 3.49Å; E29-S33 PolarHBondContact O-N 3.49Å; V30-S33 WeakPolarHBondContact O-CB 3.31Å; V30-S33 PolarHBondContact O-N 3.04Å; S33-Q35 PolarHBondContact O-N 2.82Å; S33-Q35 PolarHBondContact OG-N 3.36Å; S33-K44 WeakPolarHBondContact O-CE 3.46Å; S33-K44 PolarHBondContact O-NZ 3.33Å
34	K	88.9	Confident	91.3	Very high	190 Å²	190	78.8 Å²	78.8	83%	0.826	39%	0.392	S	S	*	.			trans	-72.4	-12	176.9	-63.5	-175.1	179.6	-175.6	0	112.8	F32 L36	F32-K34 PolarHBondContact O-N 2.82Å; K34-L36 PolarHBondContact O-N 2.89Å
35	Q	86.1	Confident	91.3	Very high	120 Å²	120	87 Å²	87	56%	0.561	42%	0.423	S	S	*	.			trans	-70	131.2	-179.2	-64	179.7	13.2	0	0	110.8	S33 I40	S33-Q35 PolarHBondContact O-N 2.82Å; S33-Q35 PolarHBondContact OG-N 3.36Å; Q35-I40 HydrophobicContact CB-CD1 4.49Å; Q35-I40 HydrophobicContact CB-CG1 3.87Å; Q35-I40 HydrophobicContact CB-CG2 4.43Å; Q35-I40 WeakPolarHBondContact O-CG2 3.41Å
36	L	83.2	Confident	91.5	Very high	162 Å²	162	89.6 Å²	89.6	85%	0.848	43%	0.433	S	S	*	.			trans	-106.6	76	179	-60.5	178.5	0	0	0	109.6	K34	K34-L36 PolarHBondContact O-N 2.89Å
37	N	84.3	Confident	91.6	Very high	76 Å²	76	82.6 Å²	82.6	41%	0.406	40%	0.404	S	S	.	.			trans	-129.5	145.9	176.6	174.9	-11.4	0	0	0	109.3	T39 I40 N41	N37-T39 PolarHBondContact O-N 3.47Å; N37-T39 PolarHBondContact OD1-N 3.38Å; N37-T39 PolarHBondContact OD1-OG1 2.95Å; N37-I40 HydrophobicContact CB-CB 4.49Å; N37-I40 HydrophobicContact CB-CG1 4.28Å; N37-I40 PolarHBondContact O-N 2.87Å; N37-N41 PolarHBondContact O-N 2.82Å
38	T	88.3	Confident	91.8	Very high	71 Å²	71	81.6 Å²	81.6	44%	0.436	40%	0.4	S	S	.	.	H	α-helix	trans	-48.4	-40.5	170.6	52.5	0	0	0	0	113.1	N41 V42	T38-N41 PolarHBondContact O-N 3.44Å; T38-V42 VanDerWaalsContact O-CG2 3.31Å; T38-V42 WeakPolarHBondContact O-CG2 3.41Å; T38-V42 PolarHBondContact O-N 3.17Å
39	T	89.4	Confident	92	Very high	84 Å²	84	81.1 Å²	81.1	52%	0.515	40%	0.4	S	S	.	.	H	α-helix	trans	-62.4	-45.6	176.3	-53.3	0	0	0	0	111	N37 N41 V42 M43	N37-T39 PolarHBondContact O-N 3.47Å; N37-T39 PolarHBondContact OD1-N 3.38Å; N37-T39 PolarHBondContact OD1-OG1 2.95Å; T39-N41 VanDerWaalsContact C-N 3.32Å; T39-N41 PolarHBondContact O-N 2.89Å; T39-V42 WeakPolarHBondContact O-CB 3.33Å; T39-V42 PolarHBondContact O-N 3.21Å; T39-M43 VanDerWaalsContact O-CG 3.26Å; T39-M43 WeakPolarHBondContact O-CG 3.41Å; T39-M43 PolarHBondContact O-N 3.45Å
40	I	90	Very high	92.3	Very high	29 Å²	29	77.7 Å²	77.7	15%	0.149	38%	0.383	C	S	.	.	H	α-helix	trans	-66.9	-35.8	177.4	-64	-67.8	0	0	0	111.1	Q35 N37 V42 M43 K44	Q35-I40 HydrophobicContact CB-CD1 4.49Å; Q35-I40 HydrophobicContact CB-CG1 3.87Å; Q35-I40 HydrophobicContact CB-CG2 4.43Å; Q35-I40 WeakPolarHBondContact O-CG2 3.41Å; N37-I40 HydrophobicContact CB-CB 4.49Å; N37-I40 HydrophobicContact CB-CG1 4.28Å; N37-I40 PolarHBondContact O-N 2.87Å; I40-V42 VanDerWaalsContact C-N 3.35Å; I40-M43 PolarHBondContact O-N 2.9Å; I40-K44 HydrophobicContact CG2-CD 4.14Å; I40-K44 HydrophobicContact CG2-CG 4.35Å; I40-K44 WeakPolarHBondContact O-CB 3.31Å; I40-K44 VanDerWaalsContact O-CG 3.29Å; I40-K44 WeakPolarHBondContact O-CG 3.35Å; I40-K44 PolarHBondContact O-N 2.86Å
41	N	92.1	Very high	92.4	Very high	76 Å²	76	75.3 Å²	75.3	41%	0.406	37%	0.369	S	S	.	.	H	α-helix	trans	-66.1	-37.2	174.3	-71.1	-20.4	0	0	0	112	N37 T38 T39 R45	N37-N41 PolarHBondContact O-N 2.82Å; T38-N41 PolarHBondContact O-N 3.44Å; T39-N41 VanDerWaalsContact C-N 3.32Å; T39-N41 PolarHBondContact O-N 2.89Å; N41-R45 WeakPolarHBondContact O-CG 3.31Å; N41-R45 PolarHBondContact O-N 2.87Å
42	V	94.4	Very high	92.6	Very high	59 Å²	59	74.8 Å²	74.8	36%	0.358	37%	0.366	S	S	.	.	H	α-helix	trans	-62.9	-49.9	170.1	172.6	0	0	0	0	110	T38 T39 I40 K44 R45 M46	T38-V42 VanDerWaalsContact O-CG2 3.31Å; T38-V42 WeakPolarHBondContact O-CG2 3.41Å; T38-V42 PolarHBondContact O-N 3.17Å; T39-V42 WeakPolarHBondContact O-CB 3.33Å; T39-V42 PolarHBondContact O-N 3.21Å; I40-V42 VanDerWaalsContact C-N 3.35Å; V42-K44 VanDerWaalsContact C-N 3.32Å; V42-K44 PolarHBondContact O-N 2.9Å; V42-R45 WeakPolarHBondContact O-CB 3.42Å; V42-R45 PolarHBondContact O-N 3.43Å; V42-R45 VanDerWaalsContact O-N 3.07Å; V42-M46 HydrophobicContact CG1-CG 4.3Å; V42-M46 HydrophobicContact CG1-SD 3.93Å; V42-M46 WeakPolarHBondContact O-CG 3.47Å; V42-M46 PolarHBondContact O-N 3.38Å
43	M	95.1	Very high	92.7	Very high	87 Å²	87	76 Å²	76	43%	0.429	37%	0.373	S	S	.	.	H	α-helix	trans	-59.3	-40.4	178	-66.9	-66.4	-71.9	0	0	112.4	V30 T39 I40 M46 A47	V30-M43 HydrophobicContact CG1-CB 3.82Å; T39-M43 VanDerWaalsContact O-CG 3.26Å; T39-M43 WeakPolarHBondContact O-CG 3.41Å; T39-M43 PolarHBondContact O-N 3.45Å; I40-M43 PolarHBondContact O-N 2.9Å; M43-M46 PolarHBondContact O-N 3.44Å; M43-A47 VanDerWaalsContact O-CB 3.32Å; M43-A47 WeakPolarHBondContact O-CB 3.32Å; M43-A47 PolarHBondContact O-N 2.95Å
44	K	94.8	Very high	93	Very high	40 Å²	40	76.8 Å²	76.8	17%	0.174	38%	0.378	C	S	.	.	H	α-helix	trans	-61.6	-45.8	173.3	-77.8	172.8	178.4	172	0	111.2	V30 I31 S33 I40 V42 A47 W48	V30-K44 WeakPolarHBondContact O-CE 3.44Å; V30-K44 VanDerWaalsContact O-CG 3.29Å; V30-K44 WeakPolarHBondContact O-CG 3.32Å; I31-K44 WeakPolarHBondContact O-CE 3.39Å; S33-K44 WeakPolarHBondContact O-CE 3.46Å; S33-K44 PolarHBondContact O-NZ 3.33Å; I40-K44 HydrophobicContact CG2-CD 4.14Å; I40-K44 HydrophobicContact CG2-CG 4.35Å; I40-K44 WeakPolarHBondContact O-CB 3.31Å; I40-K44 VanDerWaalsContact O-CG 3.29Å; I40-K44 WeakPolarHBondContact O-CG 3.35Å; I40-K44 PolarHBondContact O-N 2.86Å; V42-K44 VanDerWaalsContact C-N 3.32Å; V42-K44 PolarHBondContact O-N 2.9Å; K44-A47 PolarHBondContact O-N 2.84Å; K44-W48 PolarHBondContact O-N 3.38Å
45	R	95.2	Very high	93.3	Very high	173 Å²	173	67.7 Å²	67.7	65%	0.653	34%	0.339	S	S	*	.	H	α-helix	trans	-61.4	-47.3	176.6	-76.1	-173.1	-65.6	-178.8	2	111.3	N41 V42 A47 W48 E49	N41-R45 WeakPolarHBondContact O-CG 3.31Å; N41-R45 PolarHBondContact O-N 2.87Å; V42-R45 WeakPolarHBondContact O-CB 3.42Å; V42-R45 PolarHBondContact O-N 3.43Å; V42-R45 VanDerWaalsContact O-N 3.07Å; R45-A47 VanDerWaalsContact C-N 3.34Å; R45-A47 PolarHBondContact O-N 3.48Å; R45-W48 PolarHBondContact O-N 3.3Å; R45-E49 PolarHBondContact O-N 2.9Å
46	M	96.9	Very high	93.7	Very high	99 Å²	99	63.9 Å²	63.9	49%	0.488	32%	0.323	S	S	.	.	H	α-helix	trans	-59.5	-44.9	176.3	-68.9	180	72	0	0	111.3	V42 M43 W48 E49 E50	V42-M46 HydrophobicContact CG1-CG 4.3Å; V42-M46 HydrophobicContact CG1-SD 3.93Å; V42-M46 WeakPolarHBondContact O-CG 3.47Å; V42-M46 PolarHBondContact O-N 3.38Å; M43-M46 PolarHBondContact O-N 3.44Å; M46-W48 VanDerWaalsContact C-N 3.34Å; M46-W48 PolarHBondContact O-N 3.49Å; M46-E49 PolarHBondContact O-N 3.3Å; M46-E49 VanDerWaalsContact O-N 3.14Å; M46-E50 WeakPolarHBondContact O-CG 3.38Å; M46-E50 PolarHBondContact O-N 3.36Å
47	A	96.7	Very high	94.1	Very high	5 Å²	5	60.3 Å²	60.3	4%	0.041	32%	0.316	C	S	.	.	H	α-helix	trans	-60.2	-42.1	176.9	0	0	0	0	0	112.4	V30 I31 M43 K44 R45 I51	V30-A47 HydrophobicContact CG1-CB 4.17Å; I31-A47 HydrophobicContact CG1-CB 3.98Å; M43-A47 VanDerWaalsContact O-CB 3.32Å; M43-A47 WeakPolarHBondContact O-CB 3.32Å; M43-A47 PolarHBondContact O-N 2.95Å; K44-A47 PolarHBondContact O-N 2.84Å; R45-A47 VanDerWaalsContact C-N 3.34Å; R45-A47 PolarHBondContact O-N 3.48Å; A47-I51 WeakPolarHBondContact O-CD1 3.31Å; A47-I51 WeakPolarHBondContact O-CG1 3.37Å; A47-I51 PolarHBondContact O-N 2.92Å
48	W	97.7	Very high	94.5	Very high	21 Å²	21	59 Å²	59	8%	0.08	31%	0.311	C	S	.	.	H	α-helix	trans	-66	-37.6	174.9	-78.4	114	0	0	0	112.6	L20 I24 I31 K44 R45 M46 I51 A52 G66 V69 K70 Y73	L20-W48 HydrophobicContact CD1-CZ3 4.31Å; I24-W48 HydrophobicContact CD1-CH2 3.66Å; I24-W48 HydrophobicContact CD1-CZ3 3.76Å; I24-W48 HydrophobicContact CG1-CH2 4.02Å; I24-W48 HydrophobicContact CG1-CZ3 3.99Å; I31-W48 HydrophobicContact CG2-CH2 4.42Å; I31-W48 HydrophobicContact CG2-CZ2 3.55Å; K44-W48 PolarHBondContact O-N 3.38Å; R45-W48 PolarHBondContact O-N 3.3Å; M46-W48 VanDerWaalsContact C-N 3.34Å; M46-W48 PolarHBondContact O-N 3.49Å; W48-I51 HydrophobicContact CE3-CD1 3.96Å; W48-I51 HydrophobicContact CZ3-CD1 4.14Å; W48-I51 PolarHBondContact O-N 3.31Å; W48-A52 PolarHBondContact O-N 2.92Å; W48-G66 WeakPolarHBondContact O-CA 3.4Å; W48-V69 HydrophobicContact CE3-CG1 4.42Å; W48-V69 HydrophobicContact CZ3-CG1 4.41Å; W48-K70 HydrophobicContact CD2-CB 3.77Å; W48-K70 HydrophobicContact CD2-CD 4.45Å; W48-K70 HydrophobicContact CD2-CG 4.14Å; W48-K70 HydrophobicContact CE3-CB 3.79Å; W48-K70 HydrophobicContact CE3-CG 4.47Å; W48-K70 HydrophobicContact CG-CB 4.35Å; W48-K70 HydrophobicContact CH2-CB 4.23Å; W48-K70 HydrophobicContact CH2-CG 4.21Å; W48-K70 HydrophobicContact CZ2-CB 4.2Å; W48-K70 HydrophobicContact CZ2-CD 4.47Å; W48-K70 HydrophobicContact CZ2-CG 3.84Å; W48-K70 HydrophobicContact CZ3-CB 4.03Å; W48-Y73 AromaticContact CH2-CD1 3.79Å; W48-Y73 HydrophobicContact CH2-CD1 3.79Å; W48-Y73 HydrophobicContact CH2-CG 4.04Å; W48-Y73 HydrophobicContact CZ2-CD1 4.39Å
49	E	97.4	Very high	94.5	Very high	86 Å²	86	56.4 Å²	56.4	40%	0.402	30%	0.299	S	S	.	.	H	α-helix	trans	-68.9	-41.3	177.5	-162.2	58.5	-153.9	0	0	111.7	R45 M46 I51 A52 Q53 G66	R45-E49 PolarHBondContact O-N 2.9Å; M46-E49 PolarHBondContact O-N 3.3Å; M46-E49 VanDerWaalsContact O-N 3.14Å; E49-I51 VanDerWaalsContact C-N 3.32Å; E49-I51 PolarHBondContact O-N 2.99Å; E49-A52 WeakPolarHBondContact O-CB 3.45Å; E49-A52 PolarHBondContact O-N 3.45Å; E49-A52 VanDerWaalsContact O-N 3.14Å; E49-Q53 WeakPolarHBondContact O-CG 3.49Å; E49-Q53 PolarHBondContact O-N 3.37Å; E49-G66 WeakPolarHBondContact OE2-CA 3.18Å; E49-G66 PolarHBondContact OE2-N 2.86Å
50	E	97.4	Very high	94	Very high	76 Å²	76	61.6 Å²	61.6	36%	0.355	32%	0.317	S	S	.	.	H	α-helix	trans	-64.3	-35.9	172.8	-70.5	179.4	-163.5	0	0	112.1	R27 M46 A52 Q53 C54	R27-E50 VanDerWaalsContact CZ-CB 3.42Å; R27-E50 IonicContact CZ-OE2 2.77Å; R27-E50 IonicContact NE-OE2 3.5Å; R27-E50 PolarHBondContact NE-OE2 3.27Å; R27-E50 VanDerWaalsContact NH1-C 3.31Å; R27-E50 PolarHBondContact NH1-O 3.48Å; R27-E50 IonicContact NH2-OE2 3.59Å; R27-E50 PolarHBondContact NH2-OE2 2.93Å; M46-E50 WeakPolarHBondContact O-CG 3.38Å; M46-E50 PolarHBondContact O-N 3.36Å; E50-A52 VanDerWaalsContact C-N 3.33Å; E50-Q53 PolarHBondContact O-N 2.86Å; E50-C54 PolarHBondContact O-N 3.4Å; E50-C54 PolarHBondContact O-SG 2.96Å
51	I	96.9	Very high	93.3	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-64.5	-43.1	172.6	-67.2	163	0	0	0	109.6	L20 E23 I24 I31 A47 W48 E49 Q53 C54 V55 V69	L20-I51 HydrophobicContact CD1-CG2 3.51Å; E23-I51 HydrophobicContact CB-CG1 4.09Å; E23-I51 HydrophobicContact CB-CG2 4.37Å; E23-I51 HydrophobicContact CG-CG1 3.77Å; I24-I51 HydrophobicContact CG1-CD1 3.67Å; I31-I51 HydrophobicContact CD1-CD1 3.36Å; A47-I51 WeakPolarHBondContact O-CD1 3.31Å; A47-I51 WeakPolarHBondContact O-CG1 3.37Å; A47-I51 PolarHBondContact O-N 2.92Å; W48-I51 HydrophobicContact CE3-CD1 3.96Å; W48-I51 HydrophobicContact CZ3-CD1 4.14Å; W48-I51 PolarHBondContact O-N 3.31Å; E49-I51 VanDerWaalsContact C-N 3.32Å; E49-I51 PolarHBondContact O-N 2.99Å; I51-Q53 VanDerWaalsContact C-N 3.31Å; I51-Q53 PolarHBondContact O-N 2.93Å; I51-C54 PolarHBondContact O-N 2.94Å; I51-C54 VanDerWaalsContact O-N 3.16Å; I51-V55 HydrophobicContact CG2-CG2 4.24Å; I51-V55 WeakPolarHBondContact O-CG2 3.5Å; I51-V55 PolarHBondContact O-N 3.36Å; I51-V69 HydrophobicContact CG2-CG1 3.72Å
52	A	96.4	Very high	92.7	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-61.4	-40.3	177.4	0	0	0	0	0	112	W48 E49 E50 C54 V55 N56 V69	W48-A52 PolarHBondContact O-N 2.92Å; E49-A52 WeakPolarHBondContact O-CB 3.45Å; E49-A52 PolarHBondContact O-N 3.45Å; E49-A52 VanDerWaalsContact O-N 3.14Å; E50-A52 VanDerWaalsContact C-N 3.33Å; A52-C54 PolarHBondContact O-N 3.17Å; A52-V55 PolarHBondContact O-N 2.87Å; A52-N56 VanDerWaalsContact O-CB 3.31Å; A52-N56 WeakPolarHBondContact O-CB 3.27Å; A52-N56 PolarHBondContact O-N 2.91Å; A52-N56 PolarHBondContact O-ND2 2.91Å; A52-N56 PolarHBondContact O-OD1 3.42Å; A52-V69 HydrophobicContact CB-CB 4.44Å; A52-V69 HydrophobicContact CB-CG2 3.88Å
53	Q	96.1	Very high	92.5	Very high	118 Å²	118	68.2 Å²	68.2	55%	0.551	36%	0.363	S	S	*	.	H	α-helix	trans	-59.4	-44.6	172.2	-69.3	170.1	20.2	0	0	112.1	E49 E50 I51 V55 N56 A57	E49-Q53 WeakPolarHBondContact O-CG 3.49Å; E49-Q53 PolarHBondContact O-N 3.37Å; E50-Q53 PolarHBondContact O-N 2.86Å; I51-Q53 VanDerWaalsContact C-N 3.31Å; I51-Q53 PolarHBondContact O-N 2.93Å; Q53-V55 PolarHBondContact O-N 3.46Å; Q53-N56 PolarHBondContact O-N 3.19Å; Q53-A57 WeakPolarHBondContact O-CB 3.42Å; Q53-A57 PolarHBondContact O-N 3.34Å
54	C	95.3	Very high	92.3	Very high	40 Å²	40	64.7 Å²	64.7	27%	0.27	35%	0.345	S	S	.	.	H	α-helix	trans	-63.6	-39.3	175.9	-65.2	0	0	0	0	112.6	T19 E50 I51 A52 A57 V58	T19-C54 HydrophobicContact CG2-CB 4.21Å; E50-C54 PolarHBondContact O-N 3.4Å; E50-C54 PolarHBondContact O-SG 2.96Å; I51-C54 PolarHBondContact O-N 2.94Å; I51-C54 VanDerWaalsContact O-N 3.16Å; A52-C54 PolarHBondContact O-N 3.17Å; C54-A57 PolarHBondContact O-N 3.48Å; C54-V58 PolarHBondContact O-N 2.95Å
55	V	95.4	Very high	92.3	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-68	-43.8	176.8	172.1	0	0	0	0	110.8	F12 E16 T19 L20 I51 A52 Q53 A57 V58 G59 V69	F12-V55 HydrophobicContact CE1-CG1 4.32Å; E16-V55 HydrophobicContact CB-CG1 3.88Å; E16-V55 HydrophobicContact CG-CG1 4.02Å; T19-V55 HydrophobicContact CG2-CG2 4.47Å; L20-V55 HydrophobicContact CB-CG2 3.97Å; I51-V55 HydrophobicContact CG2-CG2 4.24Å; I51-V55 WeakPolarHBondContact O-CG2 3.5Å; I51-V55 PolarHBondContact O-N 3.36Å; A52-V55 PolarHBondContact O-N 2.87Å; Q53-V55 PolarHBondContact O-N 3.46Å; V55-A57 VanDerWaalsContact C-N 3.27Å; V55-A57 PolarHBondContact O-N 3.41Å; V55-V58 WeakPolarHBondContact O-CG2 3.48Å; V55-V58 PolarHBondContact O-N 3.25Å; V55-G59 PolarHBondContact O-N 2.95Å; V55-V69 HydrophobicContact CG2-CG1 4.43Å
56	N	93.9	Very high	92.3	Very high	40 Å²	40	57.5 Å²	57.5	21%	0.214	33%	0.325	C	S	.	.	H	α-helix	trans	-66.7	-30.3	177.6	-64.5	-15.7	0	0	0	112.1	A52 Q53 V58 G59 R64	A52-N56 VanDerWaalsContact O-CB 3.31Å; A52-N56 WeakPolarHBondContact O-CB 3.27Å; A52-N56 PolarHBondContact O-N 2.91Å; A52-N56 PolarHBondContact O-ND2 2.91Å; A52-N56 PolarHBondContact O-OD1 3.42Å; Q53-N56 PolarHBondContact O-N 3.19Å; N56-V58 PolarHBondContact O-N 3.46Å; N56-G59 PolarHBondContact O-N 3.41Å; N56-G59 VanDerWaalsContact O-O 3.09Å; N56-R64 PolarHBondContact ND2-N 3.37Å; N56-R64 PolarHBondContact ND2-O 3.47Å; N56-R64 WeakPolarHBondContact OD1-CA 3.35Å; N56-R64 VanDerWaalsContact OD1-CB 3.32Å; N56-R64 WeakPolarHBondContact OD1-CB 3.47Å; N56-R64 WeakPolarHBondContact OD1-CG 3.47Å; N56-R64 PolarHBondContact OD1-N 2.99Å
57	A	93.3	Very high	92.2	Very high	87 Å²	87	57.1 Å²	57.1	72%	0.719	33%	0.328	S	S	*	.	H	α-helix	trans	-68.1	-24	175.8	0	0	0	0	0	113.2	Q53 C54 V55	Q53-A57 WeakPolarHBondContact O-CB 3.42Å; Q53-A57 PolarHBondContact O-N 3.34Å; C54-A57 PolarHBondContact O-N 3.48Å; V55-A57 VanDerWaalsContact C-N 3.27Å; V55-A57 PolarHBondContact O-N 3.41Å
58	V	92.6	Very high	92.1	Very high	48 Å²	48	58.9 Å²	58.9	29%	0.291	34%	0.335	S	S	.	.	H	α-helix	trans	-100.3	-12.4	174.4	-58.7	0	0	0	0	113.1	Q15 E16 T19 C54 V55 N56	Q15-V58 HydrophobicContact CG-CB 4.32Å; Q15-V58 HydrophobicContact CG-CG2 4.44Å; E16-V58 HydrophobicContact CG-CG2 4.3Å; T19-V58 HydrophobicContact CG2-CG1 4.45Å; T19-V58 HydrophobicContact CG2-CG2 4.19Å; C54-V58 PolarHBondContact O-N 2.95Å; V55-V58 WeakPolarHBondContact O-CG2 3.48Å; V55-V58 PolarHBondContact O-N 3.25Å; N56-V58 PolarHBondContact O-N 3.46Å
59	G	87.2	Confident	92	Very high	17 Å²	17	57.9 Å²	57.9	18%	0.175	33%	0.332	C	S	.	.	S	Bend	trans	-89.9	140.7	179.4	0	0	0	0	0	111.2	E16 V55 N56	E16-G59 WeakPolarHBondContact OE1-CA 3.11Å; V55-G59 PolarHBondContact O-N 2.95Å; N56-G59 PolarHBondContact O-N 3.41Å; N56-G59 VanDerWaalsContact O-O 3.09Å
60	E	79.6	Confident	91.9	Very high	193 Å²	193	58.5 Å²	58.5	90%	0.902	33%	0.333	S	S	*	.	S	Bend	trans	-94	114.4	175.4	-66.3	178.5	178.8	0	0	109.4	E62	E60-E62 PolarHBondContact O-N 2.99Å
61	G	74.4	Confident	91.9	Very high	84 Å²	84	61.7 Å²	61.7	87%	0.866	34%	0.342	S	S	*	.	S	Bend	trans	87.8	-19	163.1	0	0	0	0	0	117.6
62	E	80.5	Confident	91.7	Very high	55 Å²	55	65 Å²	65	26%	0.257	36%	0.355	S	S	.	.			trans	-113.4	112.8	-179.6	-68	-161.2	177.5	0	0	114	K9 S10 E60 R64	K9-E62 WeakPolarHBondContact CB-OE2 3.4Å; S10-E62 WeakPolarHBondContact CA-OE1 3.42Å; S10-E62 WeakPolarHBondContact CB-OE1 3.47Å; S10-E62 WeakPolarHBondContact CB-OE2 3.45Å; S10-E62 PolarHBondContact N-OE1 3.39Å; S10-E62 PolarHBondContact N-OE2 3.38Å; E60-E62 PolarHBondContact O-N 2.99Å; E62-R64 PolarHBondContact O-N 3.32Å; E62-R64 IonicContact OE2-CZ 2.85Å; E62-R64 IonicContact OE2-NE 3.93Å; E62-R64 IonicContact OE2-NH1 3.71Å; E62-R64 PolarHBondContact OE2-NH1 3.41Å; E62-R64 IonicContact OE2-NH2 3.5Å; E62-R64 PolarHBondContact OE2-NH2 3.04Å
63	Q	89.6	Confident	91.7	Very high	164 Å²	164	65.3 Å²	65.3	77%	0.766	36%	0.356	S	S	*	.			trans	-74.7	114.9	169.3	-67.2	-174.5	-12.5	0	0	110.4	K9	K9-Q63 PolarHBondContact NZ-O 2.71Å
64	R	91.6	Very high	91.7	Very high	12 Å²	12	63 Å²	63	5%	0.045	35%	0.347	C	S	.	.			trans	-93.9	144.4	169.3	-45	-56.7	-172.5	155.9	14.8	109.6	S10 N11 F12 N56 E62 E68 V69	S10-R64 VanDerWaalsContact O-CZ 3.26Å; S10-R64 PolarHBondContact O-NH1 2.9Å; S10-R64 PolarHBondContact O-NH2 3.18Å; N11-R64 PolarHBondContact O-NH2 3.43Å; F12-R64 HydrophobicContact CE1-CG 4.23Å; F12-R64 HydrophobicContact CZ-CG 4.28Å; N56-R64 PolarHBondContact ND2-N 3.37Å; N56-R64 PolarHBondContact ND2-O 3.47Å; N56-R64 WeakPolarHBondContact OD1-CA 3.35Å; N56-R64 VanDerWaalsContact OD1-CB 3.32Å; N56-R64 WeakPolarHBondContact OD1-CB 3.47Å; N56-R64 WeakPolarHBondContact OD1-CG 3.47Å; N56-R64 PolarHBondContact OD1-N 2.99Å; E62-R64 PolarHBondContact O-N 3.32Å; E62-R64 IonicContact OE2-CZ 2.85Å; E62-R64 IonicContact OE2-NE 3.93Å; E62-R64 IonicContact OE2-NH1 3.71Å; E62-R64 PolarHBondContact OE2-NH1 3.41Å; E62-R64 IonicContact OE2-NH2 3.5Å; E62-R64 PolarHBondContact OE2-NH2 3.04Å; R64-E68 WeakPolarHBondContact CA-OE2 3.47Å; R64-V69 HydrophobicContact CB-CG2 3.77Å
65	T	94.2	Very high	91.6	Very high	58 Å²	58	65.5 Å²	65.5	36%	0.356	36%	0.358	S	S	.	.			trans	-92.3	160.9	173.5	61.7	0	0	0	0	111.1	T67 E68 V69	T65-T67 PolarHBondContact O-N 2.97Å; T65-T67 VanDerWaalsContact O-N 3.08Å; T65-T67 PolarHBondContact OG1-OG1 3.32Å; T65-E68 PolarHBondContact N-OE2 2.96Å; T65-E68 PolarHBondContact O-N 3.43Å; T65-E68 WeakPolarHBondContact OG1-CG 3.33Å; T65-E68 PolarHBondContact OG1-N 3.28Å; T65-E68 PolarHBondContact OG1-OE2 3.31Å; T65-E68 VanDerWaalsContact OG1-OE2 3.1Å; T65-V69 WeakPolarHBondContact O-CG2 3.35Å; T65-V69 PolarHBondContact O-N 3.47Å; T65-V69 VanDerWaalsContact O-N 3.12Å
66	G	94.5	Very high	91.6	Very high	4 Å²	4	66.8 Å²	66.8	4%	0.041	36%	0.362	C	S	.	.	H	α-helix	trans	-53.4	-31.1	174.1	0	0	0	0	0	113.7	W48 E49 K70	W48-G66 WeakPolarHBondContact O-CA 3.4Å; E49-G66 WeakPolarHBondContact OE2-CA 3.18Å; E49-G66 PolarHBondContact OE2-N 2.86Å; G66-K70 VanDerWaalsContact O-CB 3.29Å; G66-K70 WeakPolarHBondContact O-CB 3.45Å; G66-K70 PolarHBondContact O-N 3.24Å
67	T	95.2	Very high	91.5	Very high	91 Å²	91	69.8 Å²	69.8	56%	0.558	37%	0.371	S	S	*	.	H	α-helix	trans	-71.2	-39.6	177.9	69.1	0	0	0	0	113.4	T65 R71	T65-T67 PolarHBondContact O-N 2.97Å; T65-T67 VanDerWaalsContact O-N 3.08Å; T65-T67 PolarHBondContact OG1-OG1 3.32Å; T67-R71 PolarHBondContact O-N 3.22Å
68	E	94.9	Very high	91.5	Very high	42 Å²	42	68.2 Å²	68.2	20%	0.196	36%	0.358	C	S	.	.	H	α-helix	trans	-69.4	-41	179.1	-70.4	169.4	133.8	0	0	110.9	K9 R64 T65 R71 R72	K9-E68 WeakPolarHBondContact CD-OE1 3.42Å; K9-E68 VanDerWaalsContact CE-OE1 3.29Å; K9-E68 WeakPolarHBondContact CE-OE1 3.42Å; K9-E68 VanDerWaalsContact NZ-CD 3.29Å; K9-E68 IonicContact NZ-OE1 3.9Å; K9-E68 PolarHBondContact NZ-OE1 2.98Å; K9-E68 IonicContact NZ-OE2 2.7Å; K9-E68 PolarHBondContact NZ-OE2 3.5Å; K9-E68 VanDerWaalsContact NZ-OE2 3.09Å; R64-E68 WeakPolarHBondContact CA-OE2 3.47Å; T65-E68 PolarHBondContact N-OE2 2.96Å; T65-E68 PolarHBondContact O-N 3.43Å; T65-E68 WeakPolarHBondContact OG1-CG 3.33Å; T65-E68 PolarHBondContact OG1-N 3.28Å; T65-E68 PolarHBondContact OG1-OE2 3.31Å; T65-E68 VanDerWaalsContact OG1-OE2 3.1Å; E68-R71 WeakPolarHBondContact O-CB 3.31Å; E68-R71 PolarHBondContact O-N 3Å; E68-R72 PolarHBondContact O-N 3.45Å
69	V	95.7	Very high	91.5	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-67.4	-40.3	177.5	175.6	0	0	0	0	111.4	F12 L20 W48 I51 A52 V55 R64 T65 R71 R72 Y73	F12-V69 HydrophobicContact CE1-CG2 4.26Å; F12-V69 HydrophobicContact CZ-CG2 4.42Å; L20-V69 HydrophobicContact CD1-CG1 3.16Å; L20-V69 HydrophobicContact CD2-CG1 4.16Å; L20-V69 HydrophobicContact CG-CG1 4.19Å; W48-V69 HydrophobicContact CE3-CG1 4.42Å; W48-V69 HydrophobicContact CZ3-CG1 4.41Å; I51-V69 HydrophobicContact CG2-CG1 3.72Å; A52-V69 HydrophobicContact CB-CB 4.44Å; A52-V69 HydrophobicContact CB-CG2 3.88Å; V55-V69 HydrophobicContact CG2-CG1 4.43Å; R64-V69 HydrophobicContact CB-CG2 3.77Å; T65-V69 WeakPolarHBondContact O-CG2 3.35Å; T65-V69 PolarHBondContact O-N 3.47Å; T65-V69 VanDerWaalsContact O-N 3.12Å; V69-R71 PolarHBondContact O-N 3.38Å; V69-R72 PolarHBondContact O-N 2.88Å; V69-Y73 PolarHBondContact O-N 3.36Å
70	K	96.3	Very high	91.6	Very high	100 Å²	100	72.3 Å²	72.3	44%	0.435	37%	0.372	S	S	.	.	H	α-helix	trans	-58.3	-46.6	169.9	-179	179.8	178.5	-174.4	0	111.6	W48 G66 R72 Y73 L74	W48-K70 HydrophobicContact CD2-CB 3.77Å; W48-K70 HydrophobicContact CD2-CD 4.45Å; W48-K70 HydrophobicContact CD2-CG 4.14Å; W48-K70 HydrophobicContact CE3-CB 3.79Å; W48-K70 HydrophobicContact CE3-CG 4.47Å; W48-K70 HydrophobicContact CG-CB 4.35Å; W48-K70 HydrophobicContact CH2-CB 4.23Å; W48-K70 HydrophobicContact CH2-CG 4.21Å; W48-K70 HydrophobicContact CZ2-CB 4.2Å; W48-K70 HydrophobicContact CZ2-CD 4.47Å; W48-K70 HydrophobicContact CZ2-CG 3.84Å; W48-K70 HydrophobicContact CZ3-CB 4.03Å; G66-K70 VanDerWaalsContact O-CB 3.29Å; G66-K70 WeakPolarHBondContact O-CB 3.45Å; G66-K70 PolarHBondContact O-N 3.24Å; K70-R72 PolarHBondContact O-N 2.96Å; K70-Y73 PolarHBondContact O-N 2.95Å; K70-L74 WeakPolarHBondContact O-CG 3.5Å; K70-L74 PolarHBondContact O-N 3.47Å
71	R	95.7	Very high	92.1	Very high	143 Å²	143	69.8 Å²	69.8	54%	0.54	36%	0.358	S	S	.	.	H	α-helix	trans	-59.7	-46.8	177.7	-173.9	177.6	-67.2	109.7	-1.5	111.1	T67 E68 V69 Y73 L74 D75	T67-R71 PolarHBondContact O-N 3.22Å; E68-R71 WeakPolarHBondContact O-CB 3.31Å; E68-R71 PolarHBondContact O-N 3Å; V69-R71 PolarHBondContact O-N 3.38Å; R71-Y73 VanDerWaalsContact C-N 3.28Å; R71-Y73 PolarHBondContact O-N 3.45Å; R71-L74 WeakPolarHBondContact O-CB 3.37Å; R71-L74 PolarHBondContact O-N 2.93Å; R71-D75 PolarHBondContact O-N 3.32Å
72	R	94.4	Very high	92.8	Very high	70 Å²	70	73.3 Å²	73.3	26%	0.264	35%	0.345	S	S	.	.	H	α-helix	trans	-55.6	-42	175.8	176.2	58.2	178.7	167.8	-2.7	112.6	F12 T17 L20 E68 V69 K70 W76	F12-R72 HydrophobicContact CB-CG 4.44Å; F12-R72 HydrophobicContact CD1-CB 4.49Å; F12-R72 HydrophobicContact CD1-CG 3.87Å; F12-R72 HydrophobicContact CD2-CB 4.08Å; F12-R72 HydrophobicContact CD2-CG 3.72Å; F12-R72 HydrophobicContact CE1-CB 4.1Å; F12-R72 HydrophobicContact CE1-CG 3.97Å; F12-R72 HydrophobicContact CE2-CB 3.66Å; F12-R72 HydrophobicContact CE2-CG 3.83Å; F12-R72 HydrophobicContact CG-CB 4.47Å; F12-R72 HydrophobicContact CG-CG 3.73Å; F12-R72 HydrophobicContact CZ-CB 3.66Å; F12-R72 HydrophobicContact CZ-CG 3.95Å; T17-R72 PolarHBondContact OG1-NH2 2.92Å; T17-R72 VanDerWaalsContact OG1-NH2 3.16Å; L20-R72 HydrophobicContact CD2-CB 4.09Å; L20-R72 HydrophobicContact CD2-CG 3.66Å; E68-R72 PolarHBondContact O-N 3.45Å; V69-R72 PolarHBondContact O-N 2.88Å; K70-R72 PolarHBondContact O-N 2.96Å; R72-W76 VanDerWaalsContact O-CB 3.3Å; R72-W76 WeakPolarHBondContact O-CB 3.46Å; R72-W76 PolarHBondContact O-N 2.98Å
73	Y	95.9	Very high	93.3	Very high	6 Å²	6	77.6 Å²	77.6	2%	0.024	36%	0.363	C	S	.	.	H	α-helix	trans	-64.8	-42	175.6	169.1	-105.8	0	0	0	112.8	L21 I24 F32 W48 V69 K70 R71 W76 R77 W125	L21-Y73 HydrophobicContact CD2-CD2 4.14Å; L21-Y73 HydrophobicContact CD2-CE2 4.43Å; I24-Y73 HydrophobicContact CD1-CD1 4.19Å; I24-Y73 HydrophobicContact CD1-CD2 3.28Å; I24-Y73 HydrophobicContact CD1-CE2 3.92Å; I24-Y73 HydrophobicContact CD1-CG 3.43Å; I24-Y73 VanDerWaalsContact CD1-CG 3.43Å; I24-Y73 HydrophobicContact CG2-CE2 4.35Å; F32-Y73 HydrophobicContact CE1-CE1 4.1Å; F32-Y73 AromaticContact CZ-CE1 3.71Å; F32-Y73 HydrophobicContact CZ-CE1 3.71Å; F32-Y73 AromaticContact CZ-CZ 3.72Å; F32-Y73 VanDerWaalsContact CZ-OH 3.28Å; F32-Y73 WeakPolarHBondContact CZ-OH 3.37Å; W48-Y73 AromaticContact CH2-CD1 3.79Å; W48-Y73 HydrophobicContact CH2-CD1 3.79Å; W48-Y73 HydrophobicContact CH2-CG 4.04Å; W48-Y73 HydrophobicContact CZ2-CD1 4.39Å; V69-Y73 PolarHBondContact O-N 3.36Å; K70-Y73 PolarHBondContact O-N 2.95Å; R71-Y73 VanDerWaalsContact C-N 3.28Å; R71-Y73 PolarHBondContact O-N 3.45Å; Y73-W76 HydrophobicContact CD2-CE3 4.01Å; Y73-W76 HydrophobicContact CD2-CZ3 4.42Å; Y73-W76 AromaticContact CE2-CE3 3.95Å; Y73-W76 HydrophobicContact CE2-CE3 3.95Å; Y73-W76 AromaticContact CE2-CZ3 3.95Å; Y73-W76 HydrophobicContact CE2-CZ3 3.95Å; Y73-W76 PolarHBondContact O-N 3.4Å; Y73-R77 WeakPolarHBondContact O-CB 3.3Å; Y73-R77 PolarHBondContact O-N 2.95Å; Y73-W125 HydrophobicContact CE2-CH2 4.29Å
74	L	95.4	Very high	93	Very high	69 Å²	69	77.8 Å²	77.8	36%	0.361	36%	0.357	S	S	.	.	H	α-helix	trans	-62.6	-44.6	176.7	-65.2	177.8	0	0	0	111.5	K70 R71 W76 R77 A78	K70-L74 WeakPolarHBondContact O-CG 3.5Å; K70-L74 PolarHBondContact O-N 3.47Å; R71-L74 WeakPolarHBondContact O-CB 3.37Å; R71-L74 PolarHBondContact O-N 2.93Å; L74-W76 VanDerWaalsContact C-N 3.35Å; L74-R77 PolarHBondContact O-N 3.25Å; L74-A78 WeakPolarHBondContact O-CB 3.47Å; L74-A78 PolarHBondContact O-N 2.87Å
75	D	93.8	Very high	92.5	Very high	93 Å²	93	82.1 Å²	82.1	50%	0.497	38%	0.379	S	S	.	.	H	α-helix	trans	-62.6	-43.2	176.5	-67.1	-21.3	0	0	0	111.2	R71 R77 A78 L79	R71-D75 PolarHBondContact O-N 3.32Å; D75-R77 PolarHBondContact O-N 3.44Å; D75-A78 PolarHBondContact O-N 3.47Å; D75-L79 WeakPolarHBondContact O-CB 3.5Å; D75-L79 PolarHBondContact O-N 3.18Å
76	W	94.4	Very high	92	Very high	26 Å²	26	85.4 Å²	85.4	10%	0.098	39%	0.388	C	S	.	.	H	α-helix	trans	-60.1	-44.9	174.3	175.3	86.5	0	0	0	111.6	L21 R72 Y73 L74 A78 L79 M80	L21-W76 HydrophobicContact CD1-CD2 4.29Å; L21-W76 HydrophobicContact CD1-CH2 4.28Å; L21-W76 HydrophobicContact CD1-CZ2 3.6Å; L21-W76 HydrophobicContact CD2-CD2 3.66Å; L21-W76 HydrophobicContact CD2-CE3 3.57Å; L21-W76 HydrophobicContact CD2-CG 4.41Å; L21-W76 HydrophobicContact CD2-CH2 3.72Å; L21-W76 HydrophobicContact CD2-CZ2 3.8Å; L21-W76 HydrophobicContact CD2-CZ3 3.6Å; L21-W76 HydrophobicContact CG-CZ2 4.36Å; R72-W76 VanDerWaalsContact O-CB 3.3Å; R72-W76 WeakPolarHBondContact O-CB 3.46Å; R72-W76 PolarHBondContact O-N 2.98Å; Y73-W76 HydrophobicContact CD2-CE3 4.01Å; Y73-W76 HydrophobicContact CD2-CZ3 4.42Å; Y73-W76 AromaticContact CE2-CE3 3.95Å; Y73-W76 HydrophobicContact CE2-CE3 3.95Å; Y73-W76 AromaticContact CE2-CZ3 3.95Å; Y73-W76 HydrophobicContact CE2-CZ3 3.95Å; Y73-W76 PolarHBondContact O-N 3.4Å; L74-W76 VanDerWaalsContact C-N 3.35Å; W76-A78 PolarHBondContact O-N 3.5Å; W76-L79 WeakPolarHBondContact O-CB 3.33Å; W76-L79 PolarHBondContact O-N 2.86Å; W76-M80 HydrophobicContact CD2-CG 4.12Å; W76-M80 HydrophobicContact CH2-CG 4.39Å; W76-M80 HydrophobicContact CZ2-CG 3.87Å; W76-M80 WeakPolarHBondContact O-CG 3.47Å; W76-M80 PolarHBondContact O-N 3.1Å
77	R	92.9	Very high	91.3	Very high	104 Å²	104	87.7 Å²	87.7	39%	0.392	41%	0.407	S	S	.	.	H	α-helix	trans	-62.3	-43.8	177.8	-166.6	-179.2	76.8	-133.3	3.2	111.4	Y73 L74 D75 L79 M80 K81 F123	Y73-R77 WeakPolarHBondContact O-CB 3.3Å; Y73-R77 PolarHBondContact O-N 2.95Å; L74-R77 PolarHBondContact O-N 3.25Å; D75-R77 PolarHBondContact O-N 3.44Å; R77-L79 VanDerWaalsContact C-N 3.35Å; R77-M80 PolarHBondContact O-N 3Å; R77-K81 PolarHBondContact O-N 3.34Å; R77-F123 HydrophobicContact CG-CZ 4.14Å
78	A	93.1	Very high	90.1	Very high	54 Å²	54	87.2 Å²	87.2	45%	0.446	40%	0.401	S	S	.	.	H	α-helix	trans	-63.4	-41.1	176.3	0	0	0	0	0	111.8	L74 D75 W76 K81 R82	L74-A78 WeakPolarHBondContact O-CB 3.47Å; L74-A78 PolarHBondContact O-N 2.87Å; D75-A78 PolarHBondContact O-N 3.47Å; W76-A78 PolarHBondContact O-N 3.5Å; A78-K81 PolarHBondContact O-N 3.3Å; A78-R82 WeakPolarHBondContact O-CB 3.39Å; A78-R82 PolarHBondContact O-N 3.06Å
79	L	92.5	Very high	88.9	Confident	98 Å²	98	90.9 Å²	90.9	51%	0.513	42%	0.421	S	S	.	.	H	α-helix	trans	-61.6	-44.6	175.6	-178.4	64.9	0	0	0	111.6	D75 W76 R77 R82 K83	D75-L79 WeakPolarHBondContact O-CB 3.5Å; D75-L79 PolarHBondContact O-N 3.18Å; W76-L79 WeakPolarHBondContact O-CB 3.33Å; W76-L79 PolarHBondContact O-N 2.86Å; R77-L79 VanDerWaalsContact C-N 3.35Å; L79-R82 PolarHBondContact O-N 3.44Å; L79-K83 WeakPolarHBondContact O-CB 3.44Å; L79-K83 PolarHBondContact O-N 2.93Å
80	M	89.6	Confident	87.7	Confident	53 Å²	53	99.1 Å²	99.1	26%	0.261	46%	0.456	S	S	.	.	H	α-helix	trans	-67.2	-40.9	178.2	-69.2	-56.3	-71.2	0	0	112.2	W76 R77 R82 K83 R84	W76-M80 HydrophobicContact CD2-CG 4.12Å; W76-M80 HydrophobicContact CH2-CG 4.39Å; W76-M80 HydrophobicContact CZ2-CG 3.87Å; W76-M80 WeakPolarHBondContact O-CG 3.47Å; W76-M80 PolarHBondContact O-N 3.1Å; R77-M80 PolarHBondContact O-N 3Å; M80-R82 VanDerWaalsContact C-N 3.33Å; M80-R82 PolarHBondContact O-N 3.41Å; M80-K83 PolarHBondContact O-N 3.28Å; M80-R84 PolarHBondContact O-N 3Å
81	K	89.8	Confident	85.7	Confident	139 Å²	139	101.2 Å²	101.2	60%	0.604	47%	0.472	S	S	*	.	H	α-helix	trans	-57.7	-46.5	171.6	-172	177	-178.3	177.7	0	110.7	R77 A78 R84 M85	R77-K81 PolarHBondContact O-N 3.34Å; A78-K81 PolarHBondContact O-N 3.3Å; K81-R84 PolarHBondContact O-N 3.05Å; K81-M85 WeakPolarHBondContact O-CG 3.42Å; K81-M85 PolarHBondContact O-N 3.46Å
82	R	88.3	Confident	83.8	Confident	158 Å²	158	99.2 Å²	99.2	60%	0.596	48%	0.475	S	S	*	.	H	α-helix	trans	-63.9	-42.3	177.4	-174.5	-179.1	-65.5	168.2	-0.4	112.6	A78 L79 M80 R84 M85 K86	A78-R82 WeakPolarHBondContact O-CB 3.39Å; A78-R82 PolarHBondContact O-N 3.06Å; L79-R82 PolarHBondContact O-N 3.44Å; M80-R82 VanDerWaalsContact C-N 3.33Å; M80-R82 PolarHBondContact O-N 3.41Å; R82-R84 VanDerWaalsContact C-N 3.33Å; R82-R84 PolarHBondContact O-N 3.39Å; R82-M85 PolarHBondContact O-N 3.44Å; R82-K86 HydrophobicContact CG-CD 4.35Å; R82-K86 WeakPolarHBondContact O-CB 3.46Å; R82-K86 WeakPolarHBondContact O-CG 3.49Å; R82-K86 PolarHBondContact O-N 3.35Å
83	K	90.5	Very high	81.3	Confident	146 Å²	146	98.7 Å²	98.7	64%	0.635	49%	0.492	S	S	*	.	H	α-helix	trans	-62.1	-40.9	177.6	-170.2	177.5	178.2	-176.3	0	111	L79 M80 K86 A87	L79-K83 WeakPolarHBondContact O-CB 3.44Å; L79-K83 PolarHBondContact O-N 2.93Å; M80-K83 PolarHBondContact O-N 3.28Å; K83-K86 PolarHBondContact O-N 2.9Å; K83-A87 WeakPolarHBondContact O-CB 3.46Å; K83-A87 PolarHBondContact O-N 2.91Å
84	R	85.1	Confident	78.7	Confident	168 Å²	168	104 Å²	104	63%	0.634	53%	0.53	S	S	*	.	H	α-helix	trans	-64.1	-47.7	175	-173.8	176.5	-177.5	173.6	0.4	112.6	M80 K81 R82 K86 A87 N88	M80-R84 PolarHBondContact O-N 3Å; K81-R84 PolarHBondContact O-N 3.05Å; R82-R84 VanDerWaalsContact C-N 3.33Å; R82-R84 PolarHBondContact O-N 3.39Å; R84-K86 VanDerWaalsContact C-N 3.31Å; R84-K86 PolarHBondContact O-N 2.92Å; R84-A87 PolarHBondContact O-N 2.96Å; R84-A87 VanDerWaalsContact O-N 3.16Å; R84-N88 PolarHBondContact O-N 3.27Å
85	M	80.2	Confident	75.8	Confident	102 Å²	102	103 Å²	103	50%	0.502	54%	0.537	S	S	.	.	H	α-helix	trans	-59.6	-42.9	176.9	-66.3	-56.6	-168.6	0	0	111.6	K81 R82 A87 N88 I89	K81-M85 WeakPolarHBondContact O-CG 3.42Å; K81-M85 PolarHBondContact O-N 3.46Å; R82-M85 PolarHBondContact O-N 3.44Å; M85-A87 PolarHBondContact O-N 3.35Å; M85-N88 PolarHBondContact O-N 3.38Å; M85-I89 WeakPolarHBondContact O-CD1 3.36Å; M85-I89 VanDerWaalsContact O-CG1 3.26Å; M85-I89 WeakPolarHBondContact O-CG1 3.5Å; M85-I89 PolarHBondContact O-N 2.83Å
86	K	84.1	Confident	73	Confident	127 Å²	127	107.2 Å²	107.2	55%	0.552	55%	0.551	S	S	*	*	H	α-helix	trans	-63.7	-37.4	175.8	-72.9	-179.5	177	-170.2	0	112.8	R82 K83 R84 K90	R82-K86 HydrophobicContact CG-CD 4.35Å; R82-K86 WeakPolarHBondContact O-CB 3.46Å; R82-K86 WeakPolarHBondContact O-CG 3.49Å; R82-K86 PolarHBondContact O-N 3.35Å; K83-K86 PolarHBondContact O-N 2.9Å; R84-K86 VanDerWaalsContact C-N 3.31Å; R84-K86 PolarHBondContact O-N 2.92Å; K86-K90 WeakPolarHBondContact O-CG 3.34Å; K86-K90 PolarHBondContact O-N 3.44Å; K86-K90 VanDerWaalsContact O-N 3.1Å
87	A	78.7	Confident	70.2	Confident	53 Å²	53	112 Å²	112	44%	0.438	59%	0.585	S	S	.	*	H	α-helix	trans	-68.4	-43.1	176.3	0	0	0	0	0	112	K83 R84 M85 I89 K90 L91	K83-A87 WeakPolarHBondContact O-CB 3.46Å; K83-A87 PolarHBondContact O-N 2.91Å; R84-A87 PolarHBondContact O-N 2.96Å; R84-A87 VanDerWaalsContact O-N 3.16Å; M85-A87 PolarHBondContact O-N 3.35Å; A87-I89 VanDerWaalsContact C-N 3.34Å; A87-I89 PolarHBondContact O-N 2.9Å; A87-K90 PolarHBondContact O-N 3.29Å; A87-L91 PolarHBondContact O-N 3.34Å
88	N	71.7	Confident	67.5	Low	81 Å²	81	114.5 Å²	114.5	43%	0.433	61%	0.605	S	S	.	*	H	α-helix	trans	-62.3	-40.7	175.7	-72.3	-0.2	0	0	0	111.9	R84 M85 K90 L91 V92	R84-N88 PolarHBondContact O-N 3.27Å; M85-N88 PolarHBondContact O-N 3.38Å; N88-K90 VanDerWaalsContact C-N 3.34Å; N88-K90 PolarHBondContact O-N 3.01Å; N88-L91 PolarHBondContact O-N 2.95Å; N88-V92 WeakPolarHBondContact O-CG2 3.41Å; N88-V92 PolarHBondContact O-N 3Å; N88-V92 VanDerWaalsContact O-N 3.08Å
89	I	70	Confident	64.8	Low	119 Å²	119	117.2 Å²	117.2	61%	0.61	62%	0.619	S	S	*	*	H	α-helix	trans	-62.9	-40.6	174.6	-68.9	163.9	0	0	0	111.1	M85 A87 L91 V92 G93	M85-I89 WeakPolarHBondContact O-CD1 3.36Å; M85-I89 VanDerWaalsContact O-CG1 3.26Å; M85-I89 WeakPolarHBondContact O-CG1 3.5Å; M85-I89 PolarHBondContact O-N 2.83Å; A87-I89 VanDerWaalsContact C-N 3.34Å; A87-I89 PolarHBondContact O-N 2.9Å; I89-L91 VanDerWaalsContact C-N 3.34Å; I89-L91 PolarHBondContact O-N 3.32Å; I89-V92 PolarHBondContact O-N 3.4Å; I89-G93 VanDerWaalsContact O-CA 3.29Å; I89-G93 WeakPolarHBondContact O-CA 3.37Å; I89-G93 PolarHBondContact O-N 2.99Å
90	K	68.8	Low	62.2	Low	172 Å²	172	118.9 Å²	118.9	75%	0.748	64%	0.638	S	S	*	*	H	α-helix	trans	-67.7	-32.2	176.5	-73	179	-179.1	-168.6	0	113.1	K86 A87 N88	K86-K90 WeakPolarHBondContact O-CG 3.34Å; K86-K90 PolarHBondContact O-N 3.44Å; K86-K90 VanDerWaalsContact O-N 3.1Å; A87-K90 PolarHBondContact O-N 3.29Å; N88-K90 VanDerWaalsContact C-N 3.34Å; N88-K90 PolarHBondContact O-N 3.01Å
91	L	55.9	Low	59.7	Low	145 Å²	145	120.6 Å²	120.6	76%	0.759	66%	0.656	S	S	*	*	H	α-helix	trans	-74.9	-32.4	178.9	-164.4	69.9	0	0	0	112.4	A87 N88 I89	A87-L91 PolarHBondContact O-N 3.34Å; N88-L91 PolarHBondContact O-N 2.95Å; I89-L91 VanDerWaalsContact C-N 3.34Å; I89-L91 PolarHBondContact O-N 3.32Å
92	V	55.5	Low	57.1	Low	100 Å²	100	121.3 Å²	121.3	61%	0.606	67%	0.666	S	S	*	*	H	α-helix	trans	-90.6	-22.8	177.5	-178.1	0	0	0	0	112	N88 I89 S94	N88-V92 WeakPolarHBondContact O-CG2 3.41Å; N88-V92 PolarHBondContact O-N 3Å; N88-V92 VanDerWaalsContact O-N 3.08Å; I89-V92 PolarHBondContact O-N 3.4Å; V92-S94 VanDerWaalsContact C-N 3.3Å; V92-S94 PolarHBondContact O-N 2.95Å
93	G	40.6	Very low	54.8	Low	60 Å²	60	121.2 Å²	121.2	62%	0.619	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	8.5	-170.9	0	0	0	0	0	116.7	I89 G95	I89-G93 VanDerWaalsContact O-CA 3.29Å; I89-G93 WeakPolarHBondContact O-CA 3.37Å; I89-G93 PolarHBondContact O-N 2.99Å; G93-G95 VanDerWaalsContact C-N 3.35Å
94	S	41	Very low	52.4	Low	117 Å²	117	120.1 Å²	120.1	82%	0.818	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	17.9	170.3	75.6	0	0	0	0	113.9	V92	V92-S94 VanDerWaalsContact C-N 3.3Å; V92-S94 PolarHBondContact O-N 2.95Å
95	G	36.1	Very low	50.6	Low	49 Å²	49	119 Å²	119	51%	0.505	68%	0.684	S	S	.	*	T	Hydrogen-bonded Turn	trans	-171.6	-14.3	177	0	0	0	0	0	122.6	G93	G93-G95 VanDerWaalsContact C-N 3.35Å
96	F	34.7	Very low	48.8	Very low	181 Å²	181	118 Å²	118	79%	0.794	69%	0.688	S	S	*	*			trans	-141.4	116.7	-178.5	-78.3	-83.1	0	0	0	113.4	L98	F96-L98 PolarHBondContact O-N 3.18Å
97	P	35.3	Very low	46.5	Very low	125 Å²	125	115.8 Å²	115.8	81%	0.812	68%	0.681	S	S	*	*			trans	-69.9	114.2	166.2	-7.1	23	0	0	0	108.6
98	L	36.2	Very low	44.9	Very low	157 Å²	157	117.3 Å²	117.3	82%	0.822	69%	0.685	S	S	*	*			trans	-74.7	133.5	165.6	-77.1	165.7	0	0	0	108.5	F96 S100	F96-L98 PolarHBondContact O-N 3.18Å; L98-S100 PolarHBondContact O-N 2.99Å
99	P	35.8	Very low	43.6	Very low	112 Å²	112	121.6 Å²	121.6	73%	0.727	70%	0.702	S	S	*	*			trans	-72.8	128	-174.9	-3.3	19.1	0	0	0	110.3	S101	P99-S101 PolarHBondContact O-N 3.26Å
100	S	38.7	Very low	42.2	Very low	133 Å²	133	122.5 Å²	122.5	93%	0.93	70%	0.704	S	S	*	*			trans	-64.5	99.3	158.4	-70.8	0	0	0	0	108.6	L98	L98-S100 PolarHBondContact O-N 2.99Å
101	S	36.9	Very low	41	Very low	89 Å²	89	118.9 Å²	118.9	62%	0.622	69%	0.692	S	S	*	*			trans	-158.2	105.5	158.8	-172.4	0	0	0	0	109.1	P99 L103	P99-S101 PolarHBondContact O-N 3.26Å; S101-L103 PolarHBondContact O-N 2.9Å
102	D	35.9	Very low	40.4	Very low	154 Å²	154	117.7 Å²	117.7	82%	0.824	69%	0.686	S	S	*	*			trans	47.1	58.3	140.8	-49.6	-40.8	0	0	0	118.4
103	L	39.9	Very low	39.7	Very low	155 Å²	155	119.8 Å²	119.8	81%	0.812	69%	0.69	S	S	*	*			trans	-98.8	88.2	153.7	-146.3	84.5	0	0	0	109.2	S101 L107	S101-L103 PolarHBondContact O-N 2.9Å; L103-L107 HydrophobicContact CD2-CD1 4.29Å
104	D	39.4	Very low	39.6	Very low	123 Å²	123	125.5 Å²	125.5	66%	0.658	70%	0.697	S	S	*	*			trans	-3.6	126.7	155.4	-166	15.1	0	0	0	116.7	S106	D104-S106 PolarHBondContact O-N 3.44Å
105	D	47.2	Very low	39.7	Very low	144 Å²	144	125.7 Å²	125.7	77%	0.77	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	29.4	176.7	-170.8	27.2	0	0	0	112.9	T108	D105-T108 PolarHBondContact OD1-OG1 2.94Å
106	S	41.6	Very low	39.7	Very low	83 Å²	83	124.6 Å²	124.6	58%	0.58	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.3	-5	-179.5	-164.7	0	0	0	0	114	D104	D104-S106 PolarHBondContact O-N 3.44Å
107	L	36.9	Very low	39.6	Very low	80 Å²	80	123.8 Å²	123.8	42%	0.419	67%	0.673	S	S	.	*	S	Bend	trans	-102.4	3.3	175.8	-72.6	175.9	0	0	0	114	L103 E109 I111	L103-L107 HydrophobicContact CD2-CD1 4.29Å; L107-E109 PolarHBondContact O-N 3.21Å; L107-I111 HydrophobicContact CB-CD1 4.33Å; L107-I111 WeakPolarHBondContact O-CG1 3.28Å; L107-I111 PolarHBondContact O-N 3.48Å
108	T	45.6	Very low	39.6	Very low	85 Å²	85	128.2 Å²	128.2	52%	0.521	67%	0.674	S	S	.	*	H	α-helix	trans	-67.3	-26.5	178.8	-18.6	0	0	0	0	111.5	D105 D112	D105-T108 PolarHBondContact OD1-OG1 2.94Å; T108-D112 WeakPolarHBondContact O-CB 3.47Å; T108-D112 PolarHBondContact O-N 2.88Å
109	E	44.7	Very low	39.6	Very low	170 Å²	170	125.6 Å²	125.6	79%	0.794	66%	0.66	S	S	*	*	H	α-helix	trans	-82.7	-40	175.8	-69.5	-164.9	158.7	0	0	113.5	L107 I111 D112 E113	L107-E109 PolarHBondContact O-N 3.21Å; E109-I111 PolarHBondContact O-N 3.4Å; E109-D112 PolarHBondContact O-N 3.45Å; E109-E113 PolarHBondContact O-N 2.88Å; E109-E113 VanDerWaalsContact O-N 3.14Å
110	E	40.2	Very low	39.8	Very low	139 Å²	139	126.4 Å²	126.4	65%	0.65	66%	0.659	S	S	*	*	H	α-helix	trans	-74.7	-28.3	-178.5	-71.9	-165.1	168.4	0	0	113.3	K114	E110-K114 PolarHBondContact O-N 3.47Å
111	I	43.6	Very low	39.8	Very low	96 Å²	96	125.2 Å²	125.2	49%	0.492	66%	0.657	S	S	.	*	H	α-helix	trans	-76.4	-33.6	174.2	-63.2	171.9	0	0	0	110.4	L107 E109 E113 K114 I115	L107-I111 HydrophobicContact CB-CD1 4.33Å; L107-I111 WeakPolarHBondContact O-CG1 3.28Å; L107-I111 PolarHBondContact O-N 3.48Å; E109-I111 PolarHBondContact O-N 3.4Å; I111-E113 VanDerWaalsContact C-N 3.31Å; I111-E113 PolarHBondContact O-N 3.32Å; I111-K114 PolarHBondContact O-N 2.89Å; I111-I115 HydrophobicContact CG2-CD1 3.58Å; I111-I115 HydrophobicContact CG2-CG1 4.07Å; I111-I115 VanDerWaalsContact O-CB 3.29Å; I111-I115 WeakPolarHBondContact O-CB 3.48Å; I111-I115 PolarHBondContact O-N 3.5Å
112	D	41.9	Very low	39.8	Very low	119 Å²	119	126.4 Å²	126.4	64%	0.636	66%	0.656	S	S	*	*	H	α-helix	trans	-67.9	-32	175.5	-122.7	2.8	0	0	0	111.7	T108 E109 G116	T108-D112 WeakPolarHBondContact O-CB 3.47Å; T108-D112 PolarHBondContact O-N 2.88Å; E109-D112 PolarHBondContact O-N 3.45Å; D112-G116 WeakPolarHBondContact O-CA 3.49Å; D112-G116 PolarHBondContact O-N 2.98Å
113	E	42.6	Very low	40.2	Very low	145 Å²	145	123 Å²	123	68%	0.678	64%	0.635	S	S	*	*	H	α-helix	trans	-77.8	-33	179.1	-138.3	164.7	-154.9	0	0	112.7	E109 I111 F117	E109-E113 PolarHBondContact O-N 2.88Å; E109-E113 VanDerWaalsContact O-N 3.14Å; I111-E113 VanDerWaalsContact C-N 3.31Å; I111-E113 PolarHBondContact O-N 3.32Å; E113-F117 HydrophobicContact CG-CE2 4.5Å
114	K	38.3	Very low	40.5	Very low	179 Å²	179	119.5 Å²	119.5	78%	0.778	62%	0.617	S	S	*	*	H	α-helix	trans	-90.2	-27	-177.9	-141.5	172.6	-170.7	176.3	0	114.1	E110 I111	E110-K114 PolarHBondContact O-N 3.47Å; I111-K114 PolarHBondContact O-N 2.89Å
115	I	43.3	Very low	41	Very low	121 Å²	121	116.9 Å²	116.9	62%	0.621	60%	0.597	S	S	*	*	H	α-helix	trans	-99.9	-31.6	175.9	-57.9	-173.6	0	0	0	111.5	I111 F117	I111-I115 HydrophobicContact CG2-CD1 3.58Å; I111-I115 HydrophobicContact CG2-CG1 4.07Å; I111-I115 VanDerWaalsContact O-CB 3.29Å; I111-I115 WeakPolarHBondContact O-CB 3.48Å; I111-I115 PolarHBondContact O-N 3.5Å; I115-F117 PolarHBondContact O-N 3.38Å
116	G	34.3	Very low	40.8	Very low	26 Å²	26	115.3 Å²	115.3	27%	0.268	59%	0.585	S	S	.	*	H	α-helix	trans	-71.8	-25.8	-175.7	0	0	0	0	0	115.4	D112	D112-G116 WeakPolarHBondContact O-CA 3.49Å; D112-G116 PolarHBondContact O-N 2.98Å
117	F	34.4	Very low	40.9	Very low	165 Å²	165	115.8 Å²	115.8	72%	0.724	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	-18.6	-178.3	-78.8	-78.8	0	0	0	115.5	E113 I115	E113-F117 HydrophobicContact CG-CE2 4.5Å; I115-F117 PolarHBondContact O-N 3.38Å
118	R	35.4	Very low	41.3	Very low	217 Å²	217	113.8 Å²	113.8	82%	0.819	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-16	-171.5	-144.4	171.9	-174.4	-109.6	0.5	114.9
119	N	35	Very low	41.1	Very low	102 Å²	102	112.4 Å²	112.4	55%	0.545	57%	0.57	S	S	.	*	S	Bend	trans	-140.5	11.3	-172.9	-82.7	-31.2	0	0	0	117.5	A121 N122 F123	N119-A121 PolarHBondContact O-N 2.9Å; N119-N122 HydrophobicContact CB-CB 4.28Å; N119-N122 CarbonylContact O-C 3.31Å; N119-N122 VanDerWaalsContact O-C 3.31Å; N119-N122 VanDerWaalsContact O-CA 3.26Å; N119-N122 WeakPolarHBondContact O-CA 3.5Å; N119-N122 VanDerWaalsContact O-CB 3.3Å; N119-N122 WeakPolarHBondContact O-CB 3.3Å; N119-N122 PolarHBondContact O-N 3.19Å; N119-F123 PolarHBondContact O-N 3.02Å
120	D	40.9	Very low	40.9	Very low	130 Å²	130	108.6 Å²	108.6	70%	0.695	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-68.9	-22.8	171	-107.8	-3.1	0	0	0	112.9	N122 F123	D120-N122 PolarHBondContact O-N 3.44Å; D120-F123 PolarHBondContact O-N 3.39Å
121	A	38.9	Very low	40.8	Very low	108 Å²	108	105 Å²	105	89%	0.893	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-64.7	-17.6	166.4	0	0	0	0	0	112.6	N119	N119-A121 PolarHBondContact O-N 2.9Å
122	N	36.5	Very low	40.5	Very low	113 Å²	113	111.3 Å²	111.3	60%	0.604	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-109.5	18.7	-178.2	-128	22.7	0	0	0	112.3	N119 D120 D124	N119-N122 HydrophobicContact CB-CB 4.28Å; N119-N122 CarbonylContact O-C 3.31Å; N119-N122 VanDerWaalsContact O-C 3.31Å; N119-N122 VanDerWaalsContact O-CA 3.26Å; N119-N122 WeakPolarHBondContact O-CA 3.5Å; N119-N122 VanDerWaalsContact O-CB 3.3Å; N119-N122 WeakPolarHBondContact O-CB 3.3Å; N119-N122 PolarHBondContact O-N 3.19Å; D120-N122 PolarHBondContact O-N 3.44Å; N122-D124 WeakPolarHBondContact O-CB 3.41Å; N122-D124 PolarHBondContact O-N 3.44Å
123	F	44.7	Very low	40.2	Very low	84 Å²	84	113.1 Å²	113.1	37%	0.368	56%	0.564	S	S	.	*	S	Bend	trans	-60.5	2.5	163.5	-176.8	-103.3	0	0	0	112.7	R77 N119 D120	R77-F123 HydrophobicContact CG-CZ 4.14Å; N119-F123 PolarHBondContact O-N 3.02Å; D120-F123 PolarHBondContact O-N 3.39Å
124	D	45	Very low	39.7	Very low	81 Å²	81	109.1 Å²	109.1	43%	0.433	56%	0.556	S	S	.	*			trans	38.8	85.3	159.2	-155.5	17.5	0	0	0	113.7	N122 Q126 N127	N122-D124 WeakPolarHBondContact O-CB 3.41Å; N122-D124 PolarHBondContact O-N 3.44Å; D124-Q126 HydrophobicContact CB-CB 4.31Å; D124-Q126 PolarHBondContact O-N 2.96Å; D124-Q126 WeakPolarHBondContact OD1-CB 3.37Å; D124-Q126 PolarHBondContact OD1-N 2.94Å; D124-Q126 WeakPolarHBondContact OD2-CB 3.36Å; D124-N127 PolarHBondContact O-N 3.43Å
125	W	49.1	Very low	39.3	Very low	68 Å²	68	104.3 Å²	104.3	26%	0.258	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-52.3	-3.4	164.6	-62.2	95.7	0	0	0	112.9	I24 T25 F32 Y73 N127 V128	I24-W125 HydrophobicContact CG2-CH2 3.62Å; I24-W125 HydrophobicContact CG2-CZ2 4.39Å; I24-W125 HydrophobicContact CG2-CZ3 4.34Å; T25-W125 HydrophobicContact CG2-CD2 4.38Å; T25-W125 HydrophobicContact CG2-CG 4.46Å; T25-W125 VanDerWaalsContact OG1-CE3 3.27Å; T25-W125 WeakPolarHBondContact OG1-CZ3 3.45Å; F32-W125 HydrophobicContact CE2-CH2 4.36Å; F32-W125 HydrophobicContact CE2-CZ2 4.03Å; Y73-W125 HydrophobicContact CE2-CH2 4.29Å; W125-N127 PolarHBondContact O-N 2.98Å; W125-N127 VanDerWaalsContact O-N 3.15Å; W125-V128 HydrophobicContact CE3-CG2 3.72Å; W125-V128 HydrophobicContact CZ3-CG2 4.33Å; W125-V128 WeakPolarHBondContact O-CA 3.48Å; W125-V128 VanDerWaalsContact O-CB 3.27Å; W125-V128 WeakPolarHBondContact O-CB 3.49Å; W125-V128 PolarHBondContact O-N 3.41Å
126	Q	44.5	Very low	38.4	Very low	110 Å²	110	101.6 Å²	101.6	51%	0.514	56%	0.559	S	S	.	*	H	α-helix	trans	-49.9	-30.1	166.1	-160.9	68	13.7	0	0	113.6	D124 V128 A129 D130	D124-Q126 HydrophobicContact CB-CB 4.31Å; D124-Q126 PolarHBondContact O-N 2.96Å; D124-Q126 WeakPolarHBondContact OD1-CB 3.37Å; D124-Q126 PolarHBondContact OD1-N 2.94Å; D124-Q126 WeakPolarHBondContact OD2-CB 3.36Å; Q126-V128 PolarHBondContact O-N 2.92Å; Q126-A129 WeakPolarHBondContact O-CA 3.46Å; Q126-A129 WeakPolarHBondContact O-CB 3.48Å; Q126-A129 PolarHBondContact O-N 3.28Å; Q126-D130 PolarHBondContact O-N 2.85Å; Q126-D130 VanDerWaalsContact O-N 3.15Å
127	N	42.3	Very low	38.1	Very low	93 Å²	93	105.6 Å²	105.6	50%	0.497	58%	0.583	S	S	.	*	H	α-helix	trans	-68.3	-19.9	172.9	-91	-97.4	0	0	0	113.7	D124 W125 A129	D124-N127 PolarHBondContact O-N 3.43Å; W125-N127 PolarHBondContact O-N 2.98Å; W125-N127 VanDerWaalsContact O-N 3.15Å; N127-A129 VanDerWaalsContact C-N 3.34Å
128	V	46.4	Very low	38	Very low	38 Å²	38	104.7 Å²	104.7	23%	0.23	59%	0.585	C	S	.	*	H	α-helix	trans	-73.9	-30.5	170.5	-178.5	0	0	0	0	110.5	L21 W125 Q126 F131	L21-V128 HydrophobicContact CB-CG1 4.43Å; W125-V128 HydrophobicContact CE3-CG2 3.72Å; W125-V128 HydrophobicContact CZ3-CG2 4.33Å; W125-V128 WeakPolarHBondContact O-CA 3.48Å; W125-V128 VanDerWaalsContact O-CB 3.27Å; W125-V128 WeakPolarHBondContact O-CB 3.49Å; W125-V128 PolarHBondContact O-N 3.41Å; Q126-V128 PolarHBondContact O-N 2.92Å; V128-F131 WeakPolarHBondContact O-CB 3.37Å; V128-F131 PolarHBondContact O-N 2.9Å
129	A	40.4	Very low	37.6	Very low	57 Å²	57	99.8 Å²	99.8	47%	0.471	58%	0.579	S	S	.	*	H	α-helix	trans	-69	-38.5	172.2	0	0	0	0	0	111.6	Q126 N127 F131 R132	Q126-A129 WeakPolarHBondContact O-CA 3.46Å; Q126-A129 WeakPolarHBondContact O-CB 3.48Å; Q126-A129 PolarHBondContact O-N 3.28Å; N127-A129 VanDerWaalsContact C-N 3.34Å; A129-F131 PolarHBondContact O-N 3.17Å; A129-F131 VanDerWaalsContact O-N 3.12Å; A129-R132 WeakPolarHBondContact O-CB 3.38Å; A129-R132 PolarHBondContact O-N 3.44Å; A129-R132 VanDerWaalsContact O-N 3.08Å
130	D	40.7	Very low	37.1	Very low	90 Å²	90	103 Å²	103	48%	0.481	59%	0.591	S	S	.	*	G	3₁₀ helix	trans	-64.6	-13.6	175	-67.8	-20.8	0	0	0	113.4	Q126 R132 D133 A134	Q126-D130 PolarHBondContact O-N 2.85Å; Q126-D130 VanDerWaalsContact O-N 3.15Å; D130-R132 PolarHBondContact O-N 2.95Å; D130-D133 PolarHBondContact O-N 3.49Å; D130-A134 PolarHBondContact O-N 3.36Å
131	F	38.9	Very low	36.5	Very low	62 Å²	62	103.7 Å²	103.7	27%	0.272	60%	0.6	S	S	.	*	G	3₁₀ helix	trans	-68.5	-20.2	173.3	-153.5	-88.5	0	0	0	112.7	V14 Q18 V128 A129 D133	V14-F131 HydrophobicContact CG1-CE1 3.89Å; V14-F131 HydrophobicContact CG1-CZ 4.02Å; Q18-F131 HydrophobicContact CG-CD1 3.49Å; Q18-F131 VanDerWaalsContact CG-CD1 3.49Å; Q18-F131 HydrophobicContact CG-CE1 3.28Å; Q18-F131 HydrophobicContact CG-CZ 4.21Å; V128-F131 WeakPolarHBondContact O-CB 3.37Å; V128-F131 PolarHBondContact O-N 2.9Å; A129-F131 PolarHBondContact O-N 3.17Å; A129-F131 VanDerWaalsContact O-N 3.12Å; F131-D133 PolarHBondContact O-N 3.21Å
132	R	38	Very low	35.7	Very low	230 Å²	230	105.6 Å²	105.6	87%	0.868	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-63.7	-28.2	175.2	-167.6	175.1	171.1	-171.9	-4.4	112	A129 D130	A129-R132 WeakPolarHBondContact O-CB 3.38Å; A129-R132 PolarHBondContact O-N 3.44Å; A129-R132 VanDerWaalsContact O-N 3.08Å; D130-R132 PolarHBondContact O-N 2.95Å
133	D	34.6	Very low	35.6	Very low	156 Å²	156	106 Å²	106	83%	0.834	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	-10.9	-179.6	-75.8	-20.8	0	0	0	114.2	D130 F131 G135	D130-D133 PolarHBondContact O-N 3.49Å; F131-D133 PolarHBondContact O-N 3.21Å; D133-G135 VanDerWaalsContact C-N 3.3Å; D133-G135 PolarHBondContact O-N 3.47Å
134	A	32.4	Very low	34.7	Very low	62 Å²	62	109.1 Å²	109.1	51%	0.512	61%	0.61	S	S	.	*			trans	-91.8	28.7	178.6	0	0	0	0	0	114.2	D130 G136	D130-A134 PolarHBondContact O-N 3.36Å; A134-G136 PolarHBondContact O-N 2.92Å
135	G	29.6	Very low	33.7	Very low	78 Å²	78	114.3 Å²	114.3	80%	0.804	63%	0.632	S	S	*	*			trans	-67.4	25.9	169.4	0	0	0	0	0	114.7	D133	D133-G135 VanDerWaalsContact C-N 3.3Å; D133-G135 PolarHBondContact O-N 3.47Å
136	G	24.5	Very low	32.9	Very low	63 Å²	63	120.2 Å²	120.2	65%	0.649	66%	0.662	S	S	*	*			trans	-101.6	110.2	179.2	0	0	0	0	0	111.6	A134	A134-G136 PolarHBondContact O-N 2.92Å
137	S	28.6	Very low	32	Very low	111 Å²	111	123.8 Å²	123.8	78%	0.776	68%	0.678	S	S	*	*			trans	72.2	78.5	156.8	-154.4	0	0	0	0	116.9
138	L	31.5	Very low	31.6	Very low	146 Å²	146	131.2 Å²	131.2	76%	0.764	70%	0.7	S	S	*	*			trans	-119.3	100.9	141.1	-172.5	63.2	0	0	0	106.9	V14 E140	V14-L138 HydrophobicContact CG2-CD2 4.45Å; L138-E140 PolarHBondContact O-N 2.94Å
139	T	27.3	Very low	31.2	Very low	113 Å²	113	136.3 Å²	136.3	69%	0.693	73%	0.725	S	S	*	*			trans	-56.4	114.5	-178.3	43	0	0	0	0	112.1	V141	T139-V141 PolarHBondContact O-N 3.36Å
140	E	24.8	Very low	31.5	Very low	170 Å²	170	137.8 Å²	137.8	79%	0.794	73%	0.73	S	S	*	*			trans	-23.5	115.7	146	-167.9	176.2	-175.6	0	0	113.8	L138	L138-E140 PolarHBondContact O-N 2.94Å
141	V	27.4	Very low	31	Very low	144 Å²	144	142.5 Å²	142.5	87%	0.873	75%	0.75	S	S	*	*			trans	-122.4	96.6	156.8	175.5	0	0	0	0	106.8	T139	T139-V141 PolarHBondContact O-N 3.36Å
142	K	22.3	Very low	30.4	Very low	149 Å²	149	144.7 Å²	144.7	65%	0.648	77%	0.773	S	S	*	*			trans	-75.4	137.9	168.1	172.5	177.7	-179.3	173.5	0	109.7
143	V	33.6	Very low	30.2	Very low	121 Å²	121	138.5 Å²	138.5	73%	0.733	76%	0.762	S	S	*	*			trans	-179.5	99.1	141	174.9	0	0	0	0	105.6
144	E	26.1	Very low	29.9	Very low	149 Å²	149	139.1 Å²	139.1	70%	0.696	76%	0.76	S	S	*	*				61.6	103	104.2	-63	177.7	166.5	0	0	112.7
145	E	25.4	Very low	29.4	Very low	191 Å²	191	145.1 Å²	145.1	89%	0.893	78%	0.775	S	S	*	*				70.8	103	76.3	-157.3	178.9	-145.1	0	0	113
146	E	30.9	Very low	29.7	Very low	191 Å²	191	150.5 Å²	150.5	89%	0.893	78%	0.779	S	S	*	*			trans	-166.2	151.4	140.2	-130.5	-176.3	158.7	0	0	112.1
147	E	27.3	Very low	30	Very low	185 Å²	185	154.6 Å²	154.6	86%	0.864	78%	0.784	S	S	*	*			trans	-71.6	153	-162	-54.4	176.1	130.2	0	0	116.3
148	R	33.8	Very low	30.5	Very low	250 Å²	250	157.8 Å²	157.8	94%	0.943	79%	0.787	S	S	*	*				166.9	132.4	112.6	-156.4	173.7	-151.7	-140.8	4.1	112.3
149	D	37.3	Very low	30.8	Very low	144 Å²	144	159.6 Å²	159.6	77%	0.77	79%	0.792	S	S	*	*			trans	-82.6	-172	177.5	-159.5	33.9	0	0	0	112.2
150	P	45.8	Very low	31.3	Very low	88 Å²	88	160.8 Å²	160.8	57%	0.571	79%	0.789	S	S	*	*				-115.7	159.3	-73.5	30.9	-17.6	0	0	0	113
151	Q	31.5	Very low	32	Very low	190 Å²	190	161.4 Å²	161.4	89%	0.888	79%	0.792	S	S	*	*				172.5	114.2	127.8	-97.5	159.8	-38.9	0	0	111.2
152	S	25.7	Very low	32.9	Very low	108 Å²	108	162.7 Å²	162.7	76%	0.755	79%	0.789	S	S	*	*			trans	-61.7	166.6	150.3	47.1	0	0	0	0	111.1
153	P	34.2	Very low	33.9	Very low	100 Å²	100	164.6 Å²	164.6	65%	0.649	80%	0.802	S	S	*	*			cis	-142.5	-176.6	17.5	41.2	-20.6	0	0	0	116.3
154	E	28.2	Very low	34	Very low	168 Å²	168	165.7 Å²	165.7	79%	0.785	80%	0.803	S	S	*	*			trans	76.1	98.3	152.8	-77.6	164.7	-158.7	0	0	119
155	F	22.3	Very low	34.3	Very low	188 Å²	188	163 Å²	163	83%	0.825	80%	0.801	S	S	*	*				73.6	93.1	88.8	-87.3	-77.3	0	0	0	112.7
156	E	34.6	Very low	34.9	Very low	192 Å²	192	160.3 Å²	160.3	90%	0.897	80%	0.803	S	S	*	*			trans	-149.4	123.7	143	-129.4	165.9	-166.8	0	0	108.4
157	I	32.2	Very low	35.1	Very low	148 Å²	148	157 Å²	157	76%	0.759	80%	0.795	S	S	*	*			trans	-90.3	102.9	-179.7	-65.4	165.1	0	0	0	104.6
158	E	37.8	Very low	35.6	Very low	179 Å²	179	156 Å²	156	84%	0.836	80%	0.795	S	S	*	*			trans	-115	123.1	169.6	-131.3	173.5	-165.9	0	0	108.8	E160	E158-E160 PolarHBondContact O-N 3.35Å
159	E	38.8	Very low	35.7	Very low	183 Å²	183	149.5 Å²	149.5	86%	0.855	79%	0.785	S	S	*	*			trans	-70.8	99.4	-177.2	-66.3	172.6	153.8	0	0	109.2	E161	E159-E161 PolarHBondContact O-N 3.23Å
160	E	37.7	Very low	35.3	Very low	138 Å²	138	149.7 Å²	149.7	65%	0.645	79%	0.786	S	S	*	*			trans	-87.1	101.9	169	-71.4	-168.7	169.3	0	0	109.5	Q3 E158 E162	Q3-E160 PolarHBondContact NE2-OE1 2.75Å; Q3-E160 PolarHBondContact NE2-OE2 3.35Å; Q3-E160 VanDerWaalsContact NE2-OE2 3.14Å; E158-E160 PolarHBondContact O-N 3.35Å; E160-E162 PolarHBondContact O-N 3.01Å
161	E	39.7	Very low	34.9	Very low	184 Å²	184	150 Å²	150	86%	0.86	79%	0.79	S	S	*	*			trans	-57.5	126.2	166.5	-66.3	-175.8	153.6	0	0	110.3	E159 M163	E159-E161 PolarHBondContact O-N 3.23Å; E161-M163 PolarHBondContact O-N 2.87Å
162	E	46.6	Very low	35	Very low	171 Å²	171	151.2 Å²	151.2	80%	0.799	79%	0.786	S	S	*	*			trans	-66.5	91.8	180	-63.2	-176.8	163.6	0	0	110.4	E160 L164	E160-E162 PolarHBondContact O-N 3.01Å; E162-L164 HydrophobicContact CB-CG 4.41Å; E162-L164 PolarHBondContact O-N 3.29Å
163	M	42.1	Very low	35.5	Very low	189 Å²	189	156.8 Å²	156.8	93%	0.931	79%	0.791	S	S	*	*			trans	-64.5	82.3	158.9	-78	-155.3	-48	0	0	109.8	E161 S165	E161-M163 PolarHBondContact O-N 2.87Å; M163-S165 PolarHBondContact O-N 2.87Å
164	L	35.3	Very low	35.3	Very low	143 Å²	143	160.2 Å²	160.2	75%	0.749	80%	0.799	S	S	*	*			trans	-82.9	95.3	166.3	-74.1	172.6	0	0	0	110	E162	E162-L164 HydrophobicContact CB-CG 4.41Å; E162-L164 PolarHBondContact O-N 3.29Å
165	S	34.2	Very low	35.7	Very low	93 Å²	93	158.6 Å²	158.6	65%	0.65	80%	0.795	S	S	*	*			trans	55.7	79.9	134.2	-174.4	0	0	0	0	118	M163	M163-S165 PolarHBondContact O-N 2.87Å
166	S	36.6	Very low	36.4	Very low	134 Å²	134	158.1 Å²	158.1	94%	0.937	80%	0.795	S	S	*	*			trans	-87.8	99.1	146.5	-66.9	0	0	0	0	108.8
167	V	35	Very low	37	Very low	121 Å²	121	156.7 Å²	156.7	73%	0.733	79%	0.793	S	S	*	*			trans	-115.2	98.2	168.2	173.3	0	0	0	0	106.8
168	I	38.1	Very low	37.3	Very low	166 Å²	166	156 Å²	156	85%	0.851	80%	0.798	S	S	*	*			trans	-154.2	135.4	140.4	-62.1	-162.6	0	0	0	107.4
169	P	36.8	Very low	37.3	Very low	113 Å²	113	153.2 Å²	153.2	73%	0.734	79%	0.789	S	S	*	*			trans	-94.9	146.6	-160.2	36.1	-31	0	0	0	115.3
170	D	29.1	Very low	37.2	Very low	147 Å²	147	152.9 Å²	152.9	79%	0.786	79%	0.785	S	S	*	*			trans	25.7	116.6	132.4	-123	-14.1	0	0	0	120.1
171	S	36.7	Very low	37.4	Very low	96 Å²	96	151.6 Å²	151.6	67%	0.671	79%	0.789	S	S	*	*				149.4	108	114	-69.2	0	0	0	0	114.8
172	R	33.4	Very low	37.2	Very low	214 Å²	214	150 Å²	150	81%	0.808	78%	0.781	S	S	*	*				56.9	119.1	126.2	-65.5	-179	173	164	0.4	121.9
173	R	36.8	Very low	37.1	Very low	225 Å²	225	148.6 Å²	148.6	85%	0.849	78%	0.778	S	S	*	*			trans	63.5	106.8	136.8	-59.4	-173.3	-176.2	-170.6	0.4	116.9
174	E	30.1	Very low	37.1	Very low	173 Å²	173	145.6 Å²	145.6	81%	0.808	77%	0.765	S	S	*	*				51.5	102.4	79.5	-78.9	-171.8	164.7	0	0	115.2
175	N	35	Very low	37.8	Very low	134 Å²	134	147 Å²	147	72%	0.717	77%	0.768	S	S	*	*			trans	111.8	123.7	133.2	-64	0.1	0	0	0	119.8
176	E	37.9	Very low	38.2	Very low	177 Å²	177	150.8 Å²	150.8	83%	0.827	77%	0.773	S	S	*	*			trans	91.8	86.4	147.6	-68.6	174.5	-176.8	0	0	120.7
177	L	46.3	Very low	38.3	Very low	162 Å²	162	154.1 Å²	154.1	85%	0.848	77%	0.771	S	S	*	*			trans	50.9	134.6	132.5	-64.6	174	0	0	0	120.2
178	P	39.7	Very low	38.4	Very low	133 Å²	133	154.5 Å²	154.5	86%	0.864	77%	0.774	S	S	*	*				-143.8	177.3	77.7	37.1	-17.9	0	0	0	116.2
179	D	38.2	Very low	38.6	Very low	122 Å²	122	154.1 Å²	154.1	65%	0.652	77%	0.773	S	S	*	*			trans	-82	143.1	-157.6	-144.5	-5.8	0	0	0	115.7
180	F	35.3	Very low	38.7	Very low	175 Å²	175	155.4 Å²	155.4	77%	0.768	77%	0.774	S	S	*	*			trans	76.5	146.8	165.7	-60.3	-71.7	0	0	0	120.7
181	P	41.9	Very low	39.2	Very low	111 Å²	111	154.6 Å²	154.6	72%	0.721	78%	0.779	S	S	*	*			cis	-130	157.8	18.3	36.2	-16.7	0	0	0	117.6	I183	P181-I183 PolarHBondContact O-N 3.45Å
182	H	36.1	Very low	39.2	Very low	151 Å²	151	156 Å²	156	70%	0.699	78%	0.784	S	S	*	*			trans	-22.8	109.9	166	-165	54.1	0	0	0	116.5	D184	H182-D184 IonicContact CE1-OD1 3.73Å; H182-D184 IonicContact CE1-OD2 2.91Å; H182-D184 PolarHBondContact CE1-OD2 3.27Å; H182-D184 IonicContact ND1-OD1 3.92Å; H182-D184 IonicContact ND1-OD2 3.82Å; H182-D184 IonicContact NE2-OD2 3.41Å; H182-D184 PolarHBondContact NE2-OD2 2.77Å
183	I	44.6	Very low	39.7	Very low	142 Å²	142	151.3 Å²	151.3	73%	0.728	78%	0.781	S	S	*	*			trans	-107.6	79.8	167.5	-65.6	167.4	0	0	0	106.9	P181	P181-I183 PolarHBondContact O-N 3.45Å
184	D	42.9	Very low	40	Very low	125 Å²	125	146.6 Å²	146.6	67%	0.668	78%	0.783	S	S	*	*			trans	-99.3	65.2	161.7	-84	2.6	0	0	0	107.9	H182	H182-D184 IonicContact CE1-OD1 3.73Å; H182-D184 IonicContact CE1-OD2 2.91Å; H182-D184 PolarHBondContact CE1-OD2 3.27Å; H182-D184 IonicContact ND1-OD1 3.92Å; H182-D184 IonicContact ND1-OD2 3.82Å; H182-D184 IonicContact NE2-OD2 3.41Å; H182-D184 PolarHBondContact NE2-OD2 2.77Å
185	E	49.3	Very low	40.9	Very low	173 Å²	173	147.5 Å²	147.5	81%	0.808	78%	0.779	S	S	*	*	S	Bend	trans	-158.7	17	168.5	-124.7	173.4	-156.4	0	0	117.1
186	F	42.7	Very low	41.7	Very low	173 Å²	173	143.9 Å²	143.9	76%	0.759	76%	0.764	S	S	*	*	S	Bend	trans	-128.1	131.7	164.1	-107.3	-100	0	0	0	109.7
187	F	39.2	Very low	42.6	Very low	203 Å²	203	139.6 Å²	139.6	89%	0.89	76%	0.759	S	S	*	*			trans	92	40.3	-176.7	-51.9	-76.8	0	0	0	117.7
188	T	37	Very low	43	Very low	130 Å²	130	141 Å²	141	80%	0.798	76%	0.755	S	S	*	*			trans	-102.9	69.3	151.1	47.4	0	0	0	0	110.5
189	L	41.6	Very low	44.2	Very low	158 Å²	158	138.3 Å²	138.3	83%	0.827	73%	0.733	S	S	*	*	S	Bend	trans	-120.1	91.1	151.8	-71.2	179.7	0	0	0	108.2
190	N	38.2	Very low	46.2	Very low	140 Å²	140	139.2 Å²	139.2	75%	0.749	73%	0.733	S	S	*	*			trans	59.3	69.4	151.2	-55.3	-20.6	0	0	0	117.1	T192	N190-T192 PolarHBondContact O-N 3.22Å
191	S	41.5	Very low	48.5	Very low	130 Å²	130	134.5 Å²	134.5	91%	0.909	72%	0.72	S	S	*	*			trans	-61.9	110.5	145.7	-76.7	0	0	0	0	109.1
192	T	36.2	Very low	50.7	Low	125 Å²	125	135.3 Å²	135.3	77%	0.767	71%	0.714	S	S	*	*			trans	-115.3	150.5	163.4	46.9	0	0	0	0	109.1	N190	N190-T192 PolarHBondContact O-N 3.22Å
193	P	44.4	Very low	53.3	Low	116 Å²	116	131.9 Å²	131.9	75%	0.753	70%	0.7	S	S	*	*				-100.4	155.6	-123	35.8	-35.6	0	0	0	114.4	R195	P193-R195 PolarHBondContact O-N 2.84Å
194	S	42.4	Very low	55.6	Low	126 Å²	126	130.9 Å²	130.9	88%	0.881	70%	0.696	S	S	*	*			trans	34.3	74.9	153.2	-66.7	0	0	0	0	116.9
195	R	49.4	Very low	57.9	Low	191 Å²	191	129.3 Å²	129.3	72%	0.721	69%	0.691	S	S	*	*			trans	-80.1	130.1	149.3	-158.8	172.4	177.1	-139.4	0	107.2	P193 A197	P193-R195 PolarHBondContact O-N 2.84Å; R195-A197 PolarHBondContact O-N 3.35Å
196	S	51.3	Low	60.1	Low	58 Å²	58	125.3 Å²	125.3	41%	0.406	68%	0.675	S	S	.	*			trans	-60.2	132.2	-167	87	0	0	0	0	110.7	Y198 D199	S196-Y198 PolarHBondContact O-N 3.07Å; S196-D199 PolarHBondContact O-N 2.89Å; S196-D199 VanDerWaalsContact OG-CG 3.26Å; S196-D199 PolarHBondContact OG-OD2 2.96Å
197	A	56.8	Low	62.6	Low	88 Å²	88	121.1 Å²	121.1	73%	0.727	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	-7.5	179.5	0	0	0	0	0	113.8	R195	R195-A197 PolarHBondContact O-N 3.35Å
198	Y	55.1	Low	65.2	Low	192 Å²	192	115.6 Å²	115.6	75%	0.753	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-12.2	176.7	-65.1	-77.1	0	0	0	113.7	S196 H202	S196-Y198 PolarHBondContact O-N 3.07Å; Y198-H202 PolarHBondContact O-CD2 2.96Å
199	D	64.1	Low	68	Low	75 Å²	75	116.1 Å²	116.1	40%	0.401	63%	0.627	S	S	.	*	H	α-helix	trans	-80.2	-27.8	179.7	-67.2	-49	0	0	0	112.8	S196 L203	S196-D199 PolarHBondContact O-N 2.89Å; S196-D199 VanDerWaalsContact OG-CG 3.26Å; S196-D199 PolarHBondContact OG-OD2 2.96Å; D199-L203 WeakPolarHBondContact O-CB 3.38Å; D199-L203 PolarHBondContact O-N 3.36Å
200	E	80.3	Confident	70.6	Confident	141 Å²	141	114.5 Å²	114.5	66%	0.659	62%	0.616	S	S	*	*	H	α-helix	trans	-63.1	-49.9	-176.2	-159	85.5	-162.4	0	0	112.9	H202 L203 L204	E200-H202 PolarHBondContact O-N 3.36Å; E200-L203 PolarHBondContact O-N 3.46Å; E200-L204 PolarHBondContact O-N 3.47Å; E200-L204 VanDerWaalsContact O-N 3.08Å
201	P	84.1	Confident	73.4	Confident	76 Å²	76	113.5 Å²	113.5	49%	0.494	61%	0.605	S	S	.	*	H	α-helix	trans	-69.4	-36.7	-178.8	-16.6	32.4	0	0	0	112.2	L204 V205	P201-L204 PolarHBondContact O-N 2.99Å; P201-V205 VanDerWaalsContact O-CG2 3.3Å; P201-V205 WeakPolarHBondContact O-CG2 3.29Å; P201-V205 PolarHBondContact O-N 3.35Å
202	H	87.2	Confident	76	Confident	129 Å²	129	112 Å²	112	60%	0.597	59%	0.586	S	S	*	*	H	α-helix	trans	-65.9	-38.9	176.4	-83.6	-66	0	0	0	111.9	Y198 E200 V205 N206	Y198-H202 PolarHBondContact O-CD2 2.96Å; E200-H202 PolarHBondContact O-N 3.36Å; H202-V205 PolarHBondContact O-N 3.38Å; H202-N206 WeakPolarHBondContact O-CB 3.38Å; H202-N206 PolarHBondContact O-N 3.17Å; H202-N206 PolarHBondContact O-ND2 3.43Å
203	L	91.4	Very high	78.9	Confident	79 Å²	79	110.4 Å²	110.4	41%	0.414	57%	0.57	S	S	.	*	H	α-helix	trans	-63.1	-44.4	174.1	-176.5	60.7	0	0	0	111.4	D199 E200 V205 N206 I207	D199-L203 WeakPolarHBondContact O-CB 3.38Å; D199-L203 PolarHBondContact O-N 3.36Å; E200-L203 PolarHBondContact O-N 3.46Å; L203-V205 PolarHBondContact O-N 3.19Å; L203-N206 PolarHBondContact O-N 3.37Å; L203-I207 HydrophobicContact CD1-CD1 4.2Å; L203-I207 HydrophobicContact CD1-CG1 4.44Å; L203-I207 HydrophobicContact CG-CD1 3.96Å; L203-I207 VanDerWaalsContact O-CG1 3.3Å; L203-I207 WeakPolarHBondContact O-CG1 3.45Å; L203-I207 PolarHBondContact O-N 3Å
204	L	92	Very high	81.4	Confident	120 Å²	120	110.5 Å²	110.5	63%	0.628	56%	0.563	S	S	*	*	H	α-helix	trans	-62.6	-43	177.9	-172	61	0	0	0	112.2	E200 P201 N206 I207 E208	E200-L204 PolarHBondContact O-N 3.47Å; E200-L204 VanDerWaalsContact O-N 3.08Å; P201-L204 PolarHBondContact O-N 2.99Å; L204-N206 VanDerWaalsContact C-N 3.35Å; L204-N206 PolarHBondContact O-N 3.5Å; L204-I207 PolarHBondContact O-N 3.48Å; L204-E208 WeakPolarHBondContact O-CB 3.26Å; L204-E208 PolarHBondContact O-N 3.5Å
205	V	92.8	Very high	84	Confident	93 Å²	93	108 Å²	108	56%	0.564	54%	0.538	S	S	*	.	H	α-helix	trans	-63.4	-39.9	175.4	171.6	0	0	0	0	111.6	P201 H202 L203 E208 K209	P201-V205 VanDerWaalsContact O-CG2 3.3Å; P201-V205 WeakPolarHBondContact O-CG2 3.29Å; P201-V205 PolarHBondContact O-N 3.35Å; H202-V205 PolarHBondContact O-N 3.38Å; L203-V205 PolarHBondContact O-N 3.19Å; V205-E208 PolarHBondContact O-N 3.02Å; V205-K209 WeakPolarHBondContact O-CB 3.45Å; V205-K209 PolarHBondContact O-N 3.37Å
206	N	94.1	Very high	86.3	Confident	89 Å²	89	105.5 Å²	105.5	48%	0.476	53%	0.532	S	S	.	.	H	α-helix	trans	-66.3	-41.7	177.3	-74.4	-26.6	0	0	0	112.1	H202 L203 L204 K209 Q210	H202-N206 WeakPolarHBondContact O-CB 3.38Å; H202-N206 PolarHBondContact O-N 3.17Å; H202-N206 PolarHBondContact O-ND2 3.43Å; L203-N206 PolarHBondContact O-N 3.37Å; L204-N206 VanDerWaalsContact C-N 3.35Å; L204-N206 PolarHBondContact O-N 3.5Å; N206-K209 PolarHBondContact O-N 3.23Å; N206-Q210 WeakPolarHBondContact O-CG 3.31Å; N206-Q210 PolarHBondContact O-N 3.46Å
207	I	94.7	Very high	88.5	Confident	85 Å²	85	109.6 Å²	109.6	44%	0.436	54%	0.539	S	S	.	.	H	α-helix	trans	-63	-45.7	175.4	-69.3	167.6	0	0	0	110.2	L203 L204 K209 Q210 K211	L203-I207 HydrophobicContact CD1-CD1 4.2Å; L203-I207 HydrophobicContact CD1-CG1 4.44Å; L203-I207 HydrophobicContact CG-CD1 3.96Å; L203-I207 VanDerWaalsContact O-CG1 3.3Å; L203-I207 WeakPolarHBondContact O-CG1 3.45Å; L203-I207 PolarHBondContact O-N 3Å; L204-I207 PolarHBondContact O-N 3.48Å; I207-K209 VanDerWaalsContact C-N 3.34Å; I207-K209 PolarHBondContact O-N 2.81Å; I207-Q210 PolarHBondContact O-N 3.2Å; I207-K211 WeakPolarHBondContact O-CB 3.43Å; I207-K211 PolarHBondContact O-N 3.44Å
208	E	94.4	Very high	90.4	Very high	86 Å²	86	111.7 Å²	111.7	40%	0.402	53%	0.528	S	S	.	.	H	α-helix	trans	-65	-38.4	178.9	-167.9	60.8	-156.2	0	0	111.6	L204 V205 K211 L212	L204-E208 WeakPolarHBondContact O-CB 3.26Å; L204-E208 PolarHBondContact O-N 3.5Å; V205-E208 PolarHBondContact O-N 3.02Å; E208-K211 PolarHBondContact O-N 3.32Å; E208-K211 IonicContact OE1-NZ 2.84Å; E208-K211 IonicContact OE2-NZ 3.66Å; E208-L212 HydrophobicContact CG-CD1 4.46Å; E208-L212 WeakPolarHBondContact O-CB 3.49Å; E208-L212 WeakPolarHBondContact O-CG 3.38Å; E208-L212 PolarHBondContact O-N 2.96Å
209	K	95.8	Very high	92.3	Very high	141 Å²	141	106.8 Å²	106.8	61%	0.613	51%	0.514	S	S	*	.	H	α-helix	trans	-62.1	-43.7	173.1	-175.3	-178.7	177.8	-175.4	0	112.1	V205 N206 I207 L212 E213	V205-K209 WeakPolarHBondContact O-CB 3.45Å; V205-K209 PolarHBondContact O-N 3.37Å; N206-K209 PolarHBondContact O-N 3.23Å; I207-K209 VanDerWaalsContact C-N 3.34Å; I207-K209 PolarHBondContact O-N 2.81Å; K209-L212 PolarHBondContact O-N 3.05Å; K209-E213 PolarHBondContact O-N 2.84Å
210	Q	96.4	Very high	93.9	Very high	124 Å²	124	107.2 Å²	107.2	58%	0.579	52%	0.517	S	S	*	.	H	α-helix	trans	-64.2	-40.8	175.5	-76.3	-178.1	-28.6	0	0	111.7	N206 I207 E213 L214	N206-Q210 WeakPolarHBondContact O-CG 3.31Å; N206-Q210 PolarHBondContact O-N 3.46Å; I207-Q210 PolarHBondContact O-N 3.2Å; Q210-E213 PolarHBondContact O-N 3.23Å; Q210-L214 WeakPolarHBondContact O-CB 3.38Å; Q210-L214 WeakPolarHBondContact O-CG 3.49Å; Q210-L214 PolarHBondContact O-N 3.2Å
211	K	96.3	Very high	94.7	Very high	119 Å²	119	105.9 Å²	105.9	52%	0.517	51%	0.513	S	S	.	.	H	α-helix	trans	-61.9	-44.7	175.8	-176.2	-175.4	169.3	-160.1	0	111.6	I207 E208 L214 E215	I207-K211 WeakPolarHBondContact O-CB 3.43Å; I207-K211 PolarHBondContact O-N 3.44Å; E208-K211 PolarHBondContact O-N 3.32Å; E208-K211 IonicContact OE1-NZ 2.84Å; E208-K211 IonicContact OE2-NZ 3.66Å; K211-L214 PolarHBondContact O-N 2.76Å; K211-E215 WeakPolarHBondContact O-CB 3.48Å; K211-E215 PolarHBondContact O-N 3.28Å
212	L	97.2	Very high	95.2	Very high	99 Å²	99	107.2 Å²	107.2	52%	0.518	51%	0.512	S	S	.	.	H	α-helix	trans	-63.2	-39.2	174.4	-75.5	168.1	0	0	0	112.2	E208 K209 E215 K216	E208-L212 HydrophobicContact CG-CD1 4.46Å; E208-L212 WeakPolarHBondContact O-CB 3.49Å; E208-L212 WeakPolarHBondContact O-CG 3.38Å; E208-L212 PolarHBondContact O-N 2.96Å; K209-L212 PolarHBondContact O-N 3.05Å; L212-E215 PolarHBondContact O-N 3.09Å; L212-K216 WeakPolarHBondContact O-CB 3.35Å; L212-K216 PolarHBondContact O-N 2.73Å
213	E	97.5	Very high	95.6	Very high	92 Å²	92	104 Å²	104	43%	0.43	51%	0.508	S	S	.	.	H	α-helix	trans	-66	-43.2	175.7	-171.7	178.9	170.9	0	0	111.9	K209 Q210 E215 K216 R217	K209-E213 PolarHBondContact O-N 2.84Å; Q210-E213 PolarHBondContact O-N 3.23Å; E213-E215 VanDerWaalsContact C-N 3.34Å; E213-K216 PolarHBondContact O-N 3.49Å; E213-R217 WeakPolarHBondContact O-CG 3.49Å; E213-R217 PolarHBondContact O-N 2.95Å; E213-R217 IonicContact OE1-CZ 3.88Å; E213-R217 IonicContact OE1-NE 3.65Å; E213-R217 IonicContact OE1-NH2 2.97Å; E213-R217 PolarHBondContact OE1-NH2 3.02Å
214	L	97.2	Very high	95.8	Very high	118 Å²	118	106.5 Å²	106.5	62%	0.618	52%	0.517	S	S	*	.	H	α-helix	trans	-64	-39.4	174.9	-72.7	174.7	0	0	0	111.7	Q210 K211 R217 R218	Q210-L214 WeakPolarHBondContact O-CB 3.38Å; Q210-L214 WeakPolarHBondContact O-CG 3.49Å; Q210-L214 PolarHBondContact O-N 3.2Å; K211-L214 PolarHBondContact O-N 2.76Å; L214-R217 PolarHBondContact O-N 3Å; L214-R218 WeakPolarHBondContact O-CB 3.36Å; L214-R218 PolarHBondContact O-N 3.39Å
215	E	96.9	Very high	96	Very high	74 Å²	74	108.8 Å²	108.8	35%	0.346	52%	0.518	S	S	.	.	H	α-helix	trans	-65.4	-41	175.2	177.7	154.7	-132.8	0	0	112.1	K211 L212 E213 R218 L219	K211-E215 WeakPolarHBondContact O-CB 3.48Å; K211-E215 PolarHBondContact O-N 3.28Å; L212-E215 PolarHBondContact O-N 3.09Å; E213-E215 VanDerWaalsContact C-N 3.34Å; E215-R218 WeakPolarHBondContact O-CB 3.14Å; E215-R218 PolarHBondContact O-N 3.46Å; E215-R218 IonicContact OE1-CZ 3.65Å; E215-R218 IonicContact OE1-NH1 3.84Å; E215-R218 PolarHBondContact OE1-NH1 3.42Å; E215-R218 IonicContact OE1-NH2 2.71Å; E215-R218 PolarHBondContact OE1-NH2 3.17Å; E215-L219 HydrophobicContact CG-CD1 4.36Å; E215-L219 WeakPolarHBondContact O-CG 3.3Å; E215-L219 PolarHBondContact O-N 3.39Å
216	K	96.7	Very high	96.1	Very high	138 Å²	138	108.6 Å²	108.6	60%	0.6	51%	0.513	S	S	*	.	H	α-helix	trans	-59.9	-47.8	173.4	-175.5	-178.9	176	-175.3	0	111.4	L212 E213 R218 L219 D220	L212-K216 WeakPolarHBondContact O-CB 3.35Å; L212-K216 PolarHBondContact O-N 2.73Å; E213-K216 PolarHBondContact O-N 3.49Å; K216-R218 VanDerWaalsContact C-N 3.3Å; K216-R218 PolarHBondContact O-N 2.84Å; K216-L219 PolarHBondContact O-N 2.82Å; K216-L219 VanDerWaalsContact O-N 3.16Å; K216-D220 PolarHBondContact O-N 3.24Å
217	R	97.5	Very high	96.2	Very high	144 Å²	144	108.9 Å²	108.9	54%	0.543	51%	0.512	S	S	.	.	H	α-helix	trans	-61.1	-38	176.1	-69.2	-174.5	-168.5	-173.9	5.6	112.1	E213 L214 D220 I221	E213-R217 WeakPolarHBondContact O-CG 3.49Å; E213-R217 PolarHBondContact O-N 2.95Å; E213-R217 IonicContact OE1-CZ 3.88Å; E213-R217 IonicContact OE1-NE 3.65Å; E213-R217 IonicContact OE1-NH2 2.97Å; E213-R217 PolarHBondContact OE1-NH2 3.02Å; L214-R217 PolarHBondContact O-N 3Å; R217-D220 PolarHBondContact O-N 3.38Å; R217-I221 VanDerWaalsContact O-CG1 3.28Å; R217-I221 WeakPolarHBondContact O-CG1 3.39Å; R217-I221 PolarHBondContact O-N 3.41Å
218	R	96.6	Very high	96.2	Very high	132 Å²	132	109.4 Å²	109.4	50%	0.498	52%	0.518	S	S	.	.	H	α-helix	trans	-59	-47.6	174	-173.8	-165.5	75.9	-146.9	-7.2	110.9	L214 E215 K216 I221 E222	L214-R218 WeakPolarHBondContact O-CB 3.36Å; L214-R218 PolarHBondContact O-N 3.39Å; E215-R218 WeakPolarHBondContact O-CB 3.14Å; E215-R218 PolarHBondContact O-N 3.46Å; E215-R218 IonicContact OE1-CZ 3.65Å; E215-R218 IonicContact OE1-NH1 3.84Å; E215-R218 PolarHBondContact OE1-NH1 3.42Å; E215-R218 IonicContact OE1-NH2 2.71Å; E215-R218 PolarHBondContact OE1-NH2 3.17Å; K216-R218 VanDerWaalsContact C-N 3.3Å; K216-R218 PolarHBondContact O-N 2.84Å; R218-I221 PolarHBondContact O-N 3Å; R218-E222 WeakPolarHBondContact O-CB 3.38Å; R218-E222 PolarHBondContact O-N 3.14Å
219	L	96.4	Very high	95.9	Very high	88 Å²	88	109 Å²	109	46%	0.461	52%	0.516	S	S	.	.	H	α-helix	trans	-65.8	-38.6	179.9	-70.3	172.2	0	0	0	112.3	E215 K216 E222 A223	E215-L219 HydrophobicContact CG-CD1 4.36Å; E215-L219 WeakPolarHBondContact O-CG 3.3Å; E215-L219 PolarHBondContact O-N 3.39Å; K216-L219 PolarHBondContact O-N 2.82Å; K216-L219 VanDerWaalsContact O-N 3.16Å; L219-E222 PolarHBondContact O-N 3.43Å; L219-A223 WeakPolarHBondContact O-CB 3.48Å; L219-A223 PolarHBondContact O-N 2.93Å
220	D	97.2	Very high	95.6	Very high	85 Å²	85	107.9 Å²	107.9	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-63.3	-45.8	175.7	-68.7	-27.5	0	0	0	111	K216 R217 E222 A223 E224	K216-D220 PolarHBondContact O-N 3.24Å; R217-D220 PolarHBondContact O-N 3.38Å; D220-E222 VanDerWaalsContact C-N 3.32Å; D220-E222 PolarHBondContact O-N 2.9Å; D220-A223 PolarHBondContact O-N 3.42Å; D220-E224 WeakPolarHBondContact O-CG 3.4Å; D220-E224 PolarHBondContact O-N 3.03Å
221	I	97	Very high	95.3	Very high	113 Å²	113	106.8 Å²	106.8	58%	0.579	51%	0.507	S	S	*	.	H	α-helix	trans	-61.6	-39.9	175.1	-68.3	166.4	0	0	0	111.3	R217 R218 E224 R225	R217-I221 VanDerWaalsContact O-CG1 3.28Å; R217-I221 WeakPolarHBondContact O-CG1 3.39Å; R217-I221 PolarHBondContact O-N 3.41Å; R218-I221 PolarHBondContact O-N 3Å; I221-E224 PolarHBondContact O-N 3.32Å; I221-R225 WeakPolarHBondContact O-CB 3.29Å; I221-R225 PolarHBondContact O-N 3.45Å
222	E	95.1	Very high	95.1	Very high	103 Å²	103	108 Å²	108	48%	0.481	51%	0.508	S	S	.	.	H	α-helix	trans	-66.6	-39.5	177.8	-175.5	170.8	-162.3	0	0	112.1	R218 L219 D220 R225 L226	R218-E222 WeakPolarHBondContact O-CB 3.38Å; R218-E222 PolarHBondContact O-N 3.14Å; L219-E222 PolarHBondContact O-N 3.43Å; D220-E222 VanDerWaalsContact C-N 3.32Å; D220-E222 PolarHBondContact O-N 2.9Å; E222-R225 PolarHBondContact O-N 3.36Å; E222-L226 WeakPolarHBondContact O-CB 3.47Å; E222-L226 PolarHBondContact O-N 3.24Å
223	A	95.1	Very high	94.9	Very high	61 Å²	61	107 Å²	107	50%	0.504	50%	0.503	S	S	.	.	H	α-helix	trans	-63.8	-43.4	174.5	0	0	0	0	0	111.9	L219 D220 L226 Q227	L219-A223 WeakPolarHBondContact O-CB 3.48Å; L219-A223 PolarHBondContact O-N 2.93Å; D220-A223 PolarHBondContact O-N 3.42Å; A223-L226 PolarHBondContact O-N 3.26Å; A223-Q227 PolarHBondContact O-N 3.01Å
224	E	95.5	Very high	94.7	Very high	132 Å²	132	109.1 Å²	109.1	62%	0.617	51%	0.513	S	S	*	.	H	α-helix	trans	-62	-45.6	174	-73	-179.9	-179.3	0	0	111.7	D220 I221 L226 Q227 V228	D220-E224 WeakPolarHBondContact O-CG 3.4Å; D220-E224 PolarHBondContact O-N 3.03Å; I221-E224 PolarHBondContact O-N 3.32Å; E224-L226 VanDerWaalsContact C-N 3.31Å; E224-L226 PolarHBondContact O-N 2.91Å; E224-Q227 WeakPolarHBondContact O-CB 3.35Å; E224-Q227 PolarHBondContact O-N 2.94Å; E224-V228 WeakPolarHBondContact O-CG2 3.32Å; E224-V228 PolarHBondContact O-N 3.42Å
225	R	95	Very high	94.3	Very high	168 Å²	168	107.5 Å²	107.5	63%	0.634	50%	0.504	S	S	*	.	H	α-helix	trans	-56.7	-46.1	175.5	179.3	-171.2	165.9	-144.6	-8	111.2	I221 E222 Q227 V228 E229	I221-R225 WeakPolarHBondContact O-CB 3.29Å; I221-R225 PolarHBondContact O-N 3.45Å; E222-R225 PolarHBondContact O-N 3.36Å; R225-Q227 VanDerWaalsContact C-N 3.31Å; R225-Q227 PolarHBondContact O-N 2.95Å; R225-V228 PolarHBondContact O-N 3.32Å; R225-E229 WeakPolarHBondContact O-CB 3.46Å; R225-E229 PolarHBondContact O-N 3.14Å
226	L	95.9	Very high	93.7	Very high	89 Å²	89	108.6 Å²	108.6	47%	0.466	51%	0.509	S	S	.	.	H	α-helix	trans	-66.9	-34.2	-179.6	-174.9	63.7	0	0	0	111.9	E222 A223 E224 E229 K230	E222-L226 WeakPolarHBondContact O-CB 3.47Å; E222-L226 PolarHBondContact O-N 3.24Å; A223-L226 PolarHBondContact O-N 3.26Å; E224-L226 VanDerWaalsContact C-N 3.31Å; E224-L226 PolarHBondContact O-N 2.91Å; L226-E229 PolarHBondContact O-N 3.46Å; L226-K230 WeakPolarHBondContact O-CG 3.46Å; L226-K230 PolarHBondContact O-N 3.05Å
227	Q	96.4	Very high	93.2	Very high	95 Å²	95	109.4 Å²	109.4	44%	0.444	51%	0.512	S	S	.	.	H	α-helix	trans	-65.5	-46.8	173.7	178.6	61.5	8.3	0	0	111.7	A223 E224 R225 E229 K230 E231	A223-Q227 PolarHBondContact O-N 3.01Å; E224-Q227 WeakPolarHBondContact O-CB 3.35Å; E224-Q227 PolarHBondContact O-N 2.94Å; R225-Q227 VanDerWaalsContact C-N 3.31Å; R225-Q227 PolarHBondContact O-N 2.95Å; Q227-E229 VanDerWaalsContact C-N 3.27Å; Q227-E229 PolarHBondContact O-N 3.31Å; Q227-K230 WeakPolarHBondContact O-CB 3.38Å; Q227-K230 PolarHBondContact O-N 2.97Å; Q227-E231 PolarHBondContact NE2-OE1 3.46Å; Q227-E231 PolarHBondContact O-N 3.08Å
228	V	94.3	Very high	92.7	Very high	96 Å²	96	108.1 Å²	108.1	58%	0.582	51%	0.513	S	S	*	.	H	α-helix	trans	-60.3	-38.7	175.4	172.2	0	0	0	0	111.3	E224 R225 E231 R232	E224-V228 WeakPolarHBondContact O-CG2 3.32Å; E224-V228 PolarHBondContact O-N 3.42Å; R225-V228 PolarHBondContact O-N 3.32Å; V228-E231 PolarHBondContact O-N 3.19Å; V228-R232 WeakPolarHBondContact O-CB 3.47Å; V228-R232 PolarHBondContact O-N 3.44Å
229	E	89	Confident	92.2	Very high	77 Å²	77	108.3 Å²	108.3	36%	0.36	51%	0.513	S	S	.	.	H	α-helix	trans	-66.3	-39.5	176.3	-176.3	165.1	-157.4	0	0	112.7	R225 L226 Q227 R232 L233	R225-E229 WeakPolarHBondContact O-CB 3.46Å; R225-E229 PolarHBondContact O-N 3.14Å; L226-E229 PolarHBondContact O-N 3.46Å; Q227-E229 VanDerWaalsContact C-N 3.27Å; Q227-E229 PolarHBondContact O-N 3.31Å; E229-R232 WeakPolarHBondContact O-CB 3.39Å; E229-R232 PolarHBondContact O-N 3.07Å; E229-L233 HydrophobicContact CG-CD1 4.32Å; E229-L233 WeakPolarHBondContact O-CB 3.36Å; E229-L233 WeakPolarHBondContact O-CG 3.48Å; E229-L233 PolarHBondContact O-N 3.46Å
230	K	89.2	Confident	91.8	Very high	119 Å²	119	109 Å²	109	52%	0.517	52%	0.517	S	S	.	.	H	α-helix	trans	-62.2	-45.4	173.4	-75.4	173	-178	172.7	0	112	L226 Q227 R232 L233 Q234	L226-K230 WeakPolarHBondContact O-CG 3.46Å; L226-K230 PolarHBondContact O-N 3.05Å; Q227-K230 WeakPolarHBondContact O-CB 3.38Å; Q227-K230 PolarHBondContact O-N 2.97Å; K230-R232 VanDerWaalsContact C-N 3.35Å; K230-L233 PolarHBondContact O-N 3.16Å; K230-Q234 PolarHBondContact O-N 2.94Å
231	E	89.3	Confident	91.3	Very high	100 Å²	100	113.9 Å²	113.9	47%	0.467	53%	0.529	S	S	.	.	H	α-helix	trans	-63.3	-42.1	176.6	-72.1	176.1	-165.8	0	0	111.4	Q227 V228 L233 Q234 I235	Q227-E231 PolarHBondContact NE2-OE1 3.46Å; Q227-E231 PolarHBondContact O-N 3.08Å; V228-E231 PolarHBondContact O-N 3.19Å; E231-L233 PolarHBondContact O-N 3.43Å; E231-Q234 PolarHBondContact O-N 3.26Å; E231-I235 WeakPolarHBondContact O-CG1 3.44Å; E231-I235 PolarHBondContact O-N 3.44Å
232	R	92.1	Very high	90.6	Very high	144 Å²	144	113.7 Å²	113.7	54%	0.543	53%	0.526	S	S	.	.	H	α-helix	trans	-57.1	-48.5	173.4	-175.8	-151.4	157	-149.7	-15.4	111.2	V228 E229 K230 Q234 I235 E236	V228-R232 WeakPolarHBondContact O-CB 3.47Å; V228-R232 PolarHBondContact O-N 3.44Å; E229-R232 WeakPolarHBondContact O-CB 3.39Å; E229-R232 PolarHBondContact O-N 3.07Å; K230-R232 VanDerWaalsContact C-N 3.35Å; R232-Q234 VanDerWaalsContact C-N 3.29Å; R232-Q234 PolarHBondContact O-N 3.36Å; R232-I235 PolarHBondContact O-N 3.14Å; R232-E236 IonicContact CZ-OE2 3.43Å; R232-E236 IonicContact NE-OE2 3.69Å; R232-E236 IonicContact NH2-OE1 3.09Å; R232-E236 IonicContact NH2-OE2 3.19Å; R232-E236 PolarHBondContact NH2-OE2 3.08Å; R232-E236 WeakPolarHBondContact O-CB 3.44Å; R232-E236 PolarHBondContact O-N 2.91Å
233	L	93.7	Very high	90.1	Very high	79 Å²	79	113.5 Å²	113.5	41%	0.414	53%	0.527	S	S	.	.	H	α-helix	trans	-64.7	-33.5	179.2	-75.7	169.8	0	0	0	112.1	E229 K230 E231 E236 K237	E229-L233 HydrophobicContact CG-CD1 4.32Å; E229-L233 WeakPolarHBondContact O-CB 3.36Å; E229-L233 WeakPolarHBondContact O-CG 3.48Å; E229-L233 PolarHBondContact O-N 3.46Å; K230-L233 PolarHBondContact O-N 3.16Å; E231-L233 PolarHBondContact O-N 3.43Å; L233-E236 PolarHBondContact O-N 3.41Å; L233-K237 WeakPolarHBondContact O-CG 3.43Å; L233-K237 PolarHBondContact O-N 3.01Å
234	Q	92.8	Very high	89.4	Confident	136 Å²	136	114.9 Å²	114.9	64%	0.636	53%	0.526	S	S	*	.	H	α-helix	trans	-66.3	-44.4	174.9	-175.1	166.9	-11.6	0	0	111.9	K230 E231 R232 E236 K237 E238	K230-Q234 PolarHBondContact O-N 2.94Å; E231-Q234 PolarHBondContact O-N 3.26Å; R232-Q234 VanDerWaalsContact C-N 3.29Å; R232-Q234 PolarHBondContact O-N 3.36Å; Q234-E236 VanDerWaalsContact C-N 3.3Å; Q234-E236 PolarHBondContact O-N 2.99Å; Q234-K237 PolarHBondContact O-N 2.88Å; Q234-E238 PolarHBondContact O-N 3Å
235	I	88.2	Confident	88.8	Confident	84 Å²	84	114.2 Å²	114.2	43%	0.431	53%	0.525	S	S	.	.	H	α-helix	trans	-61.6	-39.9	173.8	-66	166.5	0	0	0	110.7	E231 R232 E238 R239	E231-I235 WeakPolarHBondContact O-CG1 3.44Å; E231-I235 PolarHBondContact O-N 3.44Å; R232-I235 PolarHBondContact O-N 3.14Å; I235-E238 PolarHBondContact O-N 3.39Å; I235-R239 HydrophobicContact CG2-CG 4.49Å; I235-R239 WeakPolarHBondContact O-CB 3.38Å; I235-R239 VanDerWaalsContact O-CG 3.28Å; I235-R239 WeakPolarHBondContact O-CG 3.42Å; I235-R239 PolarHBondContact O-N 3.44Å
236	E	85.4	Confident	88.1	Confident	97 Å²	97	110.6 Å²	110.6	45%	0.453	52%	0.515	S	S	.	.	H	α-helix	trans	-65.2	-40.4	177.8	-170.5	160.7	-174.1	0	0	112.1	R232 L233 Q234 R239 L240	R232-E236 IonicContact CZ-OE2 3.43Å; R232-E236 IonicContact NE-OE2 3.69Å; R232-E236 IonicContact NH2-OE1 3.09Å; R232-E236 IonicContact NH2-OE2 3.19Å; R232-E236 PolarHBondContact NH2-OE2 3.08Å; R232-E236 WeakPolarHBondContact O-CB 3.44Å; R232-E236 PolarHBondContact O-N 2.91Å; L233-E236 PolarHBondContact O-N 3.41Å; Q234-E236 VanDerWaalsContact C-N 3.3Å; Q234-E236 PolarHBondContact O-N 2.99Å; E236-R239 PolarHBondContact O-N 2.94Å; E236-L240 PolarHBondContact O-N 2.97Å
237	K	85.7	Confident	87.5	Confident	155 Å²	155	112.2 Å²	112.2	67%	0.674	52%	0.52	S	S	*	.	H	α-helix	trans	-63.1	-42.3	172.8	-75.8	178.2	178.3	-176.6	0	112.8	L233 Q234 L240 R241	L233-K237 WeakPolarHBondContact O-CG 3.43Å; L233-K237 PolarHBondContact O-N 3.01Å; Q234-K237 PolarHBondContact O-N 2.88Å; K237-L240 PolarHBondContact O-N 2.95Å; K237-R241 WeakPolarHBondContact O-CG 3.47Å; K237-R241 PolarHBondContact O-N 3.39Å
238	E	86.5	Confident	86.8	Confident	117 Å²	117	112.5 Å²	112.5	55%	0.547	52%	0.521	S	S	.	.	H	α-helix	trans	-65.7	-40.2	176.9	-175.2	173	-154.6	0	0	111.9	Q234 I235 L240 R241 H242	Q234-E238 PolarHBondContact O-N 3Å; I235-E238 PolarHBondContact O-N 3.39Å; E238-L240 VanDerWaalsContact C-N 3.33Å; E238-L240 PolarHBondContact O-N 3.42Å; E238-R241 WeakPolarHBondContact O-CB 3.28Å; E238-R241 PolarHBondContact O-N 2.9Å; E238-H242 PolarHBondContact O-CD2 3.39Å; E238-H242 PolarHBondContact O-N 3.23Å
239	R	85.9	Confident	86.3	Confident	137 Å²	137	114.2 Å²	114.2	52%	0.517	52%	0.517	S	S	.	.	H	α-helix	trans	-61	-41.7	173.2	-74.6	173.3	-179.6	-170.7	0.2	112.3	I235 E236 H242 L243	I235-R239 HydrophobicContact CG2-CG 4.49Å; I235-R239 WeakPolarHBondContact O-CB 3.38Å; I235-R239 VanDerWaalsContact O-CG 3.28Å; I235-R239 WeakPolarHBondContact O-CG 3.42Å; I235-R239 PolarHBondContact O-N 3.44Å; E236-R239 PolarHBondContact O-N 2.94Å; R239-H242 PolarHBondContact O-N 3.16Å; R239-L243 WeakPolarHBondContact O-CG 3.44Å; R239-L243 PolarHBondContact O-N 2.91Å
240	L	88.9	Confident	86.1	Confident	103 Å²	103	114.8 Å²	114.8	54%	0.539	52%	0.522	S	S	.	.	H	α-helix	trans	-63.8	-43.6	177.5	-168.8	62.7	0	0	0	111.1	E236 K237 E238 H242 L243 D244	E236-L240 PolarHBondContact O-N 2.97Å; K237-L240 PolarHBondContact O-N 2.95Å; E238-L240 VanDerWaalsContact C-N 3.33Å; E238-L240 PolarHBondContact O-N 3.42Å; L240-H242 VanDerWaalsContact C-N 3.3Å; L240-H242 PolarHBondContact O-N 3.27Å; L240-L243 WeakPolarHBondContact O-CB 3.19Å; L240-L243 PolarHBondContact O-N 3.23Å; L240-L243 VanDerWaalsContact O-N 3.1Å; L240-D244 PolarHBondContact O-N 2.91Å
241	R	86.1	Confident	86	Confident	186 Å²	186	114.8 Å²	114.8	70%	0.702	52%	0.524	S	S	*	.	H	α-helix	trans	-57.5	-41.4	173.5	-69	-111.4	-65.7	-142.7	-1.8	112.6	K237 E238 D244 M245	K237-R241 WeakPolarHBondContact O-CG 3.47Å; K237-R241 PolarHBondContact O-N 3.39Å; E238-R241 WeakPolarHBondContact O-CB 3.28Å; E238-R241 PolarHBondContact O-N 2.9Å; R241-D244 PolarHBondContact O-N 3.49Å; R241-M245 VanDerWaalsContact O-CG 3.31Å; R241-M245 WeakPolarHBondContact O-CG 3.38Å; R241-M245 PolarHBondContact O-N 3.48Å
242	H	81.5	Confident	85.6	Confident	110 Å²	110	114.8 Å²	114.8	51%	0.509	53%	0.526	S	S	.	.	H	α-helix	trans	-65.1	-39.9	175.4	-84.9	-54.2	0	0	0	112.9	E238 R239 L240 M245 E246	E238-H242 PolarHBondContact O-CD2 3.39Å; E238-H242 PolarHBondContact O-N 3.23Å; R239-H242 PolarHBondContact O-N 3.16Å; L240-H242 VanDerWaalsContact C-N 3.3Å; L240-H242 PolarHBondContact O-N 3.27Å; H242-M245 PolarHBondContact O-N 3.31Å; H242-E246 PolarHBondContact O-N 3.47Å
243	L	86.2	Confident	85.2	Confident	98 Å²	98	111.9 Å²	111.9	51%	0.513	52%	0.519	S	S	.	.	H	α-helix	trans	-64	-41.5	175.3	-72.7	170.2	0	0	0	111.7	R239 L240 M245 E246 H247	R239-L243 WeakPolarHBondContact O-CG 3.44Å; R239-L243 PolarHBondContact O-N 2.91Å; L240-L243 WeakPolarHBondContact O-CB 3.19Å; L240-L243 PolarHBondContact O-N 3.23Å; L240-L243 VanDerWaalsContact O-N 3.1Å; L243-M245 PolarHBondContact O-N 2.86Å; L243-E246 PolarHBondContact O-N 2.77Å; L243-H247 WeakPolarHBondContact O-CB 3.44Å; L243-H247 PolarHBondContact O-CD2 2.84Å; L243-H247 PolarHBondContact O-N 3.32Å
244	D	80.7	Confident	84.6	Confident	91 Å²	91	115.2 Å²	115.2	49%	0.487	53%	0.53	S	S	.	.	H	α-helix	trans	-62.1	-43.4	176.5	-66.5	-27.8	0	0	0	111.4	L240 R241 E246 H247 E248	L240-D244 PolarHBondContact O-N 2.91Å; R241-D244 PolarHBondContact O-N 3.49Å; D244-E246 PolarHBondContact O-N 3.46Å; D244-H247 PolarHBondContact O-N 3.4Å; D244-E248 PolarHBondContact O-N 2.96Å
245	M	81	Confident	84.1	Confident	118 Å²	118	113 Å²	113	58%	0.581	52%	0.52	S	S	*	.	H	α-helix	trans	-63.2	-40	175.1	-71	176	65.1	0	0	112.6	R241 H242 L243 R249	R241-M245 VanDerWaalsContact O-CG 3.31Å; R241-M245 WeakPolarHBondContact O-CG 3.38Å; R241-M245 PolarHBondContact O-N 3.48Å; H242-M245 PolarHBondContact O-N 3.31Å; L243-M245 PolarHBondContact O-N 2.86Å; M245-R249 WeakPolarHBondContact O-CB 3.44Å; M245-R249 PolarHBondContact O-N 3.14Å
246	E	81.2	Confident	83.9	Confident	91 Å²	91	116.1 Å²	116.1	43%	0.425	53%	0.526	S	S	.	.	H	α-helix	trans	-67.8	-37.6	174.9	-80.2	-64.8	140.3	0	0	111.9	H242 L243 D244 R249 L250	H242-E246 PolarHBondContact O-N 3.47Å; L243-E246 PolarHBondContact O-N 2.77Å; D244-E246 PolarHBondContact O-N 3.46Å; E246-R249 PolarHBondContact O-N 3.42Å; E246-R249 IonicContact OE1-NH1 2.82Å; E246-R249 IonicContact OE2-NH1 3.52Å; E246-R249 PolarHBondContact OE2-NH1 3.13Å; E246-L250 WeakPolarHBondContact O-CB 3.28Å; E246-L250 WeakPolarHBondContact O-CG 3.44Å; E246-L250 PolarHBondContact O-N 2.91Å
247	H	83.6	Confident	84	Confident	124 Å²	124	115.8 Å²	115.8	57%	0.574	53%	0.527	S	S	*	.	H	α-helix	trans	-62.9	-44.9	174	-79.6	-51.4	0	0	0	112	L243 D244 L250 Q251	L243-H247 WeakPolarHBondContact O-CB 3.44Å; L243-H247 PolarHBondContact O-CD2 2.84Å; L243-H247 PolarHBondContact O-N 3.32Å; D244-H247 PolarHBondContact O-N 3.4Å; H247-L250 PolarHBondContact O-N 3.48Å; H247-Q251 WeakPolarHBondContact O-CB 3.48Å; H247-Q251 PolarHBondContact O-N 2.96Å
248	E	82.1	Confident	84	Confident	100 Å²	100	114.3 Å²	114.3	47%	0.467	52%	0.523	S	S	.	.	H	α-helix	trans	-61	-44.3	174.1	-172.5	-179.8	-177.4	0	0	111.1	D244 L250 Q251 L252	D244-E248 PolarHBondContact O-N 2.96Å; E248-L250 PolarHBondContact O-N 3.49Å; E248-Q251 PolarHBondContact O-N 3.38Å; E248-L252 WeakPolarHBondContact O-CG 3.45Å; E248-L252 PolarHBondContact O-N 3.18Å
249	R	82	Confident	84	Confident	132 Å²	132	114.1 Å²	114.1	50%	0.498	52%	0.524	S	S	.	.	H	α-helix	trans	-59.2	-47	176.4	177.8	-178.8	165.1	-98.6	-16.5	112.3	M245 E246 Q251 L252 E253	M245-R249 WeakPolarHBondContact O-CB 3.44Å; M245-R249 PolarHBondContact O-N 3.14Å; E246-R249 PolarHBondContact O-N 3.42Å; E246-R249 IonicContact OE1-NH1 2.82Å; E246-R249 IonicContact OE2-NH1 3.52Å; E246-R249 PolarHBondContact OE2-NH1 3.13Å; R249-Q251 VanDerWaalsContact C-N 3.31Å; R249-Q251 PolarHBondContact O-N 3.01Å; R249-L252 PolarHBondContact O-N 3.35Å; R249-E253 PolarHBondContact O-N 3.48Å
250	L	86.1	Confident	84.1	Confident	89 Å²	89	111.5 Å²	111.5	47%	0.466	52%	0.518	S	S	.	.	H	α-helix	trans	-66	-34.1	178.2	-75.6	169.6	0	0	0	112.1	E246 H247 E248 E253 K254	E246-L250 WeakPolarHBondContact O-CB 3.28Å; E246-L250 WeakPolarHBondContact O-CG 3.44Å; E246-L250 PolarHBondContact O-N 2.91Å; H247-L250 PolarHBondContact O-N 3.48Å; E248-L250 PolarHBondContact O-N 3.49Å; L250-E253 PolarHBondContact O-N 3.41Å; L250-K254 WeakPolarHBondContact O-CB 3.41Å; L250-K254 PolarHBondContact O-N 2.88Å
251	Q	86.4	Confident	83.7	Confident	119 Å²	119	114.2 Å²	114.2	56%	0.556	52%	0.521	S	S	*	.	H	α-helix	trans	-65	-46.7	174.6	-177.5	174.1	-13.9	0	0	111.3	H247 E248 R249 E253 K254 E255	H247-Q251 WeakPolarHBondContact O-CB 3.48Å; H247-Q251 PolarHBondContact O-N 2.96Å; E248-Q251 PolarHBondContact O-N 3.38Å; R249-Q251 VanDerWaalsContact C-N 3.31Å; R249-Q251 PolarHBondContact O-N 3.01Å; Q251-E253 VanDerWaalsContact C-N 3.3Å; Q251-E253 PolarHBondContact O-N 3.49Å; Q251-K254 WeakPolarHBondContact O-CB 3.19Å; Q251-K254 PolarHBondContact O-N 3.48Å; Q251-E255 PolarHBondContact NE2-OE1 3.5Å; Q251-E255 WeakPolarHBondContact O-CG 3.42Å; Q251-E255 PolarHBondContact O-N 3.06Å
252	L	82.3	Confident	83.8	Confident	100 Å²	100	110.7 Å²	110.7	52%	0.524	51%	0.513	S	S	.	.	H	α-helix	trans	-61.8	-37.9	175.2	-68.7	173.1	0	0	0	112	E248 R249 E255 R256	E248-L252 WeakPolarHBondContact O-CG 3.45Å; E248-L252 PolarHBondContact O-N 3.18Å; R249-L252 PolarHBondContact O-N 3.35Å; L252-E255 PolarHBondContact O-N 3.24Å; L252-R256 WeakPolarHBondContact O-CB 3.4Å; L252-R256 PolarHBondContact O-N 3.01Å
253	E	83.5	Confident	84.1	Confident	83 Å²	83	112.6 Å²	112.6	39%	0.388	52%	0.519	S	S	.	.	H	α-helix	trans	-64.8	-41.7	174.8	-176.2	171.3	-165.4	0	0	112	R249 L250 Q251 R256 L257	R249-E253 PolarHBondContact O-N 3.48Å; L250-E253 PolarHBondContact O-N 3.41Å; Q251-E253 VanDerWaalsContact C-N 3.3Å; Q251-E253 PolarHBondContact O-N 3.49Å; E253-R256 WeakPolarHBondContact O-CB 3.3Å; E253-R256 PolarHBondContact O-N 3.24Å; E253-L257 HydrophobicContact CG-CD1 4.36Å; E253-L257 WeakPolarHBondContact O-CG 3.26Å; E253-L257 PolarHBondContact O-N 3.03Å
254	K	80.3	Confident	84.1	Confident	150 Å²	150	112.2 Å²	112.2	65%	0.652	52%	0.517	S	S	*	.	H	α-helix	trans	-62.7	-44.4	175.3	-175.5	-178	176.4	-174.3	0	111.7	L250 Q251 L257 Q258	L250-K254 WeakPolarHBondContact O-CB 3.41Å; L250-K254 PolarHBondContact O-N 2.88Å; Q251-K254 WeakPolarHBondContact O-CB 3.19Å; Q251-K254 PolarHBondContact O-N 3.48Å; K254-L257 PolarHBondContact O-N 3.49Å; K254-Q258 WeakPolarHBondContact O-CB 3.09Å; K254-Q258 PolarHBondContact O-N 3.35Å
255	E	81.7	Confident	84.4	Confident	89 Å²	89	115 Å²	115	42%	0.416	52%	0.521	S	S	.	.	H	α-helix	trans	-63.4	-43.3	175.4	-72.4	175.6	-166.9	0	0	111.4	Q251 L252 L257 Q258 I259	Q251-E255 PolarHBondContact NE2-OE1 3.5Å; Q251-E255 WeakPolarHBondContact O-CG 3.42Å; Q251-E255 PolarHBondContact O-N 3.06Å; L252-E255 PolarHBondContact O-N 3.24Å; E255-L257 PolarHBondContact O-N 3.26Å; E255-Q258 WeakPolarHBondContact O-CB 3.5Å; E255-Q258 PolarHBondContact O-N 2.79Å; E255-I259 WeakPolarHBondContact O-CG1 3.42Å; E255-I259 PolarHBondContact O-N 3.4Å
256	R	85.3	Confident	84.6	Confident	149 Å²	149	114 Å²	114	56%	0.562	52%	0.518	S	S	*	.	H	α-helix	trans	-56.4	-47.9	173.7	-179.7	-167.6	174.6	-74.8	-5.5	111.5	L252 E253 Q258 I259 E260	L252-R256 WeakPolarHBondContact O-CB 3.4Å; L252-R256 PolarHBondContact O-N 3.01Å; E253-R256 WeakPolarHBondContact O-CB 3.3Å; E253-R256 PolarHBondContact O-N 3.24Å; R256-Q258 VanDerWaalsContact C-N 3.32Å; R256-Q258 PolarHBondContact O-N 3.34Å; R256-I259 PolarHBondContact O-N 2.82Å; R256-E260 IonicContact CZ-OE2 2.92Å; R256-E260 IonicContact NH1-OE2 3.08Å; R256-E260 PolarHBondContact NH1-OE2 3.46Å; R256-E260 IonicContact NH2-OE2 2.95Å; R256-E260 WeakPolarHBondContact O-CB 3.46Å; R256-E260 PolarHBondContact O-N 2.96Å
257	L	86.8	Confident	84.7	Confident	90 Å²	90	115 Å²	115	47%	0.471	52%	0.522	S	S	.	.	H	α-helix	trans	-66.7	-33.4	178.9	-72.6	173.1	0	0	0	112.3	E253 K254 E255 E260 R261	E253-L257 HydrophobicContact CG-CD1 4.36Å; E253-L257 WeakPolarHBondContact O-CG 3.26Å; E253-L257 PolarHBondContact O-N 3.03Å; K254-L257 PolarHBondContact O-N 3.49Å; E255-L257 PolarHBondContact O-N 3.26Å; L257-E260 PolarHBondContact O-N 3.24Å; L257-R261 VanDerWaalsContact O-CB 3.31Å; L257-R261 WeakPolarHBondContact O-CB 3.39Å; L257-R261 PolarHBondContact O-N 3.06Å
258	Q	86	Confident	84.5	Confident	124 Å²	124	113.6 Å²	113.6	58%	0.579	52%	0.518	S	S	*	.	H	α-helix	trans	-65.6	-45.5	174.1	-178.5	169.3	-12.3	0	0	111.5	K254 E255 R256 E260 R261 E262	K254-Q258 WeakPolarHBondContact O-CB 3.09Å; K254-Q258 PolarHBondContact O-N 3.35Å; E255-Q258 WeakPolarHBondContact O-CB 3.5Å; E255-Q258 PolarHBondContact O-N 2.79Å; R256-Q258 VanDerWaalsContact C-N 3.32Å; R256-Q258 PolarHBondContact O-N 3.34Å; Q258-E260 VanDerWaalsContact C-N 3.33Å; Q258-E260 PolarHBondContact O-N 3Å; Q258-R261 PolarHBondContact O-N 3Å; Q258-E262 WeakPolarHBondContact O-CB 3.26Å; Q258-E262 PolarHBondContact O-N 3.1Å
259	I	87	Confident	84.4	Confident	114 Å²	114	113 Å²	113	59%	0.585	52%	0.521	S	S	*	.	H	α-helix	trans	-61.6	-42.7	174.2	-65.9	166.2	0	0	0	110.4	E255 R256 E262 K263	E255-I259 WeakPolarHBondContact O-CG1 3.42Å; E255-I259 PolarHBondContact O-N 3.4Å; R256-I259 PolarHBondContact O-N 2.82Å; I259-E262 PolarHBondContact O-N 3.36Å; I259-K263 VanDerWaalsContact O-CB 3.31Å; I259-K263 WeakPolarHBondContact O-CB 3.29Å; I259-K263 PolarHBondContact O-N 3.09Å
260	E	87.4	Confident	84.1	Confident	82 Å²	82	112.3 Å²	112.3	38%	0.383	53%	0.527	S	S	.	.	H	α-helix	trans	-62.6	-42.7	177.2	-173.5	169	-174.9	0	0	111.8	R256 L257 Q258 K263 L264	R256-E260 IonicContact CZ-OE2 2.92Å; R256-E260 IonicContact NH1-OE2 3.08Å; R256-E260 PolarHBondContact NH1-OE2 3.46Å; R256-E260 IonicContact NH2-OE2 2.95Å; R256-E260 WeakPolarHBondContact O-CB 3.46Å; R256-E260 PolarHBondContact O-N 2.96Å; L257-E260 PolarHBondContact O-N 3.24Å; Q258-E260 VanDerWaalsContact C-N 3.33Å; Q258-E260 PolarHBondContact O-N 3Å; E260-K263 PolarHBondContact O-N 3.12Å; E260-L264 WeakPolarHBondContact O-CG 3.36Å; E260-L264 PolarHBondContact O-N 3.38Å
261	R	81.4	Confident	83.4	Confident	160 Å²	160	112.6 Å²	112.6	60%	0.604	54%	0.537	S	S	*	.	H	α-helix	trans	-63	-41.4	174.5	-175.3	-178.8	-178.1	-170.8	2.5	112.2	L257 Q258 L264 R265	L257-R261 VanDerWaalsContact O-CB 3.31Å; L257-R261 WeakPolarHBondContact O-CB 3.39Å; L257-R261 PolarHBondContact O-N 3.06Å; Q258-R261 PolarHBondContact O-N 3Å; R261-L264 PolarHBondContact O-N 3.28Å; R261-R265 WeakPolarHBondContact O-CG 3.44Å; R261-R265 PolarHBondContact O-N 3.36Å
262	E	87.9	Confident	81.9	Confident	112 Å²	112	113.5 Å²	113.5	52%	0.523	54%	0.541	S	S	.	.	H	α-helix	trans	-68.2	-41.6	176.8	-170.3	178.5	175.5	0	0	111.6	Q258 I259 L264 R265 L266	Q258-E262 WeakPolarHBondContact O-CB 3.26Å; Q258-E262 PolarHBondContact O-N 3.1Å; I259-E262 PolarHBondContact O-N 3.36Å; E262-L264 VanDerWaalsContact C-N 3.32Å; E262-L264 PolarHBondContact O-N 3.23Å; E262-R265 WeakPolarHBondContact O-CB 3.4Å; E262-R265 PolarHBondContact O-N 3.35Å; E262-R265 VanDerWaalsContact O-N 3.13Å; E262-L266 WeakPolarHBondContact O-CG 3.42Å; E262-L266 PolarHBondContact O-N 2.79Å
263	K	87.5	Confident	80	Confident	149 Å²	149	116.6 Å²	116.6	65%	0.648	55%	0.55	S	S	*	.	H	α-helix	trans	-58.4	-43.9	173.7	-174.7	-179	178.2	-176.5	0	111.7	I259 E260 L266 Q267	I259-K263 VanDerWaalsContact O-CB 3.31Å; I259-K263 WeakPolarHBondContact O-CB 3.29Å; I259-K263 PolarHBondContact O-N 3.09Å; E260-K263 PolarHBondContact O-N 3.12Å; K263-L266 PolarHBondContact O-N 2.81Å; K263-Q267 WeakPolarHBondContact O-CB 3.41Å; K263-Q267 PolarHBondContact O-N 2.91Å
264	L	86.1	Confident	78	Confident	91 Å²	91	117.2 Å²	117.2	48%	0.476	56%	0.561	S	S	.	*	H	α-helix	trans	-64.7	-40.5	174.7	-73.5	171.5	0	0	0	111.9	E260 R261 E262 L266 Q267 I268	E260-L264 WeakPolarHBondContact O-CG 3.36Å; E260-L264 PolarHBondContact O-N 3.38Å; R261-L264 PolarHBondContact O-N 3.28Å; E262-L264 VanDerWaalsContact C-N 3.32Å; E262-L264 PolarHBondContact O-N 3.23Å; L264-L266 PolarHBondContact O-N 2.77Å; L264-Q267 PolarHBondContact O-N 2.94Å; L264-I268 VanDerWaalsContact O-CG1 3.32Å; L264-I268 WeakPolarHBondContact O-CG1 3.29Å; L264-I268 PolarHBondContact O-N 2.88Å
265	R	86.8	Confident	76	Confident	149 Å²	149	116 Å²	116	56%	0.562	57%	0.572	S	S	*	*	H	α-helix	trans	-58.6	-46.8	173.5	-78.4	176.1	168	-178.8	-5	111.9	R261 E262 Q267 I268 V269	R261-R265 WeakPolarHBondContact O-CG 3.44Å; R261-R265 PolarHBondContact O-N 3.36Å; E262-R265 WeakPolarHBondContact O-CB 3.4Å; E262-R265 PolarHBondContact O-N 3.35Å; E262-R265 VanDerWaalsContact O-N 3.13Å; R265-Q267 VanDerWaalsContact C-N 3.34Å; R265-Q267 PolarHBondContact O-N 2.84Å; R265-I268 PolarHBondContact O-N 3.36Å; R265-V269 WeakPolarHBondContact O-CG2 3.34Å; R265-V269 PolarHBondContact O-N 3.3Å
266	L	84	Confident	73.9	Confident	98 Å²	98	119.7 Å²	119.7	51%	0.513	59%	0.593	S	S	.	*	H	α-helix	trans	-65.3	-37.2	177.3	-68.7	173.7	0	0	0	112.1	E262 K263 L264 V269 N270	E262-L266 WeakPolarHBondContact O-CG 3.42Å; E262-L266 PolarHBondContact O-N 2.79Å; K263-L266 PolarHBondContact O-N 2.81Å; L264-L266 PolarHBondContact O-N 2.77Å; L266-V269 PolarHBondContact O-N 2.86Å; L266-N270 WeakPolarHBondContact O-CB 3.46Å; L266-N270 VanDerWaalsContact O-CG 3.29Å; L266-N270 PolarHBondContact O-N 3.15Å; L266-N270 PolarHBondContact O-ND2 3.43Å
267	Q	84.5	Confident	71.3	Confident	112 Å²	112	120.4 Å²	120.4	52%	0.523	60%	0.603	S	S	.	*	H	α-helix	trans	-64.7	-39.8	175.7	-173	176.3	1.6	0	0	112.2	K263 L264 R265 N270 S271	K263-Q267 WeakPolarHBondContact O-CB 3.41Å; K263-Q267 PolarHBondContact O-N 2.91Å; L264-Q267 PolarHBondContact O-N 2.94Å; R265-Q267 VanDerWaalsContact C-N 3.34Å; R265-Q267 PolarHBondContact O-N 2.84Å; Q267-N270 PolarHBondContact O-N 3.03Å; Q267-S271 WeakPolarHBondContact O-CB 3.31Å; Q267-S271 PolarHBondContact O-N 3.12Å; Q267-S271 PolarHBondContact O-OG 2.81Å
268	I	79.3	Confident	68.8	Low	93 Å²	93	122.5 Å²	122.5	48%	0.477	62%	0.615	S	S	.	*	H	α-helix	trans	-63	-50.9	174.1	-67.6	164.8	0	0	0	109.8	L264 R265 N270 S271 E272	L264-I268 VanDerWaalsContact O-CG1 3.32Å; L264-I268 WeakPolarHBondContact O-CG1 3.29Å; L264-I268 PolarHBondContact O-N 2.88Å; R265-I268 PolarHBondContact O-N 3.36Å; I268-N270 VanDerWaalsContact C-N 3.28Å; I268-N270 PolarHBondContact O-N 3.08Å; I268-S271 CarbonylContact O-C 3.57Å; I268-S271 PolarHBondContact O-N 3.27Å; I268-E272 HydrophobicContact CG2-CG 4.16Å; I268-E272 WeakPolarHBondContact O-CB 3.46Å; I268-E272 WeakPolarHBondContact O-CG 3.32Å; I268-E272 PolarHBondContact O-N 3.15Å
269	V	79.6	Confident	66.1	Low	88 Å²	88	124.6 Å²	124.6	53%	0.533	63%	0.625	S	S	.	*	H	α-helix	trans	-59.7	-37.2	179	173.3	0	0	0	0	112.2	R265 L266 E272 K273	R265-V269 WeakPolarHBondContact O-CG2 3.34Å; R265-V269 PolarHBondContact O-N 3.3Å; L266-V269 PolarHBondContact O-N 2.86Å; V269-E272 CarbonylContact O-C 3.59Å; V269-E272 PolarHBondContact O-N 3.34Å; V269-K273 PolarHBondContact O-N 3.2Å
270	N	75.7	Confident	63.4	Low	117 Å²	117	126.7 Å²	126.7	63%	0.626	64%	0.636	S	S	*	*	H	α-helix	trans	-71.6	-29.2	175.7	-75.5	-21.3	0	0	0	113.2	L266 Q267 I268	L266-N270 WeakPolarHBondContact O-CB 3.46Å; L266-N270 VanDerWaalsContact O-CG 3.29Å; L266-N270 PolarHBondContact O-N 3.15Å; L266-N270 PolarHBondContact O-ND2 3.43Å; Q267-N270 PolarHBondContact O-N 3.03Å; I268-N270 VanDerWaalsContact C-N 3.28Å; I268-N270 PolarHBondContact O-N 3.08Å
271	S	71.3	Confident	60.5	Low	95 Å²	95	126.3 Å²	126.3	66%	0.664	65%	0.654	S	S	*	*	H	α-helix	trans	-81.6	-27.8	175.8	-50.7	0	0	0	0	111.8	Q267 I268 K273	Q267-S271 WeakPolarHBondContact O-CB 3.31Å; Q267-S271 PolarHBondContact O-N 3.12Å; Q267-S271 PolarHBondContact O-OG 2.81Å; I268-S271 CarbonylContact O-C 3.57Å; I268-S271 PolarHBondContact O-N 3.27Å; S271-K273 VanDerWaalsContact C-N 3.29Å; S271-K273 PolarHBondContact O-N 2.86Å
272	E	55.6	Low	58.2	Low	139 Å²	139	128.6 Å²	128.6	65%	0.65	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	23.3	174.5	-68.5	-176.8	166.5	0	0	113.2	I268 V269 P274	I268-E272 HydrophobicContact CG2-CG 4.16Å; I268-E272 WeakPolarHBondContact O-CB 3.46Å; I268-E272 WeakPolarHBondContact O-CG 3.32Å; I268-E272 PolarHBondContact O-N 3.15Å; V269-E272 CarbonylContact O-C 3.59Å; V269-E272 PolarHBondContact O-N 3.34Å; E272-P274 WeakPolarHBondContact O-CD 3.49Å
273	K	42	Very low	55.4	Low	164 Å²	164	126.6 Å²	126.6	71%	0.713	68%	0.682	S	S	*	*			trans	-89.4	79.1	155.8	-97.7	-178.7	174	172.8	0	108.9	V269 S271	V269-K273 PolarHBondContact O-N 3.2Å; S271-K273 VanDerWaalsContact C-N 3.29Å; S271-K273 PolarHBondContact O-N 2.86Å
274	P	41	Very low	52.8	Low	96 Å²	96	127.6 Å²	127.6	62%	0.623	69%	0.688	S	S	*	*			trans	-75.4	137.4	165.5	34.9	-33.5	0	0	0	108.1	E272 L276	E272-P274 WeakPolarHBondContact O-CD 3.49Å; P274-L276 VanDerWaalsContact C-N 3.3Å; P274-L276 PolarHBondContact O-N 3.49Å
275	S	40	Very low	50.6	Low	125 Å²	125	132.1 Å²	132.1	87%	0.874	70%	0.704	S	S	*	*			trans	-6.4	76.8	145.6	-50.5	0	0	0	0	116
276	L	36.2	Very low	48.1	Very low	166 Å²	166	130.4 Å²	130.4	87%	0.869	72%	0.715	S	S	*	*			trans	-111.6	88.5	154.7	-81.6	170.3	0	0	0	106.3	P274	P274-L276 VanDerWaalsContact C-N 3.3Å; P274-L276 PolarHBondContact O-N 3.49Å
277	E	32	Very low	45.8	Very low	165 Å²	165	133.3 Å²	133.3	77%	0.771	73%	0.728	S	S	*	*			trans	-33.3	144.4	157.7	-130.8	169.7	174.6	0	0	113
278	N	32.8	Very low	43.6	Very low	133 Å²	133	132.8 Å²	132.8	71%	0.711	73%	0.728	S	S	*	*			trans	45.2	105.4	141.9	-74	-10.9	0	0	0	117.4
279	E	30.6	Very low	41.5	Very low	169 Å²	169	134 Å²	134	79%	0.79	73%	0.732	S	S	*	*				172	129.7	101.3	-77.8	-128.8	134.4	0	0	110.6
280	L	29.3	Very low	40.3	Very low	158 Å²	158	134.6 Å²	134.6	83%	0.827	74%	0.737	S	S	*	*			trans	54.2	94.4	142.4	-66.7	158	0	0	0	118.2
281	G	27.5	Very low	39.1	Very low	74 Å²	74	136 Å²	136	76%	0.763	74%	0.74	S	S	*	*			trans	-174	86.8	157.5	0	0	0	0	0	110.9	G283	G281-G283 PolarHBondContact O-N 3.43Å
282	Q	32.5	Very low	38.9	Very low	207 Å²	207	134.7 Å²	134.7	97%	0.967	73%	0.726	S	S	*	*			trans	-59.4	89.6	164.2	-72.6	-174.9	-42.2	0	0	109.1
283	G	29.8	Very low	39.7	Very low	71 Å²	71	131.7 Å²	131.7	73%	0.732	71%	0.714	S	S	*	*			trans	-130.9	74.4	165.4	0	0	0	0	0	106.6	G281	G281-G283 PolarHBondContact O-N 3.43Å
284	E	32.1	Very low	41.1	Very low	169 Å²	169	129.7 Å²	129.7	79%	0.79	71%	0.707	S	S	*	*			trans	-57.3	151.9	174.6	-64.6	-175.8	130.1	0	0	111.5
285	K	39.8	Very low	42.3	Very low	186 Å²	186	129.1 Å²	129.1	81%	0.809	70%	0.702	S	S	*	*			trans	84.6	83.9	164.6	-60.2	173.9	179.6	171.3	0	116.9
286	S	33.5	Very low	44.2	Very low	113 Å²	113	128 Å²	128	79%	0.79	68%	0.683	S	S	*	*				177	54.6	114.9	-73.1	0	0	0	0	109.2	L288	S286-L288 VanDerWaalsContact C-N 3.28Å; S286-L288 PolarHBondContact O-N 2.92Å
287	M	37.2	Very low	46.2	Very low	159 Å²	159	126.8 Å²	126.8	78%	0.783	67%	0.67	S	S	*	*			trans	-84.7	85.8	163.3	-170.1	151.8	-176.8	0	0	104.6	Q289	M287-Q289 PolarHBondContact O-N 3.46Å
288	L	37.3	Very low	48.5	Very low	102 Å²	102	122.9 Å²	122.9	53%	0.534	65%	0.654	S	S	.	*			trans	-52.1	106.8	178.6	-73.4	165.4	0	0	0	107	S286 D292	S286-L288 VanDerWaalsContact C-N 3.28Å; S286-L288 PolarHBondContact O-N 2.92Å; L288-D292 WeakPolarHBondContact CA-OD2 3.46Å; L288-D292 HydrophobicContact CB-CB 4.13Å; L288-D292 HydrophobicContact CD2-CB 3.56Å; L288-D292 HydrophobicContact CG-CB 4.46Å
289	Q	36.5	Very low	51	Low	119 Å²	119	123.3 Å²	123.3	56%	0.556	65%	0.65	S	S	*	*			trans	-63.1	152.5	177	-74.6	-77.9	-25.1	0	0	106.6	M287 Q291 D292 I293	M287-Q289 PolarHBondContact O-N 3.46Å; Q289-Q291 PolarHBondContact O-N 3.24Å; Q289-D292 PolarHBondContact N-OD2 3.24Å; Q289-D292 WeakPolarHBondContact O-CA 3.34Å; Q289-D292 WeakPolarHBondContact O-CB 3.49Å; Q289-D292 PolarHBondContact O-N 3.37Å; Q289-I293 PolarHBondContact O-N 3.36Å
290	P	52.7	Low	53.7	Low	99 Å²	99	119.9 Å²	119.9	64%	0.643	64%	0.636	S	S	*	*	H	α-helix	trans	-49.9	-28.1	178.2	-27.5	34	0	0	0	113.8	I293 E294	P290-I293 PolarHBondContact O-N 3.49Å; P290-E294 PolarHBondContact O-N 3.4Å; P290-E294 VanDerWaalsContact O-N 3.1Å
291	Q	51.9	Low	56.3	Low	147 Å²	147	117.6 Å²	117.6	69%	0.687	62%	0.621	S	S	*	*	H	α-helix	trans	-65.6	-35.5	174.3	-156.8	173.4	-6.6	0	0	113.1	Q289 E294 T295	Q289-Q291 PolarHBondContact O-N 3.24Å; Q291-E294 PolarHBondContact O-N 3.17Å; Q291-T295 WeakPolarHBondContact O-CG2 3.4Å; Q291-T295 PolarHBondContact O-N 2.86Å
292	D	65.9	Low	58.9	Low	67 Å²	67	122.9 Å²	122.9	36%	0.358	62%	0.618	S	S	.	*	H	α-helix	trans	-67.5	-41.6	174.7	-60.7	-46	0	0	0	110.7	L288 Q289 E294 T295 E296	L288-D292 WeakPolarHBondContact CA-OD2 3.46Å; L288-D292 HydrophobicContact CB-CB 4.13Å; L288-D292 HydrophobicContact CD2-CB 3.56Å; L288-D292 HydrophobicContact CG-CB 4.46Å; Q289-D292 PolarHBondContact N-OD2 3.24Å; Q289-D292 WeakPolarHBondContact O-CA 3.34Å; Q289-D292 WeakPolarHBondContact O-CB 3.49Å; Q289-D292 PolarHBondContact O-N 3.37Å; D292-E294 VanDerWaalsContact C-N 3.29Å; D292-E294 PolarHBondContact O-N 2.92Å; D292-T295 WeakPolarHBondContact CA-OG1 3.47Å; D292-T295 PolarHBondContact O-N 3.38Å; D292-T295 PolarHBondContact O-OG1 2.86Å; D292-E296 WeakPolarHBondContact O-CB 3.38Å; D292-E296 PolarHBondContact O-N 3.5Å
293	I	72.4	Confident	61.4	Low	77 Å²	77	118 Å²	118	40%	0.395	60%	0.595	S	S	.	*	H	α-helix	trans	-61.5	-39.6	175.9	-58.6	174.3	0	0	0	110.6	Q289 P290 E296 K297	Q289-I293 PolarHBondContact O-N 3.36Å; P290-I293 PolarHBondContact O-N 3.49Å; I293-E296 PolarHBondContact O-N 3.28Å; I293-K297 HydrophobicContact CG2-CD 4.34Å; I293-K297 WeakPolarHBondContact O-CB 3.36Å; I293-K297 VanDerWaalsContact O-CG 3.29Å; I293-K297 WeakPolarHBondContact O-CG 3.05Å; I293-K297 PolarHBondContact O-N 2.94Å
294	E	71.8	Confident	64.3	Low	122 Å²	122	121.7 Å²	121.7	57%	0.57	59%	0.587	S	S	*	*	H	α-helix	trans	-66.3	-41.5	176.1	-168.9	171.2	-158.2	0	0	111.8	P290 Q291 D292 E296 K297 L298	P290-E294 PolarHBondContact O-N 3.4Å; P290-E294 VanDerWaalsContact O-N 3.1Å; Q291-E294 PolarHBondContact O-N 3.17Å; D292-E294 VanDerWaalsContact C-N 3.29Å; D292-E294 PolarHBondContact O-N 2.92Å; E294-E296 VanDerWaalsContact C-N 3.34Å; E294-E296 PolarHBondContact O-N 2.94Å; E294-K297 PolarHBondContact O-N 2.73Å; E294-L298 WeakPolarHBondContact O-CG 3.45Å; E294-L298 PolarHBondContact O-N 3.06Å
295	T	67.5	Low	66.9	Low	84 Å²	84	118 Å²	118	52%	0.515	57%	0.573	S	S	.	*	H	α-helix	trans	-64.6	-37.9	175.4	67.6	0	0	0	0	112.5	Q291 D292 L298 K299	Q291-T295 WeakPolarHBondContact O-CG2 3.4Å; Q291-T295 PolarHBondContact O-N 2.86Å; D292-T295 WeakPolarHBondContact CA-OG1 3.47Å; D292-T295 PolarHBondContact O-N 3.38Å; D292-T295 PolarHBondContact O-OG1 2.86Å; T295-L298 PolarHBondContact O-N 3.29Å; T295-K299 WeakPolarHBondContact O-CB 3.32Å; T295-K299 PolarHBondContact O-N 2.89Å
296	E	78.7	Confident	69.1	Low	102 Å²	102	113.5 Å²	113.5	48%	0.477	56%	0.555	S	S	.	*	H	α-helix	trans	-70.3	-40.7	177.2	-169.6	172.4	-164.7	0	0	111.5	D292 I293 E294 L298 K299 L300	D292-E296 WeakPolarHBondContact O-CB 3.38Å; D292-E296 PolarHBondContact O-N 3.5Å; I293-E296 PolarHBondContact O-N 3.28Å; E294-E296 VanDerWaalsContact C-N 3.34Å; E294-E296 PolarHBondContact O-N 2.94Å; E296-L298 PolarHBondContact O-N 2.74Å; E296-K299 WeakPolarHBondContact O-CB 3.5Å; E296-K299 PolarHBondContact O-N 3.2Å; E296-K299 VanDerWaalsContact O-N 3.16Å; E296-L300 HydrophobicContact CG-CD1 4.44Å; E296-L300 WeakPolarHBondContact O-CG 3.44Å; E296-L300 PolarHBondContact O-N 2.94Å
297	K	78.2	Confident	71.9	Confident	139 Å²	139	113.2 Å²	113.2	60%	0.604	54%	0.543	S	S	*	.	H	α-helix	trans	-58.7	-46.4	171.5	-78.6	176.4	179.2	179	0	111.9	I293 E294 K299 L300 E301	I293-K297 HydrophobicContact CG2-CD 4.34Å; I293-K297 WeakPolarHBondContact O-CB 3.36Å; I293-K297 VanDerWaalsContact O-CG 3.29Å; I293-K297 WeakPolarHBondContact O-CG 3.05Å; I293-K297 PolarHBondContact O-N 2.94Å; E294-K297 PolarHBondContact O-N 2.73Å; K297-K299 VanDerWaalsContact C-N 3.27Å; K297-K299 PolarHBondContact O-N 2.88Å; K297-L300 PolarHBondContact O-N 3.28Å; K297-E301 WeakPolarHBondContact O-CB 3.34Å; K297-E301 PolarHBondContact O-N 3.27Å
298	L	79.7	Confident	74.3	Confident	84 Å²	84	109.6 Å²	109.6	44%	0.44	53%	0.525	S	S	.	.	H	α-helix	trans	-63.6	-33.5	176.4	-74.9	170.5	0	0	0	112.1	E294 T295 E296 R302	E294-L298 WeakPolarHBondContact O-CG 3.45Å; E294-L298 PolarHBondContact O-N 3.06Å; T295-L298 PolarHBondContact O-N 3.29Å; E296-L298 PolarHBondContact O-N 2.74Å; L298-R302 WeakPolarHBondContact O-CG 3.27Å; L298-R302 PolarHBondContact O-N 3.4Å
299	K	87.1	Confident	76.7	Confident	142 Å²	142	110.9 Å²	110.9	62%	0.617	53%	0.526	S	S	*	.	H	α-helix	trans	-67.6	-47.3	174	-175	-173.9	173.4	-168.1	0	111.5	T295 E296 K297 E301 R302 E303	T295-K299 WeakPolarHBondContact O-CB 3.32Å; T295-K299 PolarHBondContact O-N 2.89Å; E296-K299 WeakPolarHBondContact O-CB 3.5Å; E296-K299 PolarHBondContact O-N 3.2Å; E296-K299 VanDerWaalsContact O-N 3.16Å; K297-K299 VanDerWaalsContact C-N 3.27Å; K297-K299 PolarHBondContact O-N 2.88Å; K299-E301 VanDerWaalsContact C-N 3.31Å; K299-E301 PolarHBondContact O-N 2.95Å; K299-R302 WeakPolarHBondContact O-CB 3.29Å; K299-R302 PolarHBondContact O-N 2.9Å; K299-E303 PolarHBondContact O-N 2.7Å
300	L	85.7	Confident	79.2	Confident	97 Å²	97	108.6 Å²	108.6	51%	0.508	52%	0.518	S	S	.	.	H	α-helix	trans	-63.9	-36.5	176.9	-70.5	172.6	0	0	0	111.8	E296 K297 E303 R304	E296-L300 HydrophobicContact CG-CD1 4.44Å; E296-L300 WeakPolarHBondContact O-CG 3.44Å; E296-L300 PolarHBondContact O-N 2.94Å; K297-L300 PolarHBondContact O-N 3.28Å; L300-E303 PolarHBondContact O-N 2.71Å; L300-R304 VanDerWaalsContact O-CB 3.31Å; L300-R304 WeakPolarHBondContact O-CB 3.35Å; L300-R304 PolarHBondContact O-N 3.45Å
301	E	85.3	Confident	81	Confident	109 Å²	109	111.6 Å²	111.6	51%	0.509	52%	0.516	S	S	.	.	H	α-helix	trans	-67.3	-40.1	174.9	-174.5	173	-158.5	0	0	111.9	K297 K299 R304 L305	K297-E301 WeakPolarHBondContact O-CB 3.34Å; K297-E301 PolarHBondContact O-N 3.27Å; K299-E301 VanDerWaalsContact C-N 3.31Å; K299-E301 PolarHBondContact O-N 2.95Å; E301-R304 PolarHBondContact O-N 3.24Å; E301-L305 HydrophobicContact CG-CD1 4.3Å; E301-L305 WeakPolarHBondContact O-CB 3.37Å; E301-L305 VanDerWaalsContact O-CG 3.32Å; E301-L305 WeakPolarHBondContact O-CG 3.48Å; E301-L305 PolarHBondContact O-N 3.43Å
302	R	80.7	Confident	82.9	Confident	185 Å²	185	109.7 Å²	109.7	70%	0.698	51%	0.51	S	S	*	.	H	α-helix	trans	-62.3	-42.9	171.7	-77.1	179.1	-167.6	162.4	5.4	112.2	L298 K299 L305 Q306	L298-R302 WeakPolarHBondContact O-CG 3.27Å; L298-R302 PolarHBondContact O-N 3.4Å; K299-R302 WeakPolarHBondContact O-CB 3.29Å; K299-R302 PolarHBondContact O-N 2.9Å; R302-L305 PolarHBondContact O-N 2.86Å; R302-Q306 WeakPolarHBondContact O-CB 3.1Å; R302-Q306 PolarHBondContact O-N 3.21Å
303	E	85.9	Confident	83.8	Confident	104 Å²	104	111.3 Å²	111.3	49%	0.486	52%	0.515	S	S	.	.	H	α-helix	trans	-65.4	-43.6	176.9	-173.8	175	179.5	0	0	111.4	K299 L300 L305 Q306 L307	K299-E303 PolarHBondContact O-N 2.7Å; L300-E303 PolarHBondContact O-N 2.71Å; E303-L305 VanDerWaalsContact C-N 3.34Å; E303-L305 PolarHBondContact O-N 3.4Å; E303-Q306 PolarHBondContact O-N 3.33Å; E303-L307 HydrophobicContact CG-CD1 4.37Å; E303-L307 WeakPolarHBondContact O-CG 3.28Å; E303-L307 PolarHBondContact O-N 3.37Å
304	R	89.9	Confident	84.7	Confident	149 Å²	149	114.1 Å²	114.1	56%	0.562	53%	0.525	S	S	*	.	H	α-helix	trans	-55.7	-48.5	172	-179.9	-164.4	175.6	-79.2	-9	111.2	L300 E301 Q306 L307 E308	L300-R304 VanDerWaalsContact O-CB 3.31Å; L300-R304 WeakPolarHBondContact O-CB 3.35Å; L300-R304 PolarHBondContact O-N 3.45Å; E301-R304 PolarHBondContact O-N 3.24Å; R304-Q306 VanDerWaalsContact C-N 3.31Å; R304-Q306 PolarHBondContact O-N 3.45Å; R304-L307 PolarHBondContact O-N 2.89Å; R304-E308 IonicContact CZ-OE2 3.04Å; R304-E308 IonicContact NH1-OE2 2.73Å; R304-E308 PolarHBondContact NH1-OE2 3.3Å; R304-E308 IonicContact NH2-OE2 3.62Å; R304-E308 WeakPolarHBondContact O-CB 3.43Å; R304-E308 PolarHBondContact O-N 3.31Å
305	L	87.9	Confident	85.6	Confident	93 Å²	93	112.3 Å²	112.3	49%	0.487	52%	0.519	S	S	.	.	H	α-helix	trans	-64.6	-35.5	178.8	-77.6	169	0	0	0	112	E301 R302 E303 K309	E301-L305 HydrophobicContact CG-CD1 4.3Å; E301-L305 WeakPolarHBondContact O-CB 3.37Å; E301-L305 VanDerWaalsContact O-CG 3.32Å; E301-L305 WeakPolarHBondContact O-CG 3.48Å; E301-L305 PolarHBondContact O-N 3.43Å; R302-L305 PolarHBondContact O-N 2.86Å; E303-L305 VanDerWaalsContact C-N 3.34Å; E303-L305 PolarHBondContact O-N 3.4Å; L305-K309 WeakPolarHBondContact O-CB 3.3Å; L305-K309 PolarHBondContact O-N 3.44Å
306	Q	86.2	Confident	86.6	Confident	91 Å²	91	115.2 Å²	115.2	43%	0.425	52%	0.524	S	S	.	.	H	α-helix	trans	-67.4	-45.6	175.1	-174.9	57.1	50.9	0	0	111.3	R302 E303 R304 E308 K309 D310	R302-Q306 WeakPolarHBondContact O-CB 3.1Å; R302-Q306 PolarHBondContact O-N 3.21Å; E303-Q306 PolarHBondContact O-N 3.33Å; R304-Q306 VanDerWaalsContact C-N 3.31Å; R304-Q306 PolarHBondContact O-N 3.45Å; Q306-E308 VanDerWaalsContact C-N 3.32Å; Q306-E308 PolarHBondContact O-N 3.29Å; Q306-K309 WeakPolarHBondContact O-CB 3.5Å; Q306-K309 PolarHBondContact O-N 2.83Å; Q306-D310 PolarHBondContact NE2-OD1 3.27Å; Q306-D310 PolarHBondContact NE2-OD2 3.03Å; Q306-D310 VanDerWaalsContact O-CG 3.25Å; Q306-D310 PolarHBondContact O-N 3.34Å
307	L	90.9	Very high	87.3	Confident	106 Å²	106	116.1 Å²	116.1	56%	0.555	53%	0.527	S	S	*	.	H	α-helix	trans	-63.2	-37.9	175.2	-71.1	172.1	0	0	0	112.1	E303 R304 D310 R311	E303-L307 HydrophobicContact CG-CD1 4.37Å; E303-L307 WeakPolarHBondContact O-CG 3.28Å; E303-L307 PolarHBondContact O-N 3.37Å; R304-L307 PolarHBondContact O-N 2.89Å; L307-D310 PolarHBondContact O-N 2.98Å; L307-R311 VanDerWaalsContact O-CB 3.27Å; L307-R311 WeakPolarHBondContact O-CB 3.48Å; L307-R311 PolarHBondContact O-N 3.3Å
308	E	89.1	Confident	87.8	Confident	83 Å²	83	114.8 Å²	114.8	39%	0.388	52%	0.523	S	S	.	.	H	α-helix	trans	-64.8	-40.7	174.7	-174.6	166.3	-166.8	0	0	111.4	R304 Q306 R311 L312	R304-E308 IonicContact CZ-OE2 3.04Å; R304-E308 IonicContact NH1-OE2 2.73Å; R304-E308 PolarHBondContact NH1-OE2 3.3Å; R304-E308 IonicContact NH2-OE2 3.62Å; R304-E308 WeakPolarHBondContact O-CB 3.43Å; R304-E308 PolarHBondContact O-N 3.31Å; Q306-E308 VanDerWaalsContact C-N 3.32Å; Q306-E308 PolarHBondContact O-N 3.29Å; E308-R311 PolarHBondContact O-N 3.43Å; E308-L312 HydrophobicContact CG-CD1 4.5Å; E308-L312 WeakPolarHBondContact O-CB 3.48Å; E308-L312 VanDerWaalsContact O-CG 3.31Å; E308-L312 WeakPolarHBondContact O-CG 3.45Å; E308-L312 PolarHBondContact O-N 2.86Å
309	K	87.6	Confident	88.2	Confident	129 Å²	129	114.2 Å²	114.2	56%	0.561	53%	0.526	S	S	*	.	H	α-helix	trans	-63.2	-44.9	173.5	-176.1	-177.6	174.9	-174.4	0	112.1	L305 Q306 L312 Q313	L305-K309 WeakPolarHBondContact O-CB 3.3Å; L305-K309 PolarHBondContact O-N 3.44Å; Q306-K309 WeakPolarHBondContact O-CB 3.5Å; Q306-K309 PolarHBondContact O-N 2.83Å; K309-L312 PolarHBondContact O-N 3.24Å; K309-Q313 PolarHBondContact O-N 3.46Å
310	D	87.9	Confident	88.3	Confident	72 Å²	72	112.4 Å²	112.4	39%	0.385	52%	0.52	S	S	.	.	H	α-helix	trans	-66.7	-40.1	178.9	-65.4	-17.5	0	0	0	111.1	Q306 L307 Q313 F314	Q306-D310 PolarHBondContact NE2-OD1 3.27Å; Q306-D310 PolarHBondContact NE2-OD2 3.03Å; Q306-D310 VanDerWaalsContact O-CG 3.25Å; Q306-D310 PolarHBondContact O-N 3.34Å; L307-D310 PolarHBondContact O-N 2.98Å; D310-Q313 PolarHBondContact O-N 3.16Å; D310-F314 PolarHBondContact O-N 2.94Å
311	R	90.9	Very high	88.6	Confident	161 Å²	161	114.9 Å²	114.9	61%	0.608	53%	0.526	S	S	*	.	H	α-helix	trans	-59.9	-46.1	172.2	179.9	177.9	168.3	165.7	1.8	111.3	L307 E308 Q313 F314 L315	L307-R311 VanDerWaalsContact O-CB 3.27Å; L307-R311 WeakPolarHBondContact O-CB 3.48Å; L307-R311 PolarHBondContact O-N 3.3Å; E308-R311 PolarHBondContact O-N 3.43Å; R311-Q313 VanDerWaalsContact C-N 3.33Å; R311-Q313 PolarHBondContact O-N 2.95Å; R311-F314 WeakPolarHBondContact O-CB 3.2Å; R311-F314 PolarHBondContact O-N 3.37Å; R311-L315 HydrophobicContact CG-CD1 3.86Å; R311-L315 WeakPolarHBondContact O-CD1 3.29Å; R311-L315 PolarHBondContact O-N 2.91Å
312	L	91.4	Very high	88.8	Confident	108 Å²	108	115 Å²	115	57%	0.565	53%	0.53	S	S	*	.	H	α-helix	trans	-63.5	-38	176.7	-75.9	170.3	0	0	0	112.4	E308 K309 L315 K316	E308-L312 HydrophobicContact CG-CD1 4.5Å; E308-L312 WeakPolarHBondContact O-CB 3.48Å; E308-L312 VanDerWaalsContact O-CG 3.31Å; E308-L312 WeakPolarHBondContact O-CG 3.45Å; E308-L312 PolarHBondContact O-N 2.86Å; K309-L312 PolarHBondContact O-N 3.24Å; L312-L315 PolarHBondContact O-N 2.92Å; L312-K316 WeakPolarHBondContact O-CB 3.42Å; L312-K316 PolarHBondContact O-N 3.35Å
313	Q	86.2	Confident	89.2	Confident	100 Å²	100	110.8 Å²	110.8	47%	0.467	52%	0.518	S	S	.	.	H	α-helix	trans	-64.8	-41.2	174.8	-172.8	176.4	-12.1	0	0	111.4	K309 D310 R311 K316 F317	K309-Q313 PolarHBondContact O-N 3.46Å; D310-Q313 PolarHBondContact O-N 3.16Å; R311-Q313 VanDerWaalsContact C-N 3.33Å; R311-Q313 PolarHBondContact O-N 2.95Å; Q313-K316 PolarHBondContact O-N 3.33Å; Q313-F317 HydrophobicContact CG-CD2 3.98Å; Q313-F317 HydrophobicContact CG-CE2 3.65Å; Q313-F317 WeakPolarHBondContact O-CD2 3.4Å; Q313-F317 PolarHBondContact O-N 3.32Å
314	F	90.8	Very high	89.4	Confident	136 Å²	136	110.6 Å²	110.6	60%	0.596	52%	0.519	S	S	*	.	H	α-helix	trans	-61.5	-47.8	174.4	-174.6	-91.1	0	0	0	111.9	D310 R311 K316 F317 E318	D310-F314 PolarHBondContact O-N 2.94Å; R311-F314 WeakPolarHBondContact O-CB 3.2Å; R311-F314 PolarHBondContact O-N 3.37Å; F314-K316 VanDerWaalsContact C-N 3.27Å; F314-K316 PolarHBondContact O-N 3.3Å; F314-F317 PolarHBondContact O-N 3.02Å; F314-E318 WeakPolarHBondContact O-CB 3.46Å; F314-E318 PolarHBondContact O-N 2.95Å
315	L	91.2	Very high	89.5	Confident	84 Å²	84	108.2 Å²	108.2	44%	0.44	52%	0.515	S	S	.	.	H	α-helix	trans	-59.4	-38.2	176.2	-92.2	79	0	0	0	112.1	R311 L312 E318 S319	R311-L315 HydrophobicContact CG-CD1 3.86Å; R311-L315 WeakPolarHBondContact O-CD1 3.29Å; R311-L315 PolarHBondContact O-N 2.91Å; L312-L315 PolarHBondContact O-N 2.92Å; L315-E318 PolarHBondContact O-N 3.48Å; L315-S319 WeakPolarHBondContact O-CB 3.4Å; L315-S319 PolarHBondContact O-N 3.45Å; L315-S319 PolarHBondContact O-OG 2.97Å
316	K	88.1	Confident	89.6	Confident	145 Å²	145	110.6 Å²	110.6	63%	0.63	52%	0.521	S	S	*	.	H	α-helix	trans	-62.8	-48	175.8	-172.8	-178.8	176.3	-175.4	0	111.2	L312 Q313 F314 E318 S319 E320	L312-K316 WeakPolarHBondContact O-CB 3.42Å; L312-K316 PolarHBondContact O-N 3.35Å; Q313-K316 PolarHBondContact O-N 3.33Å; F314-K316 VanDerWaalsContact C-N 3.27Å; F314-K316 PolarHBondContact O-N 3.3Å; K316-E318 VanDerWaalsContact C-N 3.33Å; K316-E318 PolarHBondContact O-N 2.71Å; K316-S319 PolarHBondContact O-N 3.41Å; K316-S319 PolarHBondContact O-OG 3.19Å; K316-E320 PolarHBondContact O-N 2.97Å
317	F	92.6	Very high	89.9	Confident	121 Å²	121	111.4 Å²	111.4	53%	0.531	53%	0.525	S	S	.	.	H	α-helix	trans	-62.4	-39.8	175.9	-78.9	-60.8	0	0	0	112.7	Q313 F314 E320 K321	Q313-F317 HydrophobicContact CG-CD2 3.98Å; Q313-F317 HydrophobicContact CG-CE2 3.65Å; Q313-F317 WeakPolarHBondContact O-CD2 3.4Å; Q313-F317 PolarHBondContact O-N 3.32Å; F314-F317 PolarHBondContact O-N 3.02Å; F317-E320 PolarHBondContact O-N 3.48Å; F317-K321 VanDerWaalsContact O-CB 3.3Å; F317-K321 WeakPolarHBondContact O-CB 3.41Å; F317-K321 PolarHBondContact O-N 2.94Å
318	E	89	Confident	90	Very high	111 Å²	111	114.5 Å²	114.5	52%	0.519	53%	0.529	S	S	.	.	H	α-helix	trans	-64.4	-42	177.2	-170.9	172.8	-158	0	0	111.4	F314 L315 K316 K321 L322	F314-E318 WeakPolarHBondContact O-CB 3.46Å; F314-E318 PolarHBondContact O-N 2.95Å; L315-E318 PolarHBondContact O-N 3.48Å; K316-E318 VanDerWaalsContact C-N 3.33Å; K316-E318 PolarHBondContact O-N 2.71Å; E318-K321 PolarHBondContact O-N 3Å; E318-L322 WeakPolarHBondContact O-CB 3.37Å; E318-L322 PolarHBondContact O-N 3.37Å
319	S	87.2	Confident	90.1	Very high	72 Å²	72	115.2 Å²	115.2	50%	0.503	54%	0.535	S	S	.	.	H	α-helix	trans	-64.3	-40	175.4	72.9	0	0	0	0	112.8	L315 K316 L322 Q323	L315-S319 WeakPolarHBondContact O-CB 3.4Å; L315-S319 PolarHBondContact O-N 3.45Å; L315-S319 PolarHBondContact O-OG 2.97Å; K316-S319 PolarHBondContact O-N 3.41Å; K316-S319 PolarHBondContact O-OG 3.19Å; S319-L322 PolarHBondContact O-N 2.93Å; S319-Q323 WeakPolarHBondContact O-CB 3.34Å; S319-Q323 PolarHBondContact O-N 2.98Å
320	E	89.5	Confident	90.3	Very high	104 Å²	104	113.4 Å²	113.4	49%	0.486	53%	0.529	S	S	.	.	H	α-helix	trans	-67	-43.6	176	-178	173.1	-165.9	0	0	111.3	K316 F317 L322 Q323 I324	K316-E320 PolarHBondContact O-N 2.97Å; F317-E320 PolarHBondContact O-N 3.48Å; E320-L322 VanDerWaalsContact C-N 3.34Å; E320-L322 PolarHBondContact O-N 3.49Å; E320-Q323 WeakPolarHBondContact O-CB 3.36Å; E320-Q323 PolarHBondContact O-N 2.84Å; E320-I324 HydrophobicContact CG-CD1 4.33Å; E320-I324 WeakPolarHBondContact O-CG1 3.34Å; E320-I324 PolarHBondContact O-N 3.06Å
321	K	92	Very high	90.5	Very high	150 Å²	150	114.9 Å²	114.9	65%	0.652	54%	0.54	S	S	*	.	H	α-helix	trans	-60.1	-44.2	174.9	-176.4	-178.1	176.3	-173.7	0	111.5	F317 E318 Q323 I324 E325	F317-K321 VanDerWaalsContact O-CB 3.3Å; F317-K321 WeakPolarHBondContact O-CB 3.41Å; F317-K321 PolarHBondContact O-N 2.94Å; E318-K321 PolarHBondContact O-N 3Å; K321-Q323 VanDerWaalsContact C-N 3.31Å; K321-Q323 PolarHBondContact O-N 3.43Å; K321-I324 PolarHBondContact O-N 3.34Å; K321-E325 WeakPolarHBondContact O-CB 3.41Å; K321-E325 PolarHBondContact O-N 3.39Å
322	L	90.1	Very high	90.6	Very high	112 Å²	112	111.4 Å²	111.4	59%	0.586	53%	0.531	S	S	*	.	H	α-helix	trans	-65.2	-36	178	-170.8	67.3	0	0	0	111.8	E318 S319 E320 E325 K326	E318-L322 WeakPolarHBondContact O-CB 3.37Å; E318-L322 PolarHBondContact O-N 3.37Å; S319-L322 PolarHBondContact O-N 2.93Å; E320-L322 VanDerWaalsContact C-N 3.34Å; E320-L322 PolarHBondContact O-N 3.49Å; L322-E325 PolarHBondContact O-N 3.25Å; L322-K326 WeakPolarHBondContact O-CB 3.43Å; L322-K326 PolarHBondContact O-N 3.49Å
323	Q	89.9	Confident	90.6	Very high	95 Å²	95	112.2 Å²	112.2	44%	0.444	53%	0.53	S	S	.	.	H	α-helix	trans	-64.5	-45.6	174.3	-179.8	62.4	19.6	0	0	111.5	S319 E320 K321 E325 K326 E327	S319-Q323 WeakPolarHBondContact O-CB 3.34Å; S319-Q323 PolarHBondContact O-N 2.98Å; E320-Q323 WeakPolarHBondContact O-CB 3.36Å; E320-Q323 PolarHBondContact O-N 2.84Å; K321-Q323 VanDerWaalsContact C-N 3.31Å; K321-Q323 PolarHBondContact O-N 3.43Å; Q323-E325 VanDerWaalsContact C-N 3.31Å; Q323-E325 PolarHBondContact O-N 2.89Å; Q323-K326 WeakPolarHBondContact O-CB 3.02Å; Q323-K326 PolarHBondContact O-N 3.14Å; Q323-E327 PolarHBondContact NE2-OE1 2.99Å; Q323-E327 WeakPolarHBondContact O-CG 3.3Å; Q323-E327 PolarHBondContact O-N 2.84Å
324	I	88.8	Confident	90.8	Very high	101 Å²	101	110.1 Å²	110.1	52%	0.518	52%	0.522	S	S	.	.	H	α-helix	trans	-61.2	-41.3	174.8	-66.3	166	0	0	0	110.7	E320 K321 E327 R328	E320-I324 HydrophobicContact CG-CD1 4.33Å; E320-I324 WeakPolarHBondContact O-CG1 3.34Å; E320-I324 PolarHBondContact O-N 3.06Å; K321-I324 PolarHBondContact O-N 3.34Å; I324-E327 PolarHBondContact O-N 3Å; I324-R328 WeakPolarHBondContact O-CB 3.36Å; I324-R328 PolarHBondContact O-N 3.46Å
325	E	91.9	Very high	90.7	Very high	98 Å²	98	111.3 Å²	111.3	46%	0.458	52%	0.522	S	S	.	.	H	α-helix	trans	-64.1	-40.6	177.3	-175.1	169.8	-154.2	0	0	112	K321 L322 Q323 R328 L329	K321-E325 WeakPolarHBondContact O-CB 3.41Å; K321-E325 PolarHBondContact O-N 3.39Å; L322-E325 PolarHBondContact O-N 3.25Å; Q323-E325 VanDerWaalsContact C-N 3.31Å; Q323-E325 PolarHBondContact O-N 2.89Å; E325-R328 PolarHBondContact O-N 3.41Å; E325-L329 HydrophobicContact CG-CD1 4.33Å; E325-L329 WeakPolarHBondContact O-CB 3.46Å; E325-L329 WeakPolarHBondContact O-CG 3.33Å; E325-L329 PolarHBondContact O-N 2.94Å
326	K	90.3	Very high	90.6	Very high	143 Å²	143	111.5 Å²	111.5	62%	0.622	52%	0.523	S	S	*	.	H	α-helix	trans	-63.1	-43.9	174.3	-173.8	-179.2	178	-176.2	0	111.9	L322 Q323 L329 Q330	L322-K326 WeakPolarHBondContact O-CB 3.43Å; L322-K326 PolarHBondContact O-N 3.49Å; Q323-K326 WeakPolarHBondContact O-CB 3.02Å; Q323-K326 PolarHBondContact O-N 3.14Å; K326-L329 PolarHBondContact O-N 2.88Å; K326-Q330 WeakPolarHBondContact O-CB 3.41Å; K326-Q330 PolarHBondContact O-N 3.39Å
327	E	91.7	Very high	90.6	Very high	108 Å²	108	111 Å²	111	51%	0.505	52%	0.517	S	S	.	.	H	α-helix	trans	-64	-42.5	175.2	-74.6	174.7	-163.8	0	0	111.5	Q323 I324 L329 Q330 V331	Q323-E327 PolarHBondContact NE2-OE1 2.99Å; Q323-E327 WeakPolarHBondContact O-CG 3.3Å; Q323-E327 PolarHBondContact O-N 2.84Å; I324-E327 PolarHBondContact O-N 3Å; E327-L329 PolarHBondContact O-N 3.16Å; E327-Q330 WeakPolarHBondContact O-CB 3.49Å; E327-Q330 PolarHBondContact O-N 2.99Å; E327-V331 WeakPolarHBondContact O-CG2 3.3Å; E327-V331 PolarHBondContact O-N 3.46Å
328	R	93.1	Very high	90.3	Very high	171 Å²	171	110.7 Å²	110.7	65%	0.645	52%	0.52	S	S	*	.	H	α-helix	trans	-58.9	-47.8	174.9	-177.3	-170.9	173.2	-155.5	-3.4	111.6	I324 E325 Q330 V331 E332	I324-R328 WeakPolarHBondContact O-CB 3.36Å; I324-R328 PolarHBondContact O-N 3.46Å; E325-R328 PolarHBondContact O-N 3.41Å; R328-Q330 VanDerWaalsContact C-N 3.29Å; R328-Q330 PolarHBondContact O-N 3.28Å; R328-V331 PolarHBondContact O-N 3.37Å; R328-E332 WeakPolarHBondContact O-CB 3.5Å; R328-E332 PolarHBondContact O-N 3.36Å
329	L	92.9	Very high	90	Very high	98 Å²	98	110 Å²	110	51%	0.513	52%	0.517	S	S	.	.	H	α-helix	trans	-63.9	-35.9	177.8	-75.9	170.3	0	0	0	111.8	E325 K326 E327 E332 K333	E325-L329 HydrophobicContact CG-CD1 4.33Å; E325-L329 WeakPolarHBondContact O-CB 3.46Å; E325-L329 WeakPolarHBondContact O-CG 3.33Å; E325-L329 PolarHBondContact O-N 2.94Å; K326-L329 PolarHBondContact O-N 2.88Å; E327-L329 PolarHBondContact O-N 3.16Å; L329-E332 PolarHBondContact O-N 3.49Å; L329-K333 VanDerWaalsContact O-CB 3.3Å; L329-K333 WeakPolarHBondContact O-CB 3.47Å; L329-K333 PolarHBondContact O-N 3.49Å
330	Q	91	Very high	89.8	Confident	91 Å²	91	114 Å²	114	43%	0.425	53%	0.525	S	S	.	.	H	α-helix	trans	-65.6	-46.2	174.9	-176.3	56.7	44.1	0	0	111.3	K326 E327 R328 E332 K333 D334	K326-Q330 WeakPolarHBondContact O-CB 3.41Å; K326-Q330 PolarHBondContact O-N 3.39Å; E327-Q330 WeakPolarHBondContact O-CB 3.49Å; E327-Q330 PolarHBondContact O-N 2.99Å; R328-Q330 VanDerWaalsContact C-N 3.29Å; R328-Q330 PolarHBondContact O-N 3.28Å; Q330-E332 VanDerWaalsContact C-N 3.33Å; Q330-E332 PolarHBondContact O-N 2.84Å; Q330-K333 WeakPolarHBondContact O-CB 3.26Å; Q330-K333 PolarHBondContact O-N 3.27Å; Q330-D334 PolarHBondContact NE2-OD1 3.08Å; Q330-D334 PolarHBondContact NE2-OD2 2.97Å; Q330-D334 PolarHBondContact O-N 3.02Å
331	V	92.2	Very high	89.4	Confident	103 Å²	103	114.8 Å²	114.8	62%	0.624	53%	0.529	S	S	*	.	H	α-helix	trans	-61.5	-40.7	175.1	171.9	0	0	0	0	111.5	E327 R328 D334 R335	E327-V331 WeakPolarHBondContact O-CG2 3.3Å; E327-V331 PolarHBondContact O-N 3.46Å; R328-V331 PolarHBondContact O-N 3.37Å; V331-D334 PolarHBondContact O-N 3.5Å; V331-R335 WeakPolarHBondContact O-CB 3.48Å; V331-R335 PolarHBondContact O-N 3.08Å
332	E	92.3	Very high	88.4	Confident	89 Å²	89	109.9 Å²	109.9	42%	0.416	52%	0.521	S	S	.	.	H	α-helix	trans	-65.1	-41.6	176.3	-177.1	168.7	-152.5	0	0	112	R328 L329 Q330 R335 L336	R328-E332 WeakPolarHBondContact O-CB 3.5Å; R328-E332 PolarHBondContact O-N 3.36Å; L329-E332 PolarHBondContact O-N 3.49Å; Q330-E332 VanDerWaalsContact C-N 3.33Å; Q330-E332 PolarHBondContact O-N 2.84Å; E332-R335 PolarHBondContact O-N 2.81Å; E332-L336 HydrophobicContact CG-CD1 4.46Å; E332-L336 WeakPolarHBondContact O-CG 3.32Å; E332-L336 PolarHBondContact O-N 3.28Å
333	K	91.1	Very high	86.9	Confident	124 Å²	124	112.7 Å²	112.7	54%	0.539	53%	0.53	S	S	.	.	H	α-helix	trans	-62.5	-42.4	175	-173.7	179.7	179.8	-178.4	0	111.9	L329 Q330 L336 R337	L329-K333 VanDerWaalsContact O-CB 3.3Å; L329-K333 WeakPolarHBondContact O-CB 3.47Å; L329-K333 PolarHBondContact O-N 3.49Å; Q330-K333 WeakPolarHBondContact O-CB 3.26Å; Q330-K333 PolarHBondContact O-N 3.27Å; K333-L336 PolarHBondContact O-N 3.28Å; K333-R337 PolarHBondContact O-N 3.38Å
334	D	90.6	Very high	85.3	Confident	56 Å²	56	115.5 Å²	115.5	30%	0.299	55%	0.548	S	S	.	.	H	α-helix	trans	-69.4	-38.3	177.6	-67.9	-26.3	0	0	0	111.2	Q330 V331 L336 R337 I338	Q330-D334 PolarHBondContact NE2-OD1 3.08Å; Q330-D334 PolarHBondContact NE2-OD2 2.97Å; Q330-D334 PolarHBondContact O-N 3.02Å; V331-D334 PolarHBondContact O-N 3.5Å; D334-L336 PolarHBondContact O-N 3.49Å; D334-R337 WeakPolarHBondContact O-CB 3.39Å; D334-R337 PolarHBondContact O-N 3.19Å; D334-I338 WeakPolarHBondContact O-CG1 3.45Å; D334-I338 PolarHBondContact O-N 3.21Å
335	R	90.1	Very high	83.3	Confident	161 Å²	161	121.9 Å²	121.9	61%	0.608	58%	0.575	S	S	*	*	H	α-helix	trans	-59.1	-45.7	171.3	179.3	-175.1	168	-165.4	-1.7	111.9	V331 E332 R337 I338 Q339	V331-R335 WeakPolarHBondContact O-CB 3.48Å; V331-R335 PolarHBondContact O-N 3.08Å; E332-R335 PolarHBondContact O-N 2.81Å; R335-R337 VanDerWaalsContact C-N 3.31Å; R335-R337 PolarHBondContact O-N 3.1Å; R335-I338 PolarHBondContact O-N 2.73Å; R335-Q339 WeakPolarHBondContact O-CG 3.34Å; R335-Q339 PolarHBondContact O-N 3.5Å
336	L	89.2	Confident	82.9	Confident	89 Å²	89	123.1 Å²	123.1	47%	0.466	58%	0.581	S	S	.	*	H	α-helix	trans	-65.3	-35.2	177	-74.1	171.7	0	0	0	111.9	E332 K333 D334 Q339 K340	E332-L336 HydrophobicContact CG-CD1 4.46Å; E332-L336 WeakPolarHBondContact O-CG 3.32Å; E332-L336 PolarHBondContact O-N 3.28Å; K333-L336 PolarHBondContact O-N 3.28Å; D334-L336 PolarHBondContact O-N 3.49Å; L336-Q339 PolarHBondContact O-N 2.97Å; L336-K340 WeakPolarHBondContact O-CG 3.34Å; L336-K340 PolarHBondContact O-N 3.37Å
337	R	87.1	Confident	82.5	Confident	133 Å²	133	122 Å²	122	50%	0.502	58%	0.579	S	S	.	*	H	α-helix	trans	-63.2	-48.3	173.7	-171.7	-172.2	-64	165.1	3.1	111.1	K333 D334 R335 Q339 K340 E341	K333-R337 PolarHBondContact O-N 3.38Å; D334-R337 WeakPolarHBondContact O-CB 3.39Å; D334-R337 PolarHBondContact O-N 3.19Å; R335-R337 VanDerWaalsContact C-N 3.31Å; R335-R337 PolarHBondContact O-N 3.1Å; R337-Q339 VanDerWaalsContact C-N 3.34Å; R337-Q339 PolarHBondContact O-N 3.46Å; R337-K340 PolarHBondContact O-N 3.06Å; R337-E341 WeakPolarHBondContact CG-OE1 3.49Å; R337-E341 PolarHBondContact O-N 3.49Å
338	I	86.5	Confident	82	Confident	116 Å²	116	122.8 Å²	122.8	60%	0.595	58%	0.583	S	S	*	*	H	α-helix	trans	-62.2	-40.5	177.8	-65.2	164.6	0	0	0	111.1	D334 R335 K340 E341 G342	D334-I338 WeakPolarHBondContact O-CG1 3.45Å; D334-I338 PolarHBondContact O-N 3.21Å; R335-I338 PolarHBondContact O-N 2.73Å; I338-K340 VanDerWaalsContact C-N 3.34Å; I338-K340 PolarHBondContact O-N 2.91Å; I338-E341 PolarHBondContact O-N 3.46Å; I338-G342 PolarHBondContact O-N 3.41Å
339	Q	82.7	Confident	81.3	Confident	97 Å²	97	119.9 Å²	119.9	45%	0.453	58%	0.579	S	S	.	*	H	α-helix	trans	-63.4	-38.8	175.1	-78.2	-175.2	-18.7	0	0	112.5	R335 L336 R337 H343	R335-Q339 WeakPolarHBondContact O-CG 3.34Å; R335-Q339 PolarHBondContact O-N 3.5Å; L336-Q339 PolarHBondContact O-N 2.97Å; R337-Q339 VanDerWaalsContact C-N 3.34Å; R337-Q339 PolarHBondContact O-N 3.46Å; Q339-H343 PolarHBondContact O-N 2.91Å
340	K	82.5	Confident	80.6	Confident	156 Å²	156	121.3 Å²	121.3	68%	0.678	58%	0.584	S	S	*	*	H	α-helix	trans	-66.6	-44.4	174.5	-76	-176.4	178.1	-170.8	0	111.8	L336 R337 I338 H343 L344	L336-K340 WeakPolarHBondContact O-CG 3.34Å; L336-K340 PolarHBondContact O-N 3.37Å; R337-K340 PolarHBondContact O-N 3.06Å; I338-K340 VanDerWaalsContact C-N 3.34Å; I338-K340 PolarHBondContact O-N 2.91Å; K340-H343 PolarHBondContact O-N 3.34Å; K340-L344 WeakPolarHBondContact O-CD1 3.29Å; K340-L344 PolarHBondContact O-N 3.23Å
341	E	80.7	Confident	79.9	Confident	120 Å²	120	123.3 Å²	123.3	56%	0.561	59%	0.594	S	S	*	*	H	α-helix	trans	-68.9	-38.6	178.9	-73.2	173	-168	0	0	112.4	R337 I338 H343 L344 Q345	R337-E341 WeakPolarHBondContact CG-OE1 3.49Å; R337-E341 PolarHBondContact O-N 3.49Å; I338-E341 PolarHBondContact O-N 3.46Å; E341-H343 VanDerWaalsContact C-N 3.27Å; E341-H343 PolarHBondContact O-N 3.44Å; E341-L344 PolarHBondContact O-N 3.34Å; E341-Q345 PolarHBondContact O-N 3.25Å
342	G	70.9	Confident	79	Confident	46 Å²	46	124.8 Å²	124.8	47%	0.474	59%	0.592	S	S	.	*	H	α-helix	trans	-72.7	-13	176.8	0	0	0	0	0	114.8	I338	I338-G342 PolarHBondContact O-N 3.41Å
343	H	58.5	Low	78	Confident	171 Å²	171	127.5 Å²	127.5	79%	0.792	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-7.1	167	-85.7	-3	0	0	0	113.2	Q339 K340 E341	Q339-H343 PolarHBondContact O-N 2.91Å; K340-H343 PolarHBondContact O-N 3.34Å; E341-H343 VanDerWaalsContact C-N 3.27Å; E341-H343 PolarHBondContact O-N 3.44Å
344	L	56.6	Low	76.9	Confident	155 Å²	155	127.8 Å²	127.8	81%	0.812	61%	0.611	S	S	*	*			trans	-100.9	-3.7	176.7	-95.5	87.7	0	0	0	113.7	K340 E341	K340-L344 WeakPolarHBondContact O-CD1 3.29Å; K340-L344 PolarHBondContact O-N 3.23Å; E341-L344 PolarHBondContact O-N 3.34Å
345	Q	47.8	Very low	75.7	Confident	234 Å²	234	134.4 Å²	134.4	100%	1.093	64%	0.639	S	S	*	*			trans	-99.2	0	166	-70.4	-175.1	-0.5	0	0	109.7	E341	E341-Q345 PolarHBondContact O-N 3.25Å

Retrieved 345 of 345 residues in 216 ms (Link to these results)

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